"
+ ],
+ "text/plain": [
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb \\\n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 0 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 35 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 32 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 35 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 35 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 34 \n",
+ "\n",
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb \\\n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 0 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 39 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 35 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 36 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 29 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 34 \n",
+ "\n",
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb \\\n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 35 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 39 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 0 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 32 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 40 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 36 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 34 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 34 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 36 \n",
+ "\n",
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb \\\n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 32 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 32 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 0 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 39 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 39 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 31 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 34 \n",
+ "\n",
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb \\\n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 35 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 40 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 0 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 39 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 36 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 34 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 38 \n",
+ "\n",
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb \\\n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 35 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 36 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 39 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 39 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 0 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 31 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 36 \n",
+ "\n",
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb \\\n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 36 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 39 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 36 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 0 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 31 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 33 \n",
+ "\n",
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb \\\n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 34 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 31 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 34 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 0 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 38 \n",
+ "\n",
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb \\\n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 35 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 29 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 34 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 31 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 31 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 37 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 0 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 33 \n",
+ "\n",
+ " EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb 34 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb 34 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb 36 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb 34 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb 36 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb 38 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb 33 \n",
+ "EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb 0 "
+ ]
+ },
+ "execution_count": 63,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# 根据rules进行读取:\n",
+ "# 定义description, description是一个字典格式;\n",
+ "rules = {'sequence': 'A'}\n",
+ "\n",
+ "# 根据rules进行读取:\n",
+ "silent_file = './data/design_result.silent'\n",
+ "df = parse_rosetta_file(silent_file, rules)\n",
+ "\n",
+ "# 产生距离矩阵\n",
+ "df.sequence_distance('A')"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "id": "cf266a84-8d13-4b6b-b925-41a8ccd2ba41",
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ }
+ ],
+ "metadata": {
+ "kernelspec": {
+ "display_name": "Python 3",
+ "language": "python",
+ "name": "python3"
+ },
+ "language_info": {
+ "codemirror_mode": {
+ "name": "ipython",
+ "version": 3
+ },
+ "file_extension": ".py",
+ "mimetype": "text/x-python",
+ "name": "python",
+ "nbconvert_exporter": "python",
+ "pygments_lexer": "ipython3",
+ "version": "3.7.10"
+ }
+ },
+ "nbformat": 4,
+ "nbformat_minor": 5
+}
diff --git a/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb
new file mode 100644
index 0000000..9ca38cb
--- /dev/null
+++ b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb
@@ -0,0 +1,768 @@
+HEADER 31-AUG-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 31-AUG-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.31+release.c7009b3115c
+ATOM 1 N SER A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA SER A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C SER A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O SER A 1 1.536 2.280 -0.744 1.00 0.00 O
+ATOM 5 CB SER A 1 1.980 -0.754 -1.207 1.00 0.00 C
+ATOM 6 OG SER A 1 1.621 -2.108 -1.148 1.00 0.00 O
+ATOM 7 1H SER A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 8 2H SER A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 9 3H SER A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 10 HA SER A 1 1.804 -0.502 0.905 1.00 0.00 H
+ATOM 11 1HB SER A 1 1.578 -0.308 -2.117 1.00 0.00 H
+ATOM 12 2HB SER A 1 3.065 -0.665 -1.251 1.00 0.00 H
+ATOM 13 HG SER A 1 1.958 -2.507 -1.953 1.00 0.00 H
+ATOM 14 N VAL A 2 3.011 1.661 0.839 1.00 0.00 N
+ATOM 15 CA VAL A 2 3.533 3.007 1.043 1.00 0.00 C
+ATOM 16 C VAL A 2 4.160 3.554 -0.233 1.00 0.00 C
+ATOM 17 O VAL A 2 3.936 4.707 -0.601 1.00 0.00 O
+ATOM 18 CB VAL A 2 4.584 3.007 2.169 1.00 0.00 C
+ATOM 19 CG1 VAL A 2 5.286 4.355 2.241 1.00 0.00 C
+ATOM 20 CG2 VAL A 2 3.921 2.673 3.496 1.00 0.00 C
+ATOM 21 H VAL A 2 3.422 0.891 1.348 1.00 0.00 H
+ATOM 22 HA VAL A 2 2.707 3.658 1.334 1.00 0.00 H
+ATOM 23 HB VAL A 2 5.345 2.260 1.943 1.00 0.00 H
+ATOM 24 1HG1 VAL A 2 6.026 4.337 3.042 1.00 0.00 H
+ATOM 25 2HG1 VAL A 2 5.784 4.557 1.293 1.00 0.00 H
+ATOM 26 3HG1 VAL A 2 4.553 5.137 2.442 1.00 0.00 H
+ATOM 27 1HG2 VAL A 2 4.669 2.674 4.288 1.00 0.00 H
+ATOM 28 2HG2 VAL A 2 3.156 3.417 3.719 1.00 0.00 H
+ATOM 29 3HG2 VAL A 2 3.460 1.686 3.434 1.00 0.00 H
+ATOM 30 N GLU A 3 4.946 2.720 -0.905 1.00 0.00 N
+ATOM 31 CA GLU A 3 5.662 3.139 -2.104 1.00 0.00 C
+ATOM 32 C GLU A 3 4.695 3.524 -3.216 1.00 0.00 C
+ATOM 33 O GLU A 3 4.924 4.489 -3.945 1.00 0.00 O
+ATOM 34 CB GLU A 3 6.593 2.025 -2.586 1.00 0.00 C
+ATOM 35 CG GLU A 3 7.709 1.672 -1.613 1.00 0.00 C
+ATOM 36 CD GLU A 3 7.248 0.779 -0.494 1.00 0.00 C
+ATOM 37 OE1 GLU A 3 6.099 0.408 -0.491 1.00 0.00 O
+ATOM 38 OE2 GLU A 3 8.047 0.467 0.357 1.00 0.00 O
+ATOM 39 H GLU A 3 5.051 1.770 -0.576 1.00 0.00 H
+ATOM 40 HA GLU A 3 6.273 4.008 -1.856 1.00 0.00 H
+ATOM 41 1HB GLU A 3 6.013 1.121 -2.772 1.00 0.00 H
+ATOM 42 2HB GLU A 3 7.054 2.319 -3.530 1.00 0.00 H
+ATOM 43 1HG GLU A 3 8.507 1.170 -2.158 1.00 0.00 H
+ATOM 44 2HG GLU A 3 8.115 2.591 -1.193 1.00 0.00 H
+ATOM 45 N GLU A 4 3.614 2.762 -3.342 1.00 0.00 N
+ATOM 46 CA GLU A 4 2.614 3.016 -4.373 1.00 0.00 C
+ATOM 47 C GLU A 4 1.909 4.346 -4.142 1.00 0.00 C
+ATOM 48 O GLU A 4 1.634 5.086 -5.086 1.00 0.00 O
+ATOM 49 CB GLU A 4 1.587 1.882 -4.410 1.00 0.00 C
+ATOM 50 CG GLU A 4 2.128 0.559 -4.934 1.00 0.00 C
+ATOM 51 CD GLU A 4 1.107 -0.543 -4.906 1.00 0.00 C
+ATOM 52 OE1 GLU A 4 0.061 -0.344 -4.335 1.00 0.00 O
+ATOM 53 OE2 GLU A 4 1.372 -1.586 -5.456 1.00 0.00 O
+ATOM 54 H GLU A 4 3.480 1.988 -2.708 1.00 0.00 H
+ATOM 55 HA GLU A 4 3.116 3.050 -5.341 1.00 0.00 H
+ATOM 56 1HB GLU A 4 1.198 1.711 -3.407 1.00 0.00 H
+ATOM 57 2HB GLU A 4 0.747 2.173 -5.042 1.00 0.00 H
+ATOM 58 1HG GLU A 4 2.468 0.698 -5.959 1.00 0.00 H
+ATOM 59 2HG GLU A 4 2.988 0.267 -4.332 1.00 0.00 H
+ATOM 60 N ILE A 5 1.619 4.644 -2.880 1.00 0.00 N
+ATOM 61 CA ILE A 5 0.958 5.893 -2.520 1.00 0.00 C
+ATOM 62 C ILE A 5 1.821 7.096 -2.880 1.00 0.00 C
+ATOM 63 O ILE A 5 1.329 8.083 -3.428 1.00 0.00 O
+ATOM 64 CB ILE A 5 0.631 5.928 -1.016 1.00 0.00 C
+ATOM 65 CG1 ILE A 5 -0.435 4.881 -0.678 1.00 0.00 C
+ATOM 66 CG2 ILE A 5 0.167 7.316 -0.605 1.00 0.00 C
+ATOM 67 CD1 ILE A 5 -0.569 4.604 0.802 1.00 0.00 C
+ATOM 68 H ILE A 5 1.863 3.989 -2.151 1.00 0.00 H
+ATOM 69 HA ILE A 5 0.019 5.959 -3.070 1.00 0.00 H
+ATOM 70 HB ILE A 5 1.521 5.668 -0.444 1.00 0.00 H
+ATOM 71 1HG1 ILE A 5 -1.402 5.213 -1.052 1.00 0.00 H
+ATOM 72 2HG1 ILE A 5 -0.195 3.943 -1.179 1.00 0.00 H
+ATOM 73 1HG2 ILE A 5 -0.061 7.323 0.461 1.00 0.00 H
+ATOM 74 2HG2 ILE A 5 0.955 8.039 -0.811 1.00 0.00 H
+ATOM 75 3HG2 ILE A 5 -0.727 7.583 -1.169 1.00 0.00 H
+ATOM 76 1HD1 ILE A 5 -1.343 3.852 0.963 1.00 0.00 H
+ATOM 77 2HD1 ILE A 5 0.381 4.236 1.192 1.00 0.00 H
+ATOM 78 3HD1 ILE A 5 -0.843 5.521 1.321 1.00 0.00 H
+ATOM 79 N VAL A 6 3.109 7.008 -2.570 1.00 0.00 N
+ATOM 80 CA VAL A 6 4.049 8.076 -2.890 1.00 0.00 C
+ATOM 81 C VAL A 6 4.193 8.250 -4.396 1.00 0.00 C
+ATOM 82 O VAL A 6 4.208 9.371 -4.903 1.00 0.00 O
+ATOM 83 CB VAL A 6 5.430 7.774 -2.277 1.00 0.00 C
+ATOM 84 CG1 VAL A 6 6.468 8.760 -2.792 1.00 0.00 C
+ATOM 85 CG2 VAL A 6 5.344 7.825 -0.759 1.00 0.00 C
+ATOM 86 H VAL A 6 3.447 6.180 -2.100 1.00 0.00 H
+ATOM 87 HA VAL A 6 3.673 9.007 -2.465 1.00 0.00 H
+ATOM 88 HB VAL A 6 5.747 6.780 -2.591 1.00 0.00 H
+ATOM 89 1HG1 VAL A 6 7.438 8.532 -2.349 1.00 0.00 H
+ATOM 90 2HG1 VAL A 6 6.538 8.681 -3.877 1.00 0.00 H
+ATOM 91 3HG1 VAL A 6 6.175 9.773 -2.519 1.00 0.00 H
+ATOM 92 1HG2 VAL A 6 6.324 7.610 -0.332 1.00 0.00 H
+ATOM 93 2HG2 VAL A 6 5.021 8.818 -0.446 1.00 0.00 H
+ATOM 94 3HG2 VAL A 6 4.626 7.083 -0.410 1.00 0.00 H
+ATOM 95 N LYS A 7 4.298 7.133 -5.108 1.00 0.00 N
+ATOM 96 CA LYS A 7 4.429 7.159 -6.560 1.00 0.00 C
+ATOM 97 C LYS A 7 3.223 7.824 -7.210 1.00 0.00 C
+ATOM 98 O LYS A 7 3.365 8.608 -8.149 1.00 0.00 O
+ATOM 99 CB LYS A 7 4.608 5.742 -7.108 1.00 0.00 C
+ATOM 100 CG LYS A 7 5.982 5.138 -6.853 1.00 0.00 C
+ATOM 101 CD LYS A 7 6.055 3.701 -7.349 1.00 0.00 C
+ATOM 102 CE LYS A 7 7.416 3.084 -7.065 1.00 0.00 C
+ATOM 103 NZ LYS A 7 7.498 1.675 -7.534 1.00 0.00 N
+ATOM 104 H LYS A 7 4.287 6.242 -4.632 1.00 0.00 H
+ATOM 105 HA LYS A 7 5.323 7.729 -6.817 1.00 0.00 H
+ATOM 106 1HB LYS A 7 3.864 5.083 -6.660 1.00 0.00 H
+ATOM 107 2HB LYS A 7 4.438 5.744 -8.185 1.00 0.00 H
+ATOM 108 1HG LYS A 7 6.741 5.729 -7.366 1.00 0.00 H
+ATOM 109 2HG LYS A 7 6.195 5.155 -5.784 1.00 0.00 H
+ATOM 110 1HD LYS A 7 5.285 3.106 -6.855 1.00 0.00 H
+ATOM 111 2HD LYS A 7 5.873 3.678 -8.423 1.00 0.00 H
+ATOM 112 1HE LYS A 7 8.190 3.666 -7.564 1.00 0.00 H
+ATOM 113 2HE LYS A 7 7.610 3.108 -5.992 1.00 0.00 H
+ATOM 114 1HZ LYS A 7 8.414 1.303 -7.327 1.00 0.00 H
+ATOM 115 2HZ LYS A 7 6.796 1.121 -7.063 1.00 0.00 H
+ATOM 116 3HZ LYS A 7 7.339 1.642 -8.531 1.00 0.00 H
+ATOM 117 N LYS A 8 2.035 7.506 -6.706 1.00 0.00 N
+ATOM 118 CA LYS A 8 0.807 8.123 -7.191 1.00 0.00 C
+ATOM 119 C LYS A 8 0.783 9.616 -6.889 1.00 0.00 C
+ATOM 120 O LYS A 8 0.356 10.420 -7.717 1.00 0.00 O
+ATOM 121 CB LYS A 8 -0.415 7.442 -6.573 1.00 0.00 C
+ATOM 122 CG LYS A 8 -0.695 6.045 -7.109 1.00 0.00 C
+ATOM 123 CD LYS A 8 -1.867 5.399 -6.385 1.00 0.00 C
+ATOM 124 CE LYS A 8 -2.122 3.987 -6.891 1.00 0.00 C
+ATOM 125 NZ LYS A 8 -3.233 3.325 -6.156 1.00 0.00 N
+ATOM 126 H LYS A 8 1.983 6.819 -5.967 1.00 0.00 H
+ATOM 127 HA LYS A 8 0.753 7.984 -8.271 1.00 0.00 H
+ATOM 128 1HB LYS A 8 -0.282 7.366 -5.493 1.00 0.00 H
+ATOM 129 2HB LYS A 8 -1.301 8.052 -6.751 1.00 0.00 H
+ATOM 130 1HG LYS A 8 -0.924 6.102 -8.174 1.00 0.00 H
+ATOM 131 2HG LYS A 8 0.189 5.421 -6.979 1.00 0.00 H
+ATOM 132 1HD LYS A 8 -1.658 5.361 -5.315 1.00 0.00 H
+ATOM 133 2HD LYS A 8 -2.765 5.998 -6.540 1.00 0.00 H
+ATOM 134 1HE LYS A 8 -2.373 4.020 -7.950 1.00 0.00 H
+ATOM 135 2HE LYS A 8 -1.218 3.390 -6.773 1.00 0.00 H
+ATOM 136 1HZ LYS A 8 -3.370 2.392 -6.520 1.00 0.00 H
+ATOM 137 2HZ LYS A 8 -3.003 3.271 -5.173 1.00 0.00 H
+ATOM 138 3HZ LYS A 8 -4.082 3.859 -6.274 1.00 0.00 H
+ATOM 139 N MET A 9 1.245 9.981 -5.698 1.00 0.00 N
+ATOM 140 CA MET A 9 1.370 11.384 -5.321 1.00 0.00 C
+ATOM 141 C MET A 9 2.290 12.131 -6.277 1.00 0.00 C
+ATOM 142 O MET A 9 1.985 13.245 -6.705 1.00 0.00 O
+ATOM 143 CB MET A 9 1.882 11.501 -3.887 1.00 0.00 C
+ATOM 144 CG MET A 9 2.161 12.927 -3.433 1.00 0.00 C
+ATOM 145 SD MET A 9 3.815 13.489 -3.884 1.00 0.00 S
+ATOM 146 CE MET A 9 4.818 12.537 -2.747 1.00 0.00 C
+ATOM 147 H MET A 9 1.518 9.268 -5.036 1.00 0.00 H
+ATOM 148 HA MET A 9 0.380 11.841 -5.358 1.00 0.00 H
+ATOM 149 1HB MET A 9 1.151 11.071 -3.203 1.00 0.00 H
+ATOM 150 2HB MET A 9 2.805 10.930 -3.782 1.00 0.00 H
+ATOM 151 1HG MET A 9 1.434 13.602 -3.883 1.00 0.00 H
+ATOM 152 2HG MET A 9 2.060 12.991 -2.350 1.00 0.00 H
+ATOM 153 1HE MET A 9 5.870 12.774 -2.903 1.00 0.00 H
+ATOM 154 2HE MET A 9 4.538 12.782 -1.722 1.00 0.00 H
+ATOM 155 3HE MET A 9 4.656 11.472 -2.922 1.00 0.00 H
+ATOM 156 N ILE A 10 3.418 11.513 -6.609 1.00 0.00 N
+ATOM 157 CA ILE A 10 4.393 12.125 -7.504 1.00 0.00 C
+ATOM 158 C ILE A 10 3.804 12.346 -8.892 1.00 0.00 C
+ATOM 159 O ILE A 10 3.994 13.401 -9.497 1.00 0.00 O
+ATOM 160 CB ILE A 10 5.659 11.256 -7.615 1.00 0.00 C
+ATOM 161 CG1 ILE A 10 6.411 11.235 -6.282 1.00 0.00 C
+ATOM 162 CG2 ILE A 10 6.559 11.767 -8.730 1.00 0.00 C
+ATOM 163 CD1 ILE A 10 7.454 10.146 -6.187 1.00 0.00 C
+ATOM 164 H ILE A 10 3.605 10.595 -6.232 1.00 0.00 H
+ATOM 165 HA ILE A 10 4.684 13.092 -7.090 1.00 0.00 H
+ATOM 166 HB ILE A 10 5.375 10.227 -7.834 1.00 0.00 H
+ATOM 167 1HG1 ILE A 10 6.903 12.194 -6.127 1.00 0.00 H
+ATOM 168 2HG1 ILE A 10 5.701 11.098 -5.466 1.00 0.00 H
+ATOM 169 1HG2 ILE A 10 7.449 11.142 -8.794 1.00 0.00 H
+ATOM 170 2HG2 ILE A 10 6.021 11.732 -9.676 1.00 0.00 H
+ATOM 171 3HG2 ILE A 10 6.852 12.796 -8.518 1.00 0.00 H
+ATOM 172 1HD1 ILE A 10 7.944 10.195 -5.214 1.00 0.00 H
+ATOM 173 2HD1 ILE A 10 6.976 9.172 -6.304 1.00 0.00 H
+ATOM 174 3HD1 ILE A 10 8.196 10.283 -6.972 1.00 0.00 H
+ATOM 175 N LYS A 11 3.088 11.345 -9.391 1.00 0.00 N
+ATOM 176 CA LYS A 11 2.404 11.457 -10.674 1.00 0.00 C
+ATOM 177 C LYS A 11 1.409 12.611 -10.668 1.00 0.00 C
+ATOM 178 O LYS A 11 1.392 13.434 -11.583 1.00 0.00 O
+ATOM 179 CB LYS A 11 1.690 10.149 -11.017 1.00 0.00 C
+ATOM 180 CG LYS A 11 0.976 10.156 -12.362 1.00 0.00 C
+ATOM 181 CD LYS A 11 0.343 8.804 -12.659 1.00 0.00 C
+ATOM 182 CE LYS A 11 -0.408 8.822 -13.982 1.00 0.00 C
+ATOM 183 NZ LYS A 11 -1.032 7.506 -14.285 1.00 0.00 N
+ATOM 184 H LYS A 11 3.016 10.483 -8.869 1.00 0.00 H
+ATOM 185 HA LYS A 11 3.149 11.642 -11.449 1.00 0.00 H
+ATOM 186 1HB LYS A 11 2.412 9.332 -11.025 1.00 0.00 H
+ATOM 187 2HB LYS A 11 0.951 9.925 -10.247 1.00 0.00 H
+ATOM 188 1HG LYS A 11 0.196 10.919 -12.357 1.00 0.00 H
+ATOM 189 2HG LYS A 11 1.688 10.395 -13.151 1.00 0.00 H
+ATOM 190 1HD LYS A 11 1.121 8.040 -12.702 1.00 0.00 H
+ATOM 191 2HD LYS A 11 -0.352 8.545 -11.861 1.00 0.00 H
+ATOM 192 1HE LYS A 11 -1.188 9.581 -13.947 1.00 0.00 H
+ATOM 193 2HE LYS A 11 0.281 9.077 -14.788 1.00 0.00 H
+ATOM 194 1HZ LYS A 11 -1.519 7.559 -15.169 1.00 0.00 H
+ATOM 195 2HZ LYS A 11 -0.315 6.796 -14.339 1.00 0.00 H
+ATOM 196 3HZ LYS A 11 -1.687 7.267 -13.555 1.00 0.00 H
+ATOM 197 N LYS A 12 0.579 12.665 -9.631 1.00 0.00 N
+ATOM 198 CA LYS A 12 -0.406 13.731 -9.493 1.00 0.00 C
+ATOM 199 C LYS A 12 0.269 15.086 -9.324 1.00 0.00 C
+ATOM 200 O LYS A 12 -0.233 16.104 -9.801 1.00 0.00 O
+ATOM 201 CB LYS A 12 -1.333 13.453 -8.308 1.00 0.00 C
+ATOM 202 CG LYS A 12 -2.305 12.301 -8.527 1.00 0.00 C
+ATOM 203 CD LYS A 12 -3.163 12.061 -7.293 1.00 0.00 C
+ATOM 204 CE LYS A 12 -4.129 10.905 -7.507 1.00 0.00 C
+ATOM 205 NZ LYS A 12 -4.960 10.643 -6.300 1.00 0.00 N
+ATOM 206 H LYS A 12 0.633 11.949 -8.920 1.00 0.00 H
+ATOM 207 HA LYS A 12 -1.018 13.755 -10.395 1.00 0.00 H
+ATOM 208 1HB LYS A 12 -0.736 13.224 -7.425 1.00 0.00 H
+ATOM 209 2HB LYS A 12 -1.917 14.346 -8.086 1.00 0.00 H
+ATOM 210 1HG LYS A 12 -2.955 12.529 -9.372 1.00 0.00 H
+ATOM 211 2HG LYS A 12 -1.748 11.393 -8.754 1.00 0.00 H
+ATOM 212 1HD LYS A 12 -2.520 11.834 -6.442 1.00 0.00 H
+ATOM 213 2HD LYS A 12 -3.734 12.961 -7.066 1.00 0.00 H
+ATOM 214 1HE LYS A 12 -4.787 11.131 -8.344 1.00 0.00 H
+ATOM 215 2HE LYS A 12 -3.568 10.002 -7.748 1.00 0.00 H
+ATOM 216 1HZ LYS A 12 -5.585 9.871 -6.482 1.00 0.00 H
+ATOM 217 2HZ LYS A 12 -4.359 10.414 -5.521 1.00 0.00 H
+ATOM 218 3HZ LYS A 12 -5.499 11.468 -6.078 1.00 0.00 H
+ATOM 219 N ALA A 13 1.408 15.093 -8.641 1.00 0.00 N
+ATOM 220 CA ALA A 13 2.153 16.324 -8.405 1.00 0.00 C
+ATOM 221 C ALA A 13 3.280 16.488 -9.417 1.00 0.00 C
+ATOM 222 O ALA A 13 4.218 17.254 -9.196 1.00 0.00 O
+ATOM 223 CB ALA A 13 2.707 16.346 -6.988 1.00 0.00 C
+ATOM 224 H ALA A 13 1.768 14.223 -8.275 1.00 0.00 H
+ATOM 225 HA ALA A 13 1.474 17.168 -8.528 1.00 0.00 H
+ATOM 226 1HB ALA A 13 3.260 17.271 -6.828 1.00 0.00 H
+ATOM 227 2HB ALA A 13 1.884 16.286 -6.275 1.00 0.00 H
+ATOM 228 3HB ALA A 13 3.372 15.496 -6.845 1.00 0.00 H
+ATOM 229 N SER A 14 3.183 15.764 -10.526 1.00 0.00 N
+ATOM 230 CA SER A 14 4.191 15.832 -11.577 1.00 0.00 C
+ATOM 231 C SER A 14 4.439 17.271 -12.011 1.00 0.00 C
+ATOM 232 O SER A 14 3.498 18.034 -12.227 1.00 0.00 O
+ATOM 233 CB SER A 14 3.759 15.001 -12.770 1.00 0.00 C
+ATOM 234 OG SER A 14 4.663 15.140 -13.832 1.00 0.00 O
+ATOM 235 H SER A 14 2.389 15.150 -10.645 1.00 0.00 H
+ATOM 236 HA SER A 14 5.126 15.426 -11.186 1.00 0.00 H
+ATOM 237 1HB SER A 14 3.694 13.953 -12.479 1.00 0.00 H
+ATOM 238 2HB SER A 14 2.767 15.315 -13.091 1.00 0.00 H
+ATOM 239 HG SER A 14 4.322 14.592 -14.543 1.00 0.00 H
+ATOM 240 N GLY A 15 5.710 17.635 -12.137 1.00 0.00 N
+ATOM 241 CA GLY A 15 6.086 19.005 -12.464 1.00 0.00 C
+ATOM 242 C GLY A 15 6.529 19.767 -11.222 1.00 0.00 C
+ATOM 243 O GLY A 15 7.124 20.840 -11.319 1.00 0.00 O
+ATOM 244 H GLY A 15 6.435 16.945 -12.002 1.00 0.00 H
+ATOM 245 1HA GLY A 15 6.893 18.996 -13.197 1.00 0.00 H
+ATOM 246 2HA GLY A 15 5.240 19.514 -12.925 1.00 0.00 H
+ATOM 247 N ALA A 16 6.235 19.206 -10.054 1.00 0.00 N
+ATOM 248 CA ALA A 16 6.668 19.793 -8.791 1.00 0.00 C
+ATOM 249 C ALA A 16 8.170 19.637 -8.598 1.00 0.00 C
+ATOM 250 O ALA A 16 8.793 18.750 -9.183 1.00 0.00 O
+ATOM 251 CB ALA A 16 5.916 19.161 -7.628 1.00 0.00 C
+ATOM 252 H ALA A 16 5.698 18.350 -10.040 1.00 0.00 H
+ATOM 253 HA ALA A 16 6.443 20.859 -8.819 1.00 0.00 H
+ATOM 254 1HB ALA A 16 6.251 19.609 -6.693 1.00 0.00 H
+ATOM 255 2HB ALA A 16 4.847 19.331 -7.750 1.00 0.00 H
+ATOM 256 3HB ALA A 16 6.113 18.090 -7.607 1.00 0.00 H
+ATOM 257 N SER A 17 8.749 20.504 -7.774 1.00 0.00 N
+ATOM 258 CA SER A 17 10.169 20.425 -7.453 1.00 0.00 C
+ATOM 259 C SER A 17 10.460 19.250 -6.529 1.00 0.00 C
+ATOM 260 O SER A 17 9.554 18.699 -5.905 1.00 0.00 O
+ATOM 261 CB SER A 17 10.629 21.716 -6.804 1.00 0.00 C
+ATOM 262 OG SER A 17 10.106 21.843 -5.510 1.00 0.00 O
+ATOM 263 H SER A 17 8.190 21.236 -7.359 1.00 0.00 H
+ATOM 264 HA SER A 17 10.725 20.278 -8.378 1.00 0.00 H
+ATOM 265 1HB SER A 17 11.718 21.734 -6.762 1.00 0.00 H
+ATOM 266 2HB SER A 17 10.312 22.562 -7.412 1.00 0.00 H
+ATOM 267 HG SER A 17 10.414 22.691 -5.182 1.00 0.00 H
+ATOM 268 N ARG A 18 11.731 18.870 -6.446 1.00 0.00 N
+ATOM 269 CA ARG A 18 12.148 17.772 -5.582 1.00 0.00 C
+ATOM 270 C ARG A 18 11.838 18.073 -4.121 1.00 0.00 C
+ATOM 271 O ARG A 18 11.460 17.181 -3.360 1.00 0.00 O
+ATOM 272 CB ARG A 18 13.637 17.504 -5.737 1.00 0.00 C
+ATOM 273 CG ARG A 18 14.152 16.293 -4.976 1.00 0.00 C
+ATOM 274 CD ARG A 18 15.533 15.931 -5.388 1.00 0.00 C
+ATOM 275 NE ARG A 18 15.572 15.391 -6.738 1.00 0.00 N
+ATOM 276 CZ ARG A 18 16.100 16.028 -7.801 1.00 0.00 C
+ATOM 277 NH1 ARG A 18 16.629 17.223 -7.656 1.00 0.00 N
+ATOM 278 NH2 ARG A 18 16.088 15.451 -8.990 1.00 0.00 N
+ATOM 279 H ARG A 18 12.426 19.355 -6.995 1.00 0.00 H
+ATOM 280 HA ARG A 18 11.604 16.874 -5.877 1.00 0.00 H
+ATOM 281 1HB ARG A 18 13.873 17.357 -6.790 1.00 0.00 H
+ATOM 282 2HB ARG A 18 14.201 18.373 -5.394 1.00 0.00 H
+ATOM 283 1HG ARG A 18 14.159 16.509 -3.908 1.00 0.00 H
+ATOM 284 2HG ARG A 18 13.502 15.439 -5.169 1.00 0.00 H
+ATOM 285 1HD ARG A 18 16.165 16.818 -5.357 1.00 0.00 H
+ATOM 286 2HD ARG A 18 15.930 15.178 -4.709 1.00 0.00 H
+ATOM 287 HE ARG A 18 15.175 14.474 -6.889 1.00 0.00 H
+ATOM 288 1HH1 ARG A 18 16.639 17.664 -6.748 1.00 0.00 H
+ATOM 289 2HH1 ARG A 18 17.025 17.700 -8.453 1.00 0.00 H
+ATOM 290 1HH2 ARG A 18 15.681 14.532 -9.102 1.00 0.00 H
+ATOM 291 2HH2 ARG A 18 16.483 15.928 -9.787 1.00 0.00 H
+ATOM 292 N GLU A 19 12.001 19.333 -3.734 1.00 0.00 N
+ATOM 293 CA GLU A 19 11.725 19.757 -2.367 1.00 0.00 C
+ATOM 294 C GLU A 19 10.248 19.601 -2.029 1.00 0.00 C
+ATOM 295 O GLU A 19 9.894 19.170 -0.932 1.00 0.00 O
+ATOM 296 CB GLU A 19 12.154 21.211 -2.162 1.00 0.00 C
+ATOM 297 CG GLU A 19 13.655 21.444 -2.262 1.00 0.00 C
+ATOM 298 CD GLU A 19 14.150 21.469 -3.681 1.00 0.00 C
+ATOM 299 OE1 GLU A 19 13.338 21.438 -4.574 1.00 0.00 O
+ATOM 300 OE2 GLU A 19 15.342 21.520 -3.873 1.00 0.00 O
+ATOM 301 H GLU A 19 12.323 20.016 -4.405 1.00 0.00 H
+ATOM 302 HA GLU A 19 12.306 19.133 -1.687 1.00 0.00 H
+ATOM 303 1HB GLU A 19 11.668 21.843 -2.905 1.00 0.00 H
+ATOM 304 2HB GLU A 19 11.828 21.552 -1.179 1.00 0.00 H
+ATOM 305 1HG GLU A 19 13.898 22.394 -1.787 1.00 0.00 H
+ATOM 306 2HG GLU A 19 14.171 20.655 -1.716 1.00 0.00 H
+ATOM 307 N GLN A 20 9.388 19.955 -2.979 1.00 0.00 N
+ATOM 308 CA GLN A 20 7.948 19.821 -2.798 1.00 0.00 C
+ATOM 309 C GLN A 20 7.544 18.359 -2.654 1.00 0.00 C
+ATOM 310 O GLN A 20 6.727 18.012 -1.801 1.00 0.00 O
+ATOM 311 CB GLN A 20 7.198 20.457 -3.972 1.00 0.00 C
+ATOM 312 CG GLN A 20 7.247 21.975 -3.992 1.00 0.00 C
+ATOM 313 CD GLN A 20 6.602 22.558 -5.235 1.00 0.00 C
+ATOM 314 OE1 GLN A 20 6.987 22.233 -6.362 1.00 0.00 O
+ATOM 315 NE2 GLN A 20 5.616 23.424 -5.038 1.00 0.00 N
+ATOM 316 H GLN A 20 9.742 20.326 -3.849 1.00 0.00 H
+ATOM 317 HA GLN A 20 7.662 20.353 -1.890 1.00 0.00 H
+ATOM 318 1HB GLN A 20 7.617 20.094 -4.910 1.00 0.00 H
+ATOM 319 2HB GLN A 20 6.152 20.154 -3.942 1.00 0.00 H
+ATOM 320 1HG GLN A 20 6.716 22.357 -3.120 1.00 0.00 H
+ATOM 321 2HG GLN A 20 8.289 22.295 -3.965 1.00 0.00 H
+ATOM 322 1HE2 GLN A 20 5.152 23.842 -5.820 1.00 0.00 H
+ATOM 323 2HE2 GLN A 20 5.335 23.660 -4.107 1.00 0.00 H
+ATOM 324 N ILE A 21 8.123 17.506 -3.492 1.00 0.00 N
+ATOM 325 CA ILE A 21 7.844 16.075 -3.442 1.00 0.00 C
+ATOM 326 C ILE A 21 8.324 15.466 -2.131 1.00 0.00 C
+ATOM 327 O ILE A 21 7.637 14.639 -1.532 1.00 0.00 O
+ATOM 328 CB ILE A 21 8.510 15.345 -4.623 1.00 0.00 C
+ATOM 329 CG1 ILE A 21 7.890 15.795 -5.948 1.00 0.00 C
+ATOM 330 CG2 ILE A 21 8.382 13.838 -4.456 1.00 0.00 C
+ATOM 331 CD1 ILE A 21 6.420 15.466 -6.077 1.00 0.00 C
+ATOM 332 H ILE A 21 8.771 17.857 -4.182 1.00 0.00 H
+ATOM 333 HA ILE A 21 6.766 15.929 -3.522 1.00 0.00 H
+ATOM 334 HB ILE A 21 9.567 15.608 -4.664 1.00 0.00 H
+ATOM 335 1HG1 ILE A 21 8.010 16.872 -6.058 1.00 0.00 H
+ATOM 336 2HG1 ILE A 21 8.418 15.322 -6.776 1.00 0.00 H
+ATOM 337 1HG2 ILE A 21 8.858 13.337 -5.299 1.00 0.00 H
+ATOM 338 2HG2 ILE A 21 8.869 13.532 -3.531 1.00 0.00 H
+ATOM 339 3HG2 ILE A 21 7.328 13.564 -4.419 1.00 0.00 H
+ATOM 340 1HD1 ILE A 21 6.053 15.816 -7.042 1.00 0.00 H
+ATOM 341 2HD1 ILE A 21 6.281 14.387 -6.006 1.00 0.00 H
+ATOM 342 3HD1 ILE A 21 5.866 15.957 -5.279 1.00 0.00 H
+ATOM 343 N LYS A 22 9.507 15.880 -1.691 1.00 0.00 N
+ATOM 344 CA LYS A 22 10.054 15.421 -0.419 1.00 0.00 C
+ATOM 345 C LYS A 22 9.106 15.730 0.732 1.00 0.00 C
+ATOM 346 O LYS A 22 8.809 14.863 1.554 1.00 0.00 O
+ATOM 347 CB LYS A 22 11.420 16.060 -0.162 1.00 0.00 C
+ATOM 348 CG LYS A 22 12.079 15.633 1.143 1.00 0.00 C
+ATOM 349 CD LYS A 22 13.461 16.251 1.292 1.00 0.00 C
+ATOM 350 CE LYS A 22 14.175 15.721 2.527 1.00 0.00 C
+ATOM 351 NZ LYS A 22 13.522 16.176 3.785 1.00 0.00 N
+ATOM 352 H LYS A 22 10.042 16.528 -2.251 1.00 0.00 H
+ATOM 353 HA LYS A 22 10.198 14.341 -0.474 1.00 0.00 H
+ATOM 354 1HB LYS A 22 12.099 15.809 -0.978 1.00 0.00 H
+ATOM 355 2HB LYS A 22 11.316 17.145 -0.145 1.00 0.00 H
+ATOM 356 1HG LYS A 22 11.458 15.945 1.983 1.00 0.00 H
+ATOM 357 2HG LYS A 22 12.171 14.547 1.165 1.00 0.00 H
+ATOM 358 1HD LYS A 22 14.060 16.021 0.410 1.00 0.00 H
+ATOM 359 2HD LYS A 22 13.368 17.334 1.375 1.00 0.00 H
+ATOM 360 1HE LYS A 22 14.176 14.632 2.507 1.00 0.00 H
+ATOM 361 2HE LYS A 22 15.209 16.064 2.525 1.00 0.00 H
+ATOM 362 1HZ LYS A 22 14.025 15.805 4.579 1.00 0.00 H
+ATOM 363 2HZ LYS A 22 13.532 17.186 3.823 1.00 0.00 H
+ATOM 364 3HZ LYS A 22 12.568 15.848 3.808 1.00 0.00 H
+ATOM 365 N LYS A 23 8.634 16.971 0.786 1.00 0.00 N
+ATOM 366 CA LYS A 23 7.719 17.397 1.838 1.00 0.00 C
+ATOM 367 C LYS A 23 6.427 16.591 1.804 1.00 0.00 C
+ATOM 368 O LYS A 23 5.917 16.174 2.844 1.00 0.00 O
+ATOM 369 CB LYS A 23 7.411 18.890 1.708 1.00 0.00 C
+ATOM 370 CG LYS A 23 8.567 19.806 2.088 1.00 0.00 C
+ATOM 371 CD LYS A 23 8.199 21.269 1.894 1.00 0.00 C
+ATOM 372 CE LYS A 23 9.360 22.185 2.254 1.00 0.00 C
+ATOM 373 NZ LYS A 23 9.023 23.619 2.044 1.00 0.00 N
+ATOM 374 H LYS A 23 8.916 17.636 0.080 1.00 0.00 H
+ATOM 375 HA LYS A 23 8.204 17.241 2.802 1.00 0.00 H
+ATOM 376 1HB LYS A 23 7.131 19.115 0.678 1.00 0.00 H
+ATOM 377 2HB LYS A 23 6.561 19.143 2.341 1.00 0.00 H
+ATOM 378 1HG LYS A 23 8.832 19.642 3.134 1.00 0.00 H
+ATOM 379 2HG LYS A 23 9.434 19.573 1.471 1.00 0.00 H
+ATOM 380 1HD LYS A 23 7.922 21.440 0.853 1.00 0.00 H
+ATOM 381 2HD LYS A 23 7.345 21.517 2.525 1.00 0.00 H
+ATOM 382 1HE LYS A 23 9.629 22.037 3.299 1.00 0.00 H
+ATOM 383 2HE LYS A 23 10.225 21.935 1.641 1.00 0.00 H
+ATOM 384 1HZ LYS A 23 9.817 24.192 2.293 1.00 0.00 H
+ATOM 385 2HZ LYS A 23 8.789 23.772 1.073 1.00 0.00 H
+ATOM 386 3HZ LYS A 23 8.234 23.869 2.623 1.00 0.00 H
+ATOM 387 N LEU A 24 5.901 16.376 0.603 1.00 0.00 N
+ATOM 388 CA LEU A 24 4.680 15.597 0.430 1.00 0.00 C
+ATOM 389 C LEU A 24 4.885 14.149 0.856 1.00 0.00 C
+ATOM 390 O LEU A 24 4.013 13.547 1.482 1.00 0.00 O
+ATOM 391 CB LEU A 24 4.224 15.646 -1.034 1.00 0.00 C
+ATOM 392 CG LEU A 24 3.690 17.000 -1.519 1.00 0.00 C
+ATOM 393 CD1 LEU A 24 3.583 16.989 -3.038 1.00 0.00 C
+ATOM 394 CD2 LEU A 24 2.337 17.271 -0.878 1.00 0.00 C
+ATOM 395 H LEU A 24 6.359 16.761 -0.211 1.00 0.00 H
+ATOM 396 HA LEU A 24 3.898 16.037 1.050 1.00 0.00 H
+ATOM 397 1HB LEU A 24 5.066 15.375 -1.669 1.00 0.00 H
+ATOM 398 2HB LEU A 24 3.435 14.908 -1.177 1.00 0.00 H
+ATOM 399 HG LEU A 24 4.389 17.788 -1.239 1.00 0.00 H
+ATOM 400 1HD1 LEU A 24 3.204 17.951 -3.383 1.00 0.00 H
+ATOM 401 2HD1 LEU A 24 4.568 16.812 -3.471 1.00 0.00 H
+ATOM 402 3HD1 LEU A 24 2.902 16.198 -3.349 1.00 0.00 H
+ATOM 403 1HD2 LEU A 24 1.958 18.234 -1.222 1.00 0.00 H
+ATOM 404 2HD2 LEU A 24 1.637 16.484 -1.158 1.00 0.00 H
+ATOM 405 3HD2 LEU A 24 2.446 17.291 0.206 1.00 0.00 H
+ATOM 406 N ALA A 25 6.043 13.595 0.513 1.00 0.00 N
+ATOM 407 CA ALA A 25 6.382 12.229 0.895 1.00 0.00 C
+ATOM 408 C ALA A 25 6.443 12.080 2.409 1.00 0.00 C
+ATOM 409 O ALA A 25 6.021 11.062 2.960 1.00 0.00 O
+ATOM 410 CB ALA A 25 7.706 11.817 0.269 1.00 0.00 C
+ATOM 411 H ALA A 25 6.706 14.134 -0.026 1.00 0.00 H
+ATOM 412 HA ALA A 25 5.612 11.561 0.508 1.00 0.00 H
+ATOM 413 1HB ALA A 25 7.945 10.795 0.563 1.00 0.00 H
+ATOM 414 2HB ALA A 25 7.629 11.873 -0.817 1.00 0.00 H
+ATOM 415 3HB ALA A 25 8.494 12.486 0.611 1.00 0.00 H
+ATOM 416 N GLU A 26 6.970 13.099 3.079 1.00 0.00 N
+ATOM 417 CA GLU A 26 7.060 13.095 4.534 1.00 0.00 C
+ATOM 418 C GLU A 26 5.678 13.132 5.172 1.00 0.00 C
+ATOM 419 O GLU A 26 5.442 12.503 6.203 1.00 0.00 O
+ATOM 420 CB GLU A 26 7.889 14.287 5.020 1.00 0.00 C
+ATOM 421 CG GLU A 26 9.377 14.182 4.719 1.00 0.00 C
+ATOM 422 CD GLU A 26 10.132 15.438 5.055 1.00 0.00 C
+ATOM 423 OE1 GLU A 26 9.517 16.377 5.501 1.00 0.00 O
+ATOM 424 OE2 GLU A 26 11.325 15.459 4.865 1.00 0.00 O
+ATOM 425 H GLU A 26 7.317 13.897 2.566 1.00 0.00 H
+ATOM 426 HA GLU A 26 7.566 12.181 4.847 1.00 0.00 H
+ATOM 427 1HB GLU A 26 7.517 15.201 4.557 1.00 0.00 H
+ATOM 428 2HB GLU A 26 7.773 14.395 6.098 1.00 0.00 H
+ATOM 429 1HG GLU A 26 9.796 13.356 5.293 1.00 0.00 H
+ATOM 430 2HG GLU A 26 9.508 13.957 3.661 1.00 0.00 H
+ATOM 431 N LYS A 27 4.765 13.873 4.552 1.00 0.00 N
+ATOM 432 CA LYS A 27 3.402 13.991 5.057 1.00 0.00 C
+ATOM 433 C LYS A 27 2.668 12.658 4.978 1.00 0.00 C
+ATOM 434 O LYS A 27 1.854 12.335 5.843 1.00 0.00 O
+ATOM 435 CB LYS A 27 2.634 15.061 4.279 1.00 0.00 C
+ATOM 436 CG LYS A 27 3.059 16.490 4.590 1.00 0.00 C
+ATOM 437 CD LYS A 27 2.258 17.494 3.774 1.00 0.00 C
+ATOM 438 CE LYS A 27 2.682 18.923 4.083 1.00 0.00 C
+ATOM 439 NZ LYS A 27 1.904 19.916 3.294 1.00 0.00 N
+ATOM 440 H LYS A 27 5.022 14.367 3.709 1.00 0.00 H
+ATOM 441 HA LYS A 27 3.446 14.305 6.100 1.00 0.00 H
+ATOM 442 1HB LYS A 27 2.765 14.898 3.209 1.00 0.00 H
+ATOM 443 2HB LYS A 27 1.569 14.974 4.496 1.00 0.00 H
+ATOM 444 1HG LYS A 27 2.908 16.693 5.650 1.00 0.00 H
+ATOM 445 2HG LYS A 27 4.118 16.612 4.362 1.00 0.00 H
+ATOM 446 1HD LYS A 27 2.406 17.301 2.711 1.00 0.00 H
+ATOM 447 2HD LYS A 27 1.198 17.383 4.001 1.00 0.00 H
+ATOM 448 1HE LYS A 27 2.536 19.124 5.143 1.00 0.00 H
+ATOM 449 2HE LYS A 27 3.741 19.045 3.854 1.00 0.00 H
+ATOM 450 1HZ LYS A 27 2.215 20.849 3.526 1.00 0.00 H
+ATOM 451 2HZ LYS A 27 2.047 19.750 2.307 1.00 0.00 H
+ATOM 452 3HZ LYS A 27 0.922 19.826 3.511 1.00 0.00 H
+ATOM 453 N ILE A 28 2.961 11.888 3.936 1.00 0.00 N
+ATOM 454 CA ILE A 28 2.351 10.576 3.757 1.00 0.00 C
+ATOM 455 C ILE A 28 2.828 9.597 4.822 1.00 0.00 C
+ATOM 456 O ILE A 28 4.029 9.395 4.999 1.00 0.00 O
+ATOM 457 CB ILE A 28 2.665 10.010 2.360 1.00 0.00 C
+ATOM 458 CG1 ILE A 28 2.040 10.891 1.274 1.00 0.00 C
+ATOM 459 CG2 ILE A 28 2.164 8.578 2.242 1.00 0.00 C
+ATOM 460 CD1 ILE A 28 2.580 10.625 -0.113 1.00 0.00 C
+ATOM 461 H ILE A 28 3.624 12.220 3.250 1.00 0.00 H
+ATOM 462 HA ILE A 28 1.271 10.682 3.851 1.00 0.00 H
+ATOM 463 HB ILE A 28 3.742 10.023 2.196 1.00 0.00 H
+ATOM 464 1HG1 ILE A 28 0.962 10.736 1.256 1.00 0.00 H
+ATOM 465 2HG1 ILE A 28 2.216 11.940 1.512 1.00 0.00 H
+ATOM 466 1HG2 ILE A 28 2.394 8.194 1.248 1.00 0.00 H
+ATOM 467 2HG2 ILE A 28 2.654 7.959 2.992 1.00 0.00 H
+ATOM 468 3HG2 ILE A 28 1.086 8.556 2.399 1.00 0.00 H
+ATOM 469 1HD1 ILE A 28 2.090 11.287 -0.827 1.00 0.00 H
+ATOM 470 2HD1 ILE A 28 3.655 10.808 -0.126 1.00 0.00 H
+ATOM 471 3HD1 ILE A 28 2.385 9.589 -0.386 1.00 0.00 H
+ATOM 472 N PRO A 29 1.880 8.991 5.528 1.00 0.00 N
+ATOM 473 CA PRO A 29 2.202 8.088 6.627 1.00 0.00 C
+ATOM 474 C PRO A 29 2.828 6.797 6.115 1.00 0.00 C
+ATOM 475 O PRO A 29 2.477 6.310 5.040 1.00 0.00 O
+ATOM 476 CB PRO A 29 0.838 7.836 7.277 1.00 0.00 C
+ATOM 477 CG PRO A 29 -0.139 8.060 6.174 1.00 0.00 C
+ATOM 478 CD PRO A 29 0.431 9.216 5.397 1.00 0.00 C
+ATOM 479 HA PRO A 29 2.883 8.597 7.325 1.00 0.00 H
+ATOM 480 1HB PRO A 29 0.798 6.814 7.682 1.00 0.00 H
+ATOM 481 2HB PRO A 29 0.691 8.523 8.123 1.00 0.00 H
+ATOM 482 1HG PRO A 29 -0.240 7.149 5.565 1.00 0.00 H
+ATOM 483 2HG PRO A 29 -1.135 8.277 6.587 1.00 0.00 H
+ATOM 484 1HD PRO A 29 0.097 9.157 4.351 1.00 0.00 H
+ATOM 485 2HD PRO A 29 0.106 10.162 5.855 1.00 0.00 H
+ATOM 486 N GLY A 30 3.756 6.248 6.890 1.00 0.00 N
+ATOM 487 CA GLY A 30 4.387 4.978 6.548 1.00 0.00 C
+ATOM 488 C GLY A 30 5.660 5.195 5.740 1.00 0.00 C
+ATOM 489 O GLY A 30 6.413 4.255 5.485 1.00 0.00 O
+ATOM 490 H GLY A 30 4.033 6.721 7.738 1.00 0.00 H
+ATOM 491 1HA GLY A 30 4.620 4.430 7.461 1.00 0.00 H
+ATOM 492 2HA GLY A 30 3.689 4.368 5.976 1.00 0.00 H
+ATOM 493 N VAL A 31 5.895 6.440 5.339 1.00 0.00 N
+ATOM 494 CA VAL A 31 7.058 6.777 4.526 1.00 0.00 C
+ATOM 495 C VAL A 31 8.306 6.929 5.387 1.00 0.00 C
+ATOM 496 O VAL A 31 8.313 7.685 6.358 1.00 0.00 O
+ATOM 497 CB VAL A 31 6.808 8.085 3.752 1.00 0.00 C
+ATOM 498 CG1 VAL A 31 8.081 8.542 3.055 1.00 0.00 C
+ATOM 499 CG2 VAL A 31 5.685 7.885 2.747 1.00 0.00 C
+ATOM 500 H VAL A 31 5.252 7.172 5.604 1.00 0.00 H
+ATOM 501 HA VAL A 31 7.237 5.962 3.826 1.00 0.00 H
+ATOM 502 HB VAL A 31 6.530 8.867 4.459 1.00 0.00 H
+ATOM 503 1HG1 VAL A 31 7.887 9.468 2.513 1.00 0.00 H
+ATOM 504 2HG1 VAL A 31 8.861 8.713 3.797 1.00 0.00 H
+ATOM 505 3HG1 VAL A 31 8.408 7.774 2.354 1.00 0.00 H
+ATOM 506 1HG2 VAL A 31 5.513 8.814 2.204 1.00 0.00 H
+ATOM 507 2HG2 VAL A 31 5.961 7.099 2.044 1.00 0.00 H
+ATOM 508 3HG2 VAL A 31 4.773 7.599 3.272 1.00 0.00 H
+ATOM 509 N ASP A 32 9.360 6.206 5.024 1.00 0.00 N
+ATOM 510 CA ASP A 32 10.648 6.340 5.695 1.00 0.00 C
+ATOM 511 C ASP A 32 11.672 7.016 4.792 1.00 0.00 C
+ATOM 512 O ASP A 32 11.344 7.466 3.694 1.00 0.00 O
+ATOM 513 CB ASP A 32 11.170 4.969 6.131 1.00 0.00 C
+ATOM 514 CG ASP A 32 11.368 4.011 4.964 1.00 0.00 C
+ATOM 515 OD1 ASP A 32 11.368 4.463 3.843 1.00 0.00 O
+ATOM 516 OD2 ASP A 32 11.517 2.837 5.204 1.00 0.00 O
+ATOM 517 H ASP A 32 9.267 5.548 4.264 1.00 0.00 H
+ATOM 518 HA ASP A 32 10.514 6.964 6.578 1.00 0.00 H
+ATOM 519 1HB ASP A 32 12.122 5.090 6.648 1.00 0.00 H
+ATOM 520 2HB ASP A 32 10.469 4.520 6.836 1.00 0.00 H
+ATOM 521 N GLU A 33 12.913 7.084 5.261 1.00 0.00 N
+ATOM 522 CA GLU A 33 13.969 7.780 4.535 1.00 0.00 C
+ATOM 523 C GLU A 33 14.218 7.139 3.176 1.00 0.00 C
+ATOM 524 O GLU A 33 14.464 7.832 2.188 1.00 0.00 O
+ATOM 525 CB GLU A 33 15.263 7.786 5.352 1.00 0.00 C
+ATOM 526 CG GLU A 33 15.184 8.579 6.649 1.00 0.00 C
+ATOM 527 CD GLU A 33 14.488 7.830 7.752 1.00 0.00 C
+ATOM 528 OE1 GLU A 33 14.162 6.685 7.552 1.00 0.00 O
+ATOM 529 OE2 GLU A 33 14.283 8.404 8.795 1.00 0.00 O
+ATOM 530 H GLU A 33 13.131 6.642 6.143 1.00 0.00 H
+ATOM 531 HA GLU A 33 13.660 8.815 4.383 1.00 0.00 H
+ATOM 532 1HB GLU A 33 15.539 6.761 5.603 1.00 0.00 H
+ATOM 533 2HB GLU A 33 16.070 8.205 4.752 1.00 0.00 H
+ATOM 534 1HG GLU A 33 16.195 8.824 6.974 1.00 0.00 H
+ATOM 535 2HG GLU A 33 14.656 9.512 6.460 1.00 0.00 H
+ATOM 536 N ARG A 34 14.153 5.813 3.132 1.00 0.00 N
+ATOM 537 CA ARG A 34 14.390 5.075 1.897 1.00 0.00 C
+ATOM 538 C ARG A 34 13.364 5.440 0.832 1.00 0.00 C
+ATOM 539 O ARG A 34 13.714 5.683 -0.323 1.00 0.00 O
+ATOM 540 CB ARG A 34 14.341 3.576 2.152 1.00 0.00 C
+ATOM 541 CG ARG A 34 14.530 2.711 0.916 1.00 0.00 C
+ATOM 542 CD ARG A 34 14.327 1.270 1.217 1.00 0.00 C
+ATOM 543 NE ARG A 34 12.992 1.006 1.730 1.00 0.00 N
+ATOM 544 CZ ARG A 34 11.886 0.905 0.967 1.00 0.00 C
+ATOM 545 NH1 ARG A 34 11.972 1.049 -0.337 1.00 0.00 N
+ATOM 546 NH2 ARG A 34 10.715 0.662 1.530 1.00 0.00 N
+ATOM 547 H ARG A 34 13.933 5.303 3.976 1.00 0.00 H
+ATOM 548 HA ARG A 34 15.384 5.330 1.527 1.00 0.00 H
+ATOM 549 1HB ARG A 34 15.116 3.303 2.866 1.00 0.00 H
+ATOM 550 2HB ARG A 34 13.381 3.313 2.595 1.00 0.00 H
+ATOM 551 1HG ARG A 34 13.810 3.006 0.152 1.00 0.00 H
+ATOM 552 2HG ARG A 34 15.542 2.841 0.531 1.00 0.00 H
+ATOM 553 1HD ARG A 34 14.466 0.686 0.309 1.00 0.00 H
+ATOM 554 2HD ARG A 34 15.050 0.951 1.968 1.00 0.00 H
+ATOM 555 HE ARG A 34 12.887 0.890 2.729 1.00 0.00 H
+ATOM 556 1HH1 ARG A 34 12.867 1.235 -0.767 1.00 0.00 H
+ATOM 557 2HH1 ARG A 34 11.143 0.974 -0.909 1.00 0.00 H
+ATOM 558 1HH2 ARG A 34 10.650 0.552 2.532 1.00 0.00 H
+ATOM 559 2HH2 ARG A 34 9.887 0.587 0.958 1.00 0.00 H
+ATOM 560 N VAL A 35 12.096 5.476 1.227 1.00 0.00 N
+ATOM 561 CA VAL A 35 11.016 5.810 0.306 1.00 0.00 C
+ATOM 562 C VAL A 35 11.135 7.248 -0.184 1.00 0.00 C
+ATOM 563 O VAL A 35 10.851 7.544 -1.344 1.00 0.00 O
+ATOM 564 CB VAL A 35 9.650 5.616 0.990 1.00 0.00 C
+ATOM 565 CG1 VAL A 35 8.533 6.168 0.118 1.00 0.00 C
+ATOM 566 CG2 VAL A 35 9.425 4.141 1.285 1.00 0.00 C
+ATOM 567 H VAL A 35 11.874 5.266 2.189 1.00 0.00 H
+ATOM 568 HA VAL A 35 11.075 5.142 -0.554 1.00 0.00 H
+ATOM 569 HB VAL A 35 9.638 6.180 1.923 1.00 0.00 H
+ATOM 570 1HG1 VAL A 35 7.575 6.023 0.617 1.00 0.00 H
+ATOM 571 2HG1 VAL A 35 8.696 7.233 -0.050 1.00 0.00 H
+ATOM 572 3HG1 VAL A 35 8.526 5.646 -0.838 1.00 0.00 H
+ATOM 573 1HG2 VAL A 35 8.457 4.010 1.770 1.00 0.00 H
+ATOM 574 2HG2 VAL A 35 9.442 3.576 0.353 1.00 0.00 H
+ATOM 575 3HG2 VAL A 35 10.213 3.777 1.945 1.00 0.00 H
+ATOM 576 N ILE A 36 11.556 8.138 0.708 1.00 0.00 N
+ATOM 577 CA ILE A 36 11.788 9.532 0.348 1.00 0.00 C
+ATOM 578 C ILE A 36 12.894 9.656 -0.692 1.00 0.00 C
+ATOM 579 O ILE A 36 12.756 10.384 -1.675 1.00 0.00 O
+ATOM 580 CB ILE A 36 12.155 10.366 1.590 1.00 0.00 C
+ATOM 581 CG1 ILE A 36 10.951 10.486 2.527 1.00 0.00 C
+ATOM 582 CG2 ILE A 36 12.653 11.743 1.177 1.00 0.00 C
+ATOM 583 CD1 ILE A 36 11.298 11.004 3.904 1.00 0.00 C
+ATOM 584 H ILE A 36 11.720 7.842 1.659 1.00 0.00 H
+ATOM 585 HA ILE A 36 10.867 9.939 -0.070 1.00 0.00 H
+ATOM 586 HB ILE A 36 12.940 9.859 2.149 1.00 0.00 H
+ATOM 587 1HG1 ILE A 36 10.213 11.156 2.086 1.00 0.00 H
+ATOM 588 2HG1 ILE A 36 10.479 9.510 2.640 1.00 0.00 H
+ATOM 589 1HG2 ILE A 36 12.907 12.319 2.067 1.00 0.00 H
+ATOM 590 2HG2 ILE A 36 13.536 11.637 0.549 1.00 0.00 H
+ATOM 591 3HG2 ILE A 36 11.871 12.260 0.621 1.00 0.00 H
+ATOM 592 1HD1 ILE A 36 10.393 11.062 4.510 1.00 0.00 H
+ATOM 593 2HD1 ILE A 36 12.010 10.329 4.378 1.00 0.00 H
+ATOM 594 3HD1 ILE A 36 11.740 11.996 3.818 1.00 0.00 H
+ATOM 595 N LYS A 37 13.991 8.940 -0.471 1.00 0.00 N
+ATOM 596 CA LYS A 37 15.094 8.914 -1.424 1.00 0.00 C
+ATOM 597 C LYS A 37 14.633 8.415 -2.787 1.00 0.00 C
+ATOM 598 O LYS A 37 15.044 8.938 -3.822 1.00 0.00 O
+ATOM 599 CB LYS A 37 16.233 8.037 -0.901 1.00 0.00 C
+ATOM 600 CG LYS A 37 17.017 8.647 0.254 1.00 0.00 C
+ATOM 601 CD LYS A 37 18.087 7.692 0.761 1.00 0.00 C
+ATOM 602 CE LYS A 37 18.853 8.288 1.933 1.00 0.00 C
+ATOM 603 NZ LYS A 37 19.883 7.352 2.459 1.00 0.00 N
+ATOM 604 H LYS A 37 14.063 8.400 0.380 1.00 0.00 H
+ATOM 605 HA LYS A 37 15.480 9.928 -1.535 1.00 0.00 H
+ATOM 606 1HB LYS A 37 15.831 7.081 -0.564 1.00 0.00 H
+ATOM 607 2HB LYS A 37 16.934 7.831 -1.709 1.00 0.00 H
+ATOM 608 1HG LYS A 37 17.494 9.570 -0.078 1.00 0.00 H
+ATOM 609 2HG LYS A 37 16.337 8.884 1.071 1.00 0.00 H
+ATOM 610 1HD LYS A 37 17.621 6.758 1.079 1.00 0.00 H
+ATOM 611 2HD LYS A 37 18.789 7.471 -0.044 1.00 0.00 H
+ATOM 612 1HE LYS A 37 19.343 9.208 1.617 1.00 0.00 H
+ATOM 613 2HE LYS A 37 18.157 8.531 2.736 1.00 0.00 H
+ATOM 614 1HZ LYS A 37 20.367 7.784 3.233 1.00 0.00 H
+ATOM 615 2HZ LYS A 37 19.437 6.501 2.773 1.00 0.00 H
+ATOM 616 3HZ LYS A 37 20.545 7.134 1.728 1.00 0.00 H
+ATOM 617 N MET A 38 13.775 7.399 -2.781 1.00 0.00 N
+ATOM 618 CA MET A 38 13.138 6.928 -4.004 1.00 0.00 C
+ATOM 619 C MET A 38 12.368 8.048 -4.691 1.00 0.00 C
+ATOM 620 O MET A 38 12.510 8.264 -5.895 1.00 0.00 O
+ATOM 621 CB MET A 38 12.210 5.754 -3.697 1.00 0.00 C
+ATOM 622 CG MET A 38 11.423 5.242 -4.895 1.00 0.00 C
+ATOM 623 SD MET A 38 10.060 4.160 -4.422 1.00 0.00 S
+ATOM 624 CE MET A 38 8.866 5.358 -3.834 1.00 0.00 C
+ATOM 625 H MET A 38 13.560 6.943 -1.906 1.00 0.00 H
+ATOM 626 HA MET A 38 13.913 6.569 -4.682 1.00 0.00 H
+ATOM 627 1HB MET A 38 12.793 4.924 -3.300 1.00 0.00 H
+ATOM 628 2HB MET A 38 11.494 6.048 -2.928 1.00 0.00 H
+ATOM 629 1HG MET A 38 11.017 6.087 -5.451 1.00 0.00 H
+ATOM 630 2HG MET A 38 12.089 4.688 -5.557 1.00 0.00 H
+ATOM 631 1HE MET A 38 7.964 4.842 -3.505 1.00 0.00 H
+ATOM 632 2HE MET A 38 9.291 5.916 -2.999 1.00 0.00 H
+ATOM 633 3HE MET A 38 8.615 6.048 -4.641 1.00 0.00 H
+ATOM 634 N ALA A 39 11.553 8.759 -3.920 1.00 0.00 N
+ATOM 635 CA ALA A 39 10.764 9.864 -4.452 1.00 0.00 C
+ATOM 636 C ALA A 39 11.658 10.923 -5.085 1.00 0.00 C
+ATOM 637 O ALA A 39 11.316 11.501 -6.117 1.00 0.00 O
+ATOM 638 CB ALA A 39 9.908 10.480 -3.355 1.00 0.00 C
+ATOM 639 H ALA A 39 11.477 8.527 -2.940 1.00 0.00 H
+ATOM 640 HA ALA A 39 10.091 9.473 -5.216 1.00 0.00 H
+ATOM 641 1HB ALA A 39 9.326 11.304 -3.768 1.00 0.00 H
+ATOM 642 2HB ALA A 39 9.234 9.725 -2.952 1.00 0.00 H
+ATOM 643 3HB ALA A 39 10.551 10.854 -2.559 1.00 0.00 H
+ATOM 644 N GLU A 40 12.803 11.174 -4.460 1.00 0.00 N
+ATOM 645 CA GLU A 40 13.744 12.170 -4.957 1.00 0.00 C
+ATOM 646 C GLU A 40 14.295 11.775 -6.321 1.00 0.00 C
+ATOM 647 O GLU A 40 14.576 12.632 -7.159 1.00 0.00 O
+ATOM 648 CB GLU A 40 14.896 12.357 -3.966 1.00 0.00 C
+ATOM 649 CG GLU A 40 14.509 13.077 -2.682 1.00 0.00 C
+ATOM 650 CD GLU A 40 15.642 13.168 -1.698 1.00 0.00 C
+ATOM 651 OE1 GLU A 40 16.667 12.579 -1.945 1.00 0.00 O
+ATOM 652 OE2 GLU A 40 15.483 13.828 -0.698 1.00 0.00 O
+ATOM 653 H GLU A 40 13.027 10.662 -3.619 1.00 0.00 H
+ATOM 654 HA GLU A 40 13.222 13.123 -5.053 1.00 0.00 H
+ATOM 655 1HB GLU A 40 15.303 11.384 -3.694 1.00 0.00 H
+ATOM 656 2HB GLU A 40 15.695 12.926 -4.440 1.00 0.00 H
+ATOM 657 1HG GLU A 40 14.176 14.085 -2.929 1.00 0.00 H
+ATOM 658 2HG GLU A 40 13.674 12.552 -2.220 1.00 0.00 H
+ATOM 659 N ARG A 41 14.448 10.473 -6.537 1.00 0.00 N
+ATOM 660 CA ARG A 41 14.951 9.961 -7.806 1.00 0.00 C
+ATOM 661 C ARG A 41 13.863 9.964 -8.872 1.00 0.00 C
+ATOM 662 O ARG A 41 14.134 10.199 -10.049 1.00 0.00 O
+ATOM 663 CB ARG A 41 15.489 8.548 -7.638 1.00 0.00 C
+ATOM 664 CG ARG A 41 16.783 8.446 -6.847 1.00 0.00 C
+ATOM 665 CD ARG A 41 17.432 7.121 -7.023 1.00 0.00 C
+ATOM 666 NE ARG A 41 16.614 6.042 -6.494 1.00 0.00 N
+ATOM 667 CZ ARG A 41 16.659 5.600 -5.222 1.00 0.00 C
+ATOM 668 NH1 ARG A 41 17.486 6.154 -4.363 1.00 0.00 N
+ATOM 669 NH2 ARG A 41 15.872 4.610 -4.838 1.00 0.00 N
+ATOM 670 H ARG A 41 14.209 9.821 -5.804 1.00 0.00 H
+ATOM 671 HA ARG A 41 15.768 10.603 -8.139 1.00 0.00 H
+ATOM 672 1HB ARG A 41 14.745 7.934 -7.132 1.00 0.00 H
+ATOM 673 2HB ARG A 41 15.666 8.106 -8.619 1.00 0.00 H
+ATOM 674 1HG ARG A 41 17.478 9.215 -7.185 1.00 0.00 H
+ATOM 675 2HG ARG A 41 16.574 8.586 -5.786 1.00 0.00 H
+ATOM 676 1HD ARG A 41 17.597 6.935 -8.084 1.00 0.00 H
+ATOM 677 2HD ARG A 41 18.388 7.112 -6.501 1.00 0.00 H
+ATOM 678 HE ARG A 41 15.965 5.591 -7.125 1.00 0.00 H
+ATOM 679 1HH1 ARG A 41 18.087 6.911 -4.657 1.00 0.00 H
+ATOM 680 2HH1 ARG A 41 17.520 5.823 -3.410 1.00 0.00 H
+ATOM 681 1HH2 ARG A 41 15.236 4.185 -5.498 1.00 0.00 H
+ATOM 682 2HH2 ARG A 41 15.906 4.280 -3.885 1.00 0.00 H
+ATOM 683 N LEU A 42 12.630 9.701 -8.452 1.00 0.00 N
+ATOM 684 CA LEU A 42 11.517 9.563 -9.383 1.00 0.00 C
+ATOM 685 C LEU A 42 11.186 10.894 -10.047 1.00 0.00 C
+ATOM 686 O LEU A 42 10.867 10.943 -11.235 1.00 0.00 O
+ATOM 687 CB LEU A 42 10.279 9.027 -8.653 1.00 0.00 C
+ATOM 688 CG LEU A 42 10.340 7.553 -8.235 1.00 0.00 C
+ATOM 689 CD1 LEU A 42 9.181 7.242 -7.297 1.00 0.00 C
+ATOM 690 CD2 LEU A 42 10.291 6.671 -9.474 1.00 0.00 C
+ATOM 691 H LEU A 42 12.460 9.594 -7.462 1.00 0.00 H
+ATOM 692 HA LEU A 42 11.798 8.847 -10.156 1.00 0.00 H
+ATOM 693 1HB LEU A 42 10.122 9.620 -7.753 1.00 0.00 H
+ATOM 694 2HB LEU A 42 9.412 9.153 -9.301 1.00 0.00 H
+ATOM 695 HG LEU A 42 11.267 7.366 -7.693 1.00 0.00 H
+ATOM 696 1HD1 LEU A 42 9.225 6.194 -6.999 1.00 0.00 H
+ATOM 697 2HD1 LEU A 42 9.252 7.873 -6.410 1.00 0.00 H
+ATOM 698 3HD1 LEU A 42 8.238 7.436 -7.806 1.00 0.00 H
+ATOM 699 1HD2 LEU A 42 10.335 5.623 -9.177 1.00 0.00 H
+ATOM 700 2HD2 LEU A 42 9.363 6.856 -10.016 1.00 0.00 H
+ATOM 701 3HD2 LEU A 42 11.140 6.902 -10.118 1.00 0.00 H
+ATOM 702 N ILE A 43 11.263 11.971 -9.273 1.00 0.00 N
+ATOM 703 CA ILE A 43 10.895 13.294 -9.762 1.00 0.00 C
+ATOM 704 C ILE A 43 12.088 14.000 -10.394 1.00 0.00 C
+ATOM 705 O ILE A 43 13.234 13.773 -10.003 1.00 0.00 O
+ATOM 706 OXT ILE A 43 11.918 14.787 -11.283 1.00 0.00 O
+ATOM 707 CB ILE A 43 10.328 14.162 -8.624 1.00 0.00 C
+ATOM 708 CG1 ILE A 43 9.743 15.461 -9.184 1.00 0.00 C
+ATOM 709 CG2 ILE A 43 11.407 14.461 -7.595 1.00 0.00 C
+ATOM 710 CD1 ILE A 43 8.387 15.291 -9.831 1.00 0.00 C
+ATOM 711 H ILE A 43 11.586 11.871 -8.321 1.00 0.00 H
+ATOM 712 HA ILE A 43 10.117 13.180 -10.517 1.00 0.00 H
+ATOM 713 HB ILE A 43 9.510 13.633 -8.136 1.00 0.00 H
+ATOM 714 1HG1 ILE A 43 9.649 16.193 -8.383 1.00 0.00 H
+ATOM 715 2HG1 ILE A 43 10.424 15.877 -9.927 1.00 0.00 H
+ATOM 716 1HG2 ILE A 43 10.990 15.076 -6.798 1.00 0.00 H
+ATOM 717 2HG2 ILE A 43 11.779 13.527 -7.175 1.00 0.00 H
+ATOM 718 3HG2 ILE A 43 12.228 14.996 -8.073 1.00 0.00 H
+ATOM 719 1HD1 ILE A 43 8.039 16.254 -10.204 1.00 0.00 H
+ATOM 720 2HD1 ILE A 43 8.466 14.587 -10.661 1.00 0.00 H
+ATOM 721 3HD1 ILE A 43 7.679 14.910 -9.097 1.00 0.00 H
+TER
+##Begin comments##
+BINARY SILENTFILE
+DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL
+PHI 0,-64.3519,-63.4181,-65.5667,-62.937,-64.846,-60.4677,-64.9914,-59.0496,-63.1863,-58.8565,-64.3502,-97.5401,-52.8637,100.757,-71.3637,-72.827,-61.3249,-64.5421,-64.5001,-64.6733,-57.1223,-61.0998,-64.4728,-62.1067,-66.1443,-66.0026,-68.0619,-69.6854,91.851,-81.1899,-109.42,-61.8785,-61.9746,-65.064,-62.6962,-58.6336,-57.3273,-58.089,-63.929,-78.3684,-67.8642,-89.2481
+PSI 135.29,-44.3565,-39.4421,-39.8133,-44.342,-43.5345,-41.9205,-40.6256,-44.1941,-43.6039,-48.8896,-34.8052,18.7369,134.235,-14.1939,156.871,163.208,-37.1252,-41.0631,-43.2876,-41.8017,-48.7622,-43.0688,-40.5516,-38.5449,-36.859,-35.1245,125.391,145.655,-8.20815,126.693,-174.371,-38.4443,-46.0786,-37.3903,-45.6638,-40.3914,-48.7685,-38.5726,-33.2765,-34.9392,-38.696,0
+##End comments##
+
+AlaCount 4
+AverageDegree 14.953
+BuriedUnsatHbond 2
+Buried_non_polar_SASA_per_res 59.557
+CavityVolume 0
+CoreAverageDegree 19.929
+CoreResidueCount 14
+ExposeCoreHydrophobicsPerCoreResidue 16.135
+ExposeCoreHydrophobicsSASA 225.897
+ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent 12.642
+ExposedHydrophobics_on_TotalSASAPercent 6.978
+HasCoreResidueNum 15
+MaxDistanceToToMassCenter 6.397
+PackStat 0.657
+Rg 9.298
+SSShapeComplementarity 0.795
+ScorePerResFilter -1.696
+driftRMSD 0.603
+frac_helix 72.093
+frac_loop 27.907
+frac_sheet 0
+n_hydrophobic 18
+nres_helix 31
+nres_loop 12
+nres_sheet 0
+nres_total 43
+percent_core 0.349
+score -111.579
+ss_mismatch_probability 0.267
+
diff --git a/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb
new file mode 100644
index 0000000..e1294a6
--- /dev/null
+++ b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb
@@ -0,0 +1,792 @@
+HEADER 31-AUG-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 31-AUG-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.31+release.c7009b3115c
+ATOM 1 N SER A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA SER A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C SER A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O SER A 1 1.269 2.383 -0.200 1.00 0.00 O
+ATOM 5 CB SER A 1 1.980 -0.754 -1.207 1.00 0.00 C
+ATOM 6 OG SER A 1 1.745 -0.037 -2.388 1.00 0.00 O
+ATOM 7 1H SER A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 8 2H SER A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 9 3H SER A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 10 HA SER A 1 1.804 -0.502 0.905 1.00 0.00 H
+ATOM 11 1HB SER A 1 3.049 -0.930 -1.092 1.00 0.00 H
+ATOM 12 2HB SER A 1 1.493 -1.727 -1.267 1.00 0.00 H
+ATOM 13 HG SER A 1 2.083 -0.584 -3.101 1.00 0.00 H
+ATOM 14 N GLU A 2 3.312 1.544 0.226 1.00 0.00 N
+ATOM 15 CA GLU A 2 3.962 2.848 0.270 1.00 0.00 C
+ATOM 16 C GLU A 2 3.920 3.531 -1.090 1.00 0.00 C
+ATOM 17 O GLU A 2 3.733 4.745 -1.181 1.00 0.00 O
+ATOM 18 CB GLU A 2 5.413 2.706 0.737 1.00 0.00 C
+ATOM 19 CG GLU A 2 5.567 2.292 2.193 1.00 0.00 C
+ATOM 20 CD GLU A 2 5.295 0.831 2.418 1.00 0.00 C
+ATOM 21 OE1 GLU A 2 5.101 0.127 1.456 1.00 0.00 O
+ATOM 22 OE2 GLU A 2 5.281 0.418 3.554 1.00 0.00 O
+ATOM 23 H GLU A 2 3.868 0.713 0.370 1.00 0.00 H
+ATOM 24 HA GLU A 2 3.434 3.473 0.992 1.00 0.00 H
+ATOM 25 1HB GLU A 2 5.921 1.963 0.122 1.00 0.00 H
+ATOM 26 2HB GLU A 2 5.933 3.655 0.601 1.00 0.00 H
+ATOM 27 1HG GLU A 2 6.583 2.515 2.517 1.00 0.00 H
+ATOM 28 2HG GLU A 2 4.884 2.882 2.802 1.00 0.00 H
+ATOM 29 N GLU A 3 4.096 2.745 -2.147 1.00 0.00 N
+ATOM 30 CA GLU A 3 4.078 3.273 -3.506 1.00 0.00 C
+ATOM 31 C GLU A 3 2.712 3.849 -3.855 1.00 0.00 C
+ATOM 32 O GLU A 3 2.613 4.865 -4.544 1.00 0.00 O
+ATOM 33 CB GLU A 3 4.451 2.179 -4.508 1.00 0.00 C
+ATOM 34 CG GLU A 3 5.874 1.656 -4.367 1.00 0.00 C
+ATOM 35 CD GLU A 3 6.011 0.618 -3.288 1.00 0.00 C
+ATOM 36 OE1 GLU A 3 5.023 0.292 -2.674 1.00 0.00 O
+ATOM 37 OE2 GLU A 3 7.105 0.150 -3.077 1.00 0.00 O
+ATOM 38 H GLU A 3 4.245 1.757 -2.005 1.00 0.00 H
+ATOM 39 HA GLU A 3 4.821 4.068 -3.579 1.00 0.00 H
+ATOM 40 1HB GLU A 3 3.772 1.334 -4.395 1.00 0.00 H
+ATOM 41 2HB GLU A 3 4.335 2.559 -5.523 1.00 0.00 H
+ATOM 42 1HG GLU A 3 6.186 1.220 -5.316 1.00 0.00 H
+ATOM 43 2HG GLU A 3 6.537 2.491 -4.147 1.00 0.00 H
+ATOM 44 N GLU A 4 1.659 3.195 -3.376 1.00 0.00 N
+ATOM 45 CA GLU A 4 0.298 3.669 -3.595 1.00 0.00 C
+ATOM 46 C GLU A 4 0.054 4.992 -2.881 1.00 0.00 C
+ATOM 47 O GLU A 4 -0.601 5.886 -3.417 1.00 0.00 O
+ATOM 48 CB GLU A 4 -0.714 2.626 -3.115 1.00 0.00 C
+ATOM 49 CG GLU A 4 -0.766 1.363 -3.964 1.00 0.00 C
+ATOM 50 CD GLU A 4 -1.606 0.279 -3.348 1.00 0.00 C
+ATOM 51 OE1 GLU A 4 -1.794 0.304 -2.156 1.00 0.00 O
+ATOM 52 OE2 GLU A 4 -2.061 -0.575 -4.072 1.00 0.00 O
+ATOM 53 H GLU A 4 1.806 2.347 -2.847 1.00 0.00 H
+ATOM 54 HA GLU A 4 0.150 3.816 -4.665 1.00 0.00 H
+ATOM 55 1HB GLU A 4 -0.476 2.332 -2.092 1.00 0.00 H
+ATOM 56 2HB GLU A 4 -1.712 3.064 -3.105 1.00 0.00 H
+ATOM 57 1HG GLU A 4 -1.175 1.613 -4.942 1.00 0.00 H
+ATOM 58 2HG GLU A 4 0.248 0.993 -4.108 1.00 0.00 H
+ATOM 59 N LYS A 5 0.585 5.112 -1.669 1.00 0.00 N
+ATOM 60 CA LYS A 5 0.484 6.351 -0.907 1.00 0.00 C
+ATOM 61 C LYS A 5 1.188 7.497 -1.622 1.00 0.00 C
+ATOM 62 O LYS A 5 0.680 8.617 -1.670 1.00 0.00 O
+ATOM 63 CB LYS A 5 1.069 6.167 0.494 1.00 0.00 C
+ATOM 64 CG LYS A 5 0.231 5.291 1.416 1.00 0.00 C
+ATOM 65 CD LYS A 5 0.897 5.122 2.773 1.00 0.00 C
+ATOM 66 CE LYS A 5 0.076 4.221 3.685 1.00 0.00 C
+ATOM 67 NZ LYS A 5 0.742 4.002 4.997 1.00 0.00 N
+ATOM 68 H LYS A 5 1.072 4.324 -1.265 1.00 0.00 H
+ATOM 69 HA LYS A 5 -0.571 6.603 -0.796 1.00 0.00 H
+ATOM 70 1HB LYS A 5 2.061 5.721 0.419 1.00 0.00 H
+ATOM 71 2HB LYS A 5 1.184 7.141 0.971 1.00 0.00 H
+ATOM 72 1HG LYS A 5 -0.751 5.745 1.556 1.00 0.00 H
+ATOM 73 2HG LYS A 5 0.096 4.310 0.962 1.00 0.00 H
+ATOM 74 1HD LYS A 5 1.887 4.685 2.641 1.00 0.00 H
+ATOM 75 2HD LYS A 5 1.009 6.097 3.248 1.00 0.00 H
+ATOM 76 1HE LYS A 5 -0.900 4.671 3.858 1.00 0.00 H
+ATOM 77 2HE LYS A 5 -0.074 3.255 3.202 1.00 0.00 H
+ATOM 78 1HZ LYS A 5 0.168 3.400 5.571 1.00 0.00 H
+ATOM 79 2HZ LYS A 5 1.642 3.566 4.850 1.00 0.00 H
+ATOM 80 3HZ LYS A 5 0.870 4.888 5.463 1.00 0.00 H
+ATOM 81 N GLU A 6 2.360 7.210 -2.178 1.00 0.00 N
+ATOM 82 CA GLU A 6 3.117 8.206 -2.926 1.00 0.00 C
+ATOM 83 C GLU A 6 2.354 8.666 -4.161 1.00 0.00 C
+ATOM 84 O GLU A 6 2.340 9.852 -4.488 1.00 0.00 O
+ATOM 85 CB GLU A 6 4.479 7.642 -3.337 1.00 0.00 C
+ATOM 86 CG GLU A 6 5.463 7.473 -2.188 1.00 0.00 C
+ATOM 87 CD GLU A 6 6.750 6.820 -2.610 1.00 0.00 C
+ATOM 88 OE1 GLU A 6 6.824 6.364 -3.726 1.00 0.00 O
+ATOM 89 OE2 GLU A 6 7.660 6.778 -1.816 1.00 0.00 O
+ATOM 90 H GLU A 6 2.736 6.277 -2.080 1.00 0.00 H
+ATOM 91 HA GLU A 6 3.289 9.068 -2.280 1.00 0.00 H
+ATOM 92 1HB GLU A 6 4.343 6.667 -3.807 1.00 0.00 H
+ATOM 93 2HB GLU A 6 4.938 8.300 -4.076 1.00 0.00 H
+ATOM 94 1HG GLU A 6 5.687 8.453 -1.768 1.00 0.00 H
+ATOM 95 2HG GLU A 6 4.995 6.872 -1.409 1.00 0.00 H
+ATOM 96 N PHE A 7 1.719 7.719 -4.845 1.00 0.00 N
+ATOM 97 CA PHE A 7 0.906 8.033 -6.014 1.00 0.00 C
+ATOM 98 C PHE A 7 -0.197 9.025 -5.668 1.00 0.00 C
+ATOM 99 O PHE A 7 -0.354 10.049 -6.332 1.00 0.00 O
+ATOM 100 CB PHE A 7 0.289 6.758 -6.593 1.00 0.00 C
+ATOM 101 CG PHE A 7 -0.867 7.011 -7.519 1.00 0.00 C
+ATOM 102 CD1 PHE A 7 -0.657 7.534 -8.786 1.00 0.00 C
+ATOM 103 CD2 PHE A 7 -2.165 6.728 -7.124 1.00 0.00 C
+ATOM 104 CE1 PHE A 7 -1.720 7.767 -9.638 1.00 0.00 C
+ATOM 105 CE2 PHE A 7 -3.229 6.958 -7.974 1.00 0.00 C
+ATOM 106 CZ PHE A 7 -3.006 7.479 -9.233 1.00 0.00 C
+ATOM 107 H PHE A 7 1.801 6.758 -4.546 1.00 0.00 H
+ATOM 108 HA PHE A 7 1.550 8.476 -6.774 1.00 0.00 H
+ATOM 109 1HB PHE A 7 1.049 6.203 -7.142 1.00 0.00 H
+ATOM 110 2HB PHE A 7 -0.058 6.121 -5.781 1.00 0.00 H
+ATOM 111 HD1 PHE A 7 0.360 7.761 -9.107 1.00 0.00 H
+ATOM 112 HD2 PHE A 7 -2.342 6.316 -6.129 1.00 0.00 H
+ATOM 113 HE1 PHE A 7 -1.541 8.178 -10.632 1.00 0.00 H
+ATOM 114 HE2 PHE A 7 -4.245 6.730 -7.651 1.00 0.00 H
+ATOM 115 HZ PHE A 7 -3.844 7.663 -9.903 1.00 0.00 H
+ATOM 116 N LEU A 8 -0.959 8.715 -4.625 1.00 0.00 N
+ATOM 117 CA LEU A 8 -2.073 9.560 -4.212 1.00 0.00 C
+ATOM 118 C LEU A 8 -1.580 10.902 -3.686 1.00 0.00 C
+ATOM 119 O LEU A 8 -2.227 11.931 -3.879 1.00 0.00 O
+ATOM 120 CB LEU A 8 -2.902 8.854 -3.132 1.00 0.00 C
+ATOM 121 CG LEU A 8 -3.635 7.583 -3.581 1.00 0.00 C
+ATOM 122 CD1 LEU A 8 -4.274 6.911 -2.373 1.00 0.00 C
+ATOM 123 CD2 LEU A 8 -4.682 7.943 -4.624 1.00 0.00 C
+ATOM 124 H LEU A 8 -0.761 7.872 -4.105 1.00 0.00 H
+ATOM 125 HA LEU A 8 -2.712 9.737 -5.077 1.00 0.00 H
+ATOM 126 1HB LEU A 8 -2.242 8.582 -2.310 1.00 0.00 H
+ATOM 127 2HB LEU A 8 -3.649 9.552 -2.755 1.00 0.00 H
+ATOM 128 HG LEU A 8 -2.919 6.883 -4.012 1.00 0.00 H
+ATOM 129 1HD1 LEU A 8 -4.795 6.009 -2.692 1.00 0.00 H
+ATOM 130 2HD1 LEU A 8 -3.500 6.647 -1.652 1.00 0.00 H
+ATOM 131 3HD1 LEU A 8 -4.984 7.595 -1.910 1.00 0.00 H
+ATOM 132 1HD2 LEU A 8 -5.203 7.040 -4.944 1.00 0.00 H
+ATOM 133 2HD2 LEU A 8 -5.399 8.643 -4.193 1.00 0.00 H
+ATOM 134 3HD2 LEU A 8 -4.196 8.406 -5.483 1.00 0.00 H
+ATOM 135 N LYS A 9 -0.431 10.885 -3.019 1.00 0.00 N
+ATOM 136 CA LYS A 9 0.160 12.104 -2.479 1.00 0.00 C
+ATOM 137 C LYS A 9 0.503 13.088 -3.589 1.00 0.00 C
+ATOM 138 O LYS A 9 0.230 14.283 -3.479 1.00 0.00 O
+ATOM 139 CB LYS A 9 1.411 11.776 -1.662 1.00 0.00 C
+ATOM 140 CG LYS A 9 2.076 12.985 -1.017 1.00 0.00 C
+ATOM 141 CD LYS A 9 1.166 13.630 0.018 1.00 0.00 C
+ATOM 142 CE LYS A 9 1.952 14.525 0.965 1.00 0.00 C
+ATOM 143 NZ LYS A 9 2.607 15.653 0.250 1.00 0.00 N
+ATOM 144 H LYS A 9 0.046 10.005 -2.883 1.00 0.00 H
+ATOM 145 HA LYS A 9 -0.562 12.571 -1.809 1.00 0.00 H
+ATOM 146 1HB LYS A 9 1.153 11.074 -0.868 1.00 0.00 H
+ATOM 147 2HB LYS A 9 2.147 11.291 -2.302 1.00 0.00 H
+ATOM 148 1HG LYS A 9 3.002 12.676 -0.533 1.00 0.00 H
+ATOM 149 2HG LYS A 9 2.316 13.720 -1.785 1.00 0.00 H
+ATOM 150 1HD LYS A 9 0.406 14.227 -0.486 1.00 0.00 H
+ATOM 151 2HD LYS A 9 0.668 12.853 0.598 1.00 0.00 H
+ATOM 152 1HE LYS A 9 1.282 14.931 1.721 1.00 0.00 H
+ATOM 153 2HE LYS A 9 2.719 13.937 1.470 1.00 0.00 H
+ATOM 154 1HZ LYS A 9 3.117 16.221 0.911 1.00 0.00 H
+ATOM 155 2HZ LYS A 9 3.246 15.287 -0.443 1.00 0.00 H
+ATOM 156 3HZ LYS A 9 1.905 16.217 -0.206 1.00 0.00 H
+ATOM 157 N ARG A 10 1.104 12.579 -4.660 1.00 0.00 N
+ATOM 158 CA ARG A 10 1.485 13.413 -5.794 1.00 0.00 C
+ATOM 159 C ARG A 10 0.281 14.158 -6.358 1.00 0.00 C
+ATOM 160 O ARG A 10 0.388 15.318 -6.754 1.00 0.00 O
+ATOM 161 CB ARG A 10 2.115 12.569 -6.891 1.00 0.00 C
+ATOM 162 CG ARG A 10 3.537 12.110 -6.608 1.00 0.00 C
+ATOM 163 CD ARG A 10 4.233 11.682 -7.849 1.00 0.00 C
+ATOM 164 NE ARG A 10 3.588 10.533 -8.463 1.00 0.00 N
+ATOM 165 CZ ARG A 10 3.855 9.249 -8.153 1.00 0.00 C
+ATOM 166 NH1 ARG A 10 4.755 8.968 -7.237 1.00 0.00 N
+ATOM 167 NH2 ARG A 10 3.213 8.273 -8.770 1.00 0.00 N
+ATOM 168 H ARG A 10 1.302 11.589 -4.689 1.00 0.00 H
+ATOM 169 HA ARG A 10 2.220 14.143 -5.455 1.00 0.00 H
+ATOM 170 1HB ARG A 10 1.510 11.679 -7.059 1.00 0.00 H
+ATOM 171 2HB ARG A 10 2.130 13.135 -7.823 1.00 0.00 H
+ATOM 172 1HG ARG A 10 4.102 12.930 -6.164 1.00 0.00 H
+ATOM 173 2HG ARG A 10 3.517 11.267 -5.917 1.00 0.00 H
+ATOM 174 1HD ARG A 10 4.230 12.500 -8.569 1.00 0.00 H
+ATOM 175 2HD ARG A 10 5.261 11.410 -7.613 1.00 0.00 H
+ATOM 176 HE ARG A 10 2.890 10.709 -9.173 1.00 0.00 H
+ATOM 177 1HH1 ARG A 10 5.246 9.714 -6.765 1.00 0.00 H
+ATOM 178 2HH1 ARG A 10 4.955 8.006 -7.005 1.00 0.00 H
+ATOM 179 1HH2 ARG A 10 2.521 8.489 -9.475 1.00 0.00 H
+ATOM 180 2HH2 ARG A 10 3.413 7.311 -8.538 1.00 0.00 H
+ATOM 181 N VAL A 11 -0.863 13.483 -6.393 1.00 0.00 N
+ATOM 182 CA VAL A 11 -2.097 14.093 -6.871 1.00 0.00 C
+ATOM 183 C VAL A 11 -2.680 15.044 -5.834 1.00 0.00 C
+ATOM 184 O VAL A 11 -3.089 16.158 -6.160 1.00 0.00 O
+ATOM 185 CB VAL A 11 -3.136 13.005 -7.207 1.00 0.00 C
+ATOM 186 CG1 VAL A 11 -4.442 13.639 -7.662 1.00 0.00 C
+ATOM 187 CG2 VAL A 11 -2.585 12.076 -8.277 1.00 0.00 C
+ATOM 188 H VAL A 11 -0.877 12.523 -6.080 1.00 0.00 H
+ATOM 189 HA VAL A 11 -1.876 14.657 -7.778 1.00 0.00 H
+ATOM 190 HB VAL A 11 -3.353 12.433 -6.305 1.00 0.00 H
+ATOM 191 1HG1 VAL A 11 -5.164 12.856 -7.894 1.00 0.00 H
+ATOM 192 2HG1 VAL A 11 -4.836 14.271 -6.867 1.00 0.00 H
+ATOM 193 3HG1 VAL A 11 -4.263 14.242 -8.552 1.00 0.00 H
+ATOM 194 1HG2 VAL A 11 -3.324 11.309 -8.509 1.00 0.00 H
+ATOM 195 2HG2 VAL A 11 -2.362 12.649 -9.177 1.00 0.00 H
+ATOM 196 3HG2 VAL A 11 -1.672 11.602 -7.914 1.00 0.00 H
+ATOM 197 N LYS A 12 -2.714 14.598 -4.583 1.00 0.00 N
+ATOM 198 CA LYS A 12 -3.318 15.377 -3.508 1.00 0.00 C
+ATOM 199 C LYS A 12 -2.657 16.743 -3.379 1.00 0.00 C
+ATOM 200 O LYS A 12 -3.321 17.740 -3.096 1.00 0.00 O
+ATOM 201 CB LYS A 12 -3.226 14.620 -2.182 1.00 0.00 C
+ATOM 202 CG LYS A 12 -3.900 15.322 -1.010 1.00 0.00 C
+ATOM 203 CD LYS A 12 -3.835 14.475 0.252 1.00 0.00 C
+ATOM 204 CE LYS A 12 -4.489 15.183 1.429 1.00 0.00 C
+ATOM 205 NZ LYS A 12 -4.439 14.363 2.670 1.00 0.00 N
+ATOM 206 H LYS A 12 -2.311 13.696 -4.371 1.00 0.00 H
+ATOM 207 HA LYS A 12 -4.375 15.520 -3.737 1.00 0.00 H
+ATOM 208 1HB LYS A 12 -3.684 13.637 -2.291 1.00 0.00 H
+ATOM 209 2HB LYS A 12 -2.179 14.466 -1.922 1.00 0.00 H
+ATOM 210 1HG LYS A 12 -3.405 16.275 -0.823 1.00 0.00 H
+ATOM 211 2HG LYS A 12 -4.944 15.516 -1.254 1.00 0.00 H
+ATOM 212 1HD LYS A 12 -4.346 13.526 0.081 1.00 0.00 H
+ATOM 213 2HD LYS A 12 -2.794 14.267 0.498 1.00 0.00 H
+ATOM 214 1HE LYS A 12 -3.981 16.129 1.613 1.00 0.00 H
+ATOM 215 2HE LYS A 12 -5.531 15.396 1.192 1.00 0.00 H
+ATOM 216 1HZ LYS A 12 -4.882 14.867 3.425 1.00 0.00 H
+ATOM 217 2HZ LYS A 12 -4.924 13.490 2.517 1.00 0.00 H
+ATOM 218 3HZ LYS A 12 -3.476 14.175 2.911 1.00 0.00 H
+ATOM 219 N ASP A 13 -1.345 16.782 -3.588 1.00 0.00 N
+ATOM 220 CA ASP A 13 -0.587 18.021 -3.468 1.00 0.00 C
+ATOM 221 C ASP A 13 -1.100 19.077 -4.439 1.00 0.00 C
+ATOM 222 O ASP A 13 -0.914 20.275 -4.224 1.00 0.00 O
+ATOM 223 CB ASP A 13 0.901 17.766 -3.721 1.00 0.00 C
+ATOM 224 CG ASP A 13 1.597 17.101 -2.542 1.00 0.00 C
+ATOM 225 OD1 ASP A 13 1.022 17.066 -1.480 1.00 0.00 O
+ATOM 226 OD2 ASP A 13 2.697 16.633 -2.714 1.00 0.00 O
+ATOM 227 H ASP A 13 -0.861 15.931 -3.837 1.00 0.00 H
+ATOM 228 HA ASP A 13 -0.715 18.408 -2.456 1.00 0.00 H
+ATOM 229 1HB ASP A 13 1.017 17.131 -4.599 1.00 0.00 H
+ATOM 230 2HB ASP A 13 1.401 18.712 -3.933 1.00 0.00 H
+ATOM 231 N LYS A 14 -1.746 18.626 -5.508 1.00 0.00 N
+ATOM 232 CA LYS A 14 -2.229 19.527 -6.548 1.00 0.00 C
+ATOM 233 C LYS A 14 -3.745 19.662 -6.501 1.00 0.00 C
+ATOM 234 O LYS A 14 -4.291 20.735 -6.757 1.00 0.00 O
+ATOM 235 CB LYS A 14 -1.788 19.037 -7.928 1.00 0.00 C
+ATOM 236 CG LYS A 14 -0.283 19.076 -8.159 1.00 0.00 C
+ATOM 237 CD LYS A 14 0.077 18.584 -9.552 1.00 0.00 C
+ATOM 238 CE LYS A 14 1.580 18.619 -9.782 1.00 0.00 C
+ATOM 239 NZ LYS A 14 1.950 18.092 -11.124 1.00 0.00 N
+ATOM 240 H LYS A 14 -1.908 17.634 -5.603 1.00 0.00 H
+ATOM 241 HA LYS A 14 -1.788 20.511 -6.386 1.00 0.00 H
+ATOM 242 1HB LYS A 14 -2.121 18.009 -8.073 1.00 0.00 H
+ATOM 243 2HB LYS A 14 -2.260 19.646 -8.699 1.00 0.00 H
+ATOM 244 1HG LYS A 14 0.077 20.099 -8.040 1.00 0.00 H
+ATOM 245 2HG LYS A 14 0.215 18.448 -7.421 1.00 0.00 H
+ATOM 246 1HD LYS A 14 -0.279 17.560 -9.679 1.00 0.00 H
+ATOM 247 2HD LYS A 14 -0.410 19.213 -10.297 1.00 0.00 H
+ATOM 248 1HE LYS A 14 1.937 19.644 -9.696 1.00 0.00 H
+ATOM 249 2HE LYS A 14 2.079 18.019 -9.021 1.00 0.00 H
+ATOM 250 1HZ LYS A 14 2.953 18.132 -11.237 1.00 0.00 H
+ATOM 251 2HZ LYS A 14 1.640 17.134 -11.208 1.00 0.00 H
+ATOM 252 3HZ LYS A 14 1.509 18.653 -11.839 1.00 0.00 H
+ATOM 253 N ASP A 15 -4.421 18.566 -6.171 1.00 0.00 N
+ATOM 254 CA ASP A 15 -5.879 18.539 -6.164 1.00 0.00 C
+ATOM 255 C ASP A 15 -6.404 17.411 -5.285 1.00 0.00 C
+ATOM 256 O ASP A 15 -6.519 16.268 -5.728 1.00 0.00 O
+ATOM 257 CB ASP A 15 -6.420 18.380 -7.587 1.00 0.00 C
+ATOM 258 CG ASP A 15 -7.941 18.436 -7.652 1.00 0.00 C
+ATOM 259 OD1 ASP A 15 -8.568 18.211 -6.645 1.00 0.00 O
+ATOM 260 OD2 ASP A 15 -8.460 18.705 -8.709 1.00 0.00 O
+ATOM 261 H ASP A 15 -3.912 17.731 -5.920 1.00 0.00 H
+ATOM 262 HA ASP A 15 -6.241 19.484 -5.757 1.00 0.00 H
+ATOM 263 1HB ASP A 15 -6.014 19.168 -8.221 1.00 0.00 H
+ATOM 264 2HB ASP A 15 -6.089 17.426 -7.998 1.00 0.00 H
+ATOM 265 N PRO A 16 -6.722 17.739 -4.037 1.00 0.00 N
+ATOM 266 CA PRO A 16 -7.146 16.737 -3.066 1.00 0.00 C
+ATOM 267 C PRO A 16 -8.407 16.020 -3.530 1.00 0.00 C
+ATOM 268 O PRO A 16 -8.664 14.880 -3.141 1.00 0.00 O
+ATOM 269 CB PRO A 16 -7.400 17.567 -1.804 1.00 0.00 C
+ATOM 270 CG PRO A 16 -6.491 18.739 -1.947 1.00 0.00 C
+ATOM 271 CD PRO A 16 -6.529 19.065 -3.417 1.00 0.00 C
+ATOM 272 HA PRO A 16 -6.329 16.019 -2.907 1.00 0.00 H
+ATOM 273 1HB PRO A 16 -8.461 17.854 -1.749 1.00 0.00 H
+ATOM 274 2HB PRO A 16 -7.184 16.966 -0.909 1.00 0.00 H
+ATOM 275 1HG PRO A 16 -6.842 19.572 -1.320 1.00 0.00 H
+ATOM 276 2HG PRO A 16 -5.480 18.481 -1.597 1.00 0.00 H
+ATOM 277 1HD PRO A 16 -7.372 19.741 -3.621 1.00 0.00 H
+ATOM 278 2HD PRO A 16 -5.577 19.530 -3.714 1.00 0.00 H
+ATOM 279 N GLU A 17 -9.193 16.693 -4.364 1.00 0.00 N
+ATOM 280 CA GLU A 17 -10.452 16.139 -4.847 1.00 0.00 C
+ATOM 281 C GLU A 17 -10.215 15.114 -5.949 1.00 0.00 C
+ATOM 282 O GLU A 17 -10.908 14.100 -6.026 1.00 0.00 O
+ATOM 283 CB GLU A 17 -11.363 17.255 -5.362 1.00 0.00 C
+ATOM 284 CG GLU A 17 -11.930 18.156 -4.274 1.00 0.00 C
+ATOM 285 CD GLU A 17 -12.849 17.429 -3.332 1.00 0.00 C
+ATOM 286 OE1 GLU A 17 -13.739 16.760 -3.799 1.00 0.00 O
+ATOM 287 OE2 GLU A 17 -12.661 17.543 -2.144 1.00 0.00 O
+ATOM 288 H GLU A 17 -8.910 17.613 -4.671 1.00 0.00 H
+ATOM 289 HA GLU A 17 -10.949 15.636 -4.017 1.00 0.00 H
+ATOM 290 1HB GLU A 17 -10.811 17.882 -6.062 1.00 0.00 H
+ATOM 291 2HB GLU A 17 -12.202 16.818 -5.905 1.00 0.00 H
+ATOM 292 1HG GLU A 17 -11.105 18.581 -3.702 1.00 0.00 H
+ATOM 293 2HG GLU A 17 -12.472 18.977 -4.742 1.00 0.00 H
+ATOM 294 N LEU A 18 -9.233 15.385 -6.801 1.00 0.00 N
+ATOM 295 CA LEU A 18 -8.815 14.428 -7.819 1.00 0.00 C
+ATOM 296 C LEU A 18 -8.181 13.195 -7.188 1.00 0.00 C
+ATOM 297 O LEU A 18 -8.396 12.072 -7.645 1.00 0.00 O
+ATOM 298 CB LEU A 18 -7.821 15.083 -8.786 1.00 0.00 C
+ATOM 299 CG LEU A 18 -7.308 14.187 -9.921 1.00 0.00 C
+ATOM 300 CD1 LEU A 18 -8.487 13.679 -10.740 1.00 0.00 C
+ATOM 301 CD2 LEU A 18 -6.337 14.972 -10.789 1.00 0.00 C
+ATOM 302 H LEU A 18 -8.763 16.278 -6.743 1.00 0.00 H
+ATOM 303 HA LEU A 18 -9.695 14.119 -8.385 1.00 0.00 H
+ATOM 304 1HB LEU A 18 -8.299 15.950 -9.240 1.00 0.00 H
+ATOM 305 2HB LEU A 18 -6.957 15.426 -8.218 1.00 0.00 H
+ATOM 306 HG LEU A 18 -6.798 13.321 -9.498 1.00 0.00 H
+ATOM 307 1HD1 LEU A 18 -8.122 13.042 -11.546 1.00 0.00 H
+ATOM 308 2HD1 LEU A 18 -9.155 13.104 -10.099 1.00 0.00 H
+ATOM 309 3HD1 LEU A 18 -9.027 14.525 -11.163 1.00 0.00 H
+ATOM 310 1HD2 LEU A 18 -5.971 14.335 -11.595 1.00 0.00 H
+ATOM 311 2HD2 LEU A 18 -6.846 15.838 -11.213 1.00 0.00 H
+ATOM 312 3HD2 LEU A 18 -5.496 15.308 -10.182 1.00 0.00 H
+ATOM 313 N ALA A 19 -7.399 13.411 -6.136 1.00 0.00 N
+ATOM 314 CA ALA A 19 -6.732 12.317 -5.441 1.00 0.00 C
+ATOM 315 C ALA A 19 -7.738 11.299 -4.920 1.00 0.00 C
+ATOM 316 O ALA A 19 -7.513 10.091 -5.001 1.00 0.00 O
+ATOM 317 CB ALA A 19 -5.884 12.855 -4.297 1.00 0.00 C
+ATOM 318 H ALA A 19 -7.264 14.357 -5.809 1.00 0.00 H
+ATOM 319 HA ALA A 19 -6.061 11.819 -6.142 1.00 0.00 H
+ATOM 320 1HB ALA A 19 -5.392 12.026 -3.787 1.00 0.00 H
+ATOM 321 2HB ALA A 19 -5.131 13.537 -4.691 1.00 0.00 H
+ATOM 322 3HB ALA A 19 -6.521 13.387 -3.592 1.00 0.00 H
+ATOM 323 N LYS A 20 -8.850 11.793 -4.386 1.00 0.00 N
+ATOM 324 CA LYS A 20 -9.929 10.927 -3.925 1.00 0.00 C
+ATOM 325 C LYS A 20 -10.535 10.140 -5.080 1.00 0.00 C
+ATOM 326 O LYS A 20 -10.827 8.952 -4.948 1.00 0.00 O
+ATOM 327 CB LYS A 20 -11.011 11.748 -3.222 1.00 0.00 C
+ATOM 328 CG LYS A 20 -10.623 12.246 -1.837 1.00 0.00 C
+ATOM 329 CD LYS A 20 -11.799 12.912 -1.139 1.00 0.00 C
+ATOM 330 CE LYS A 20 -11.995 14.341 -1.624 1.00 0.00 C
+ATOM 331 NZ LYS A 20 -12.977 15.083 -0.787 1.00 0.00 N
+ATOM 332 H LYS A 20 -8.950 12.794 -4.297 1.00 0.00 H
+ATOM 333 HA LYS A 20 -9.521 10.224 -3.198 1.00 0.00 H
+ATOM 334 1HB LYS A 20 -11.262 12.617 -3.832 1.00 0.00 H
+ATOM 335 2HB LYS A 20 -11.915 11.148 -3.121 1.00 0.00 H
+ATOM 336 1HG LYS A 20 -10.280 11.407 -1.231 1.00 0.00 H
+ATOM 337 2HG LYS A 20 -9.808 12.965 -1.923 1.00 0.00 H
+ATOM 338 1HD LYS A 20 -12.708 12.342 -1.334 1.00 0.00 H
+ATOM 339 2HD LYS A 20 -11.624 12.925 -0.063 1.00 0.00 H
+ATOM 340 1HE LYS A 20 -11.043 14.868 -1.599 1.00 0.00 H
+ATOM 341 2HE LYS A 20 -12.351 14.329 -2.654 1.00 0.00 H
+ATOM 342 1HZ LYS A 20 -13.079 16.024 -1.142 1.00 0.00 H
+ATOM 343 2HZ LYS A 20 -13.871 14.613 -0.819 1.00 0.00 H
+ATOM 344 3HZ LYS A 20 -12.648 15.117 0.167 1.00 0.00 H
+ATOM 345 N LYS A 21 -10.723 10.810 -6.212 1.00 0.00 N
+ATOM 346 CA LYS A 21 -11.254 10.164 -7.406 1.00 0.00 C
+ATOM 347 C LYS A 21 -10.302 9.092 -7.921 1.00 0.00 C
+ATOM 348 O LYS A 21 -10.729 8.014 -8.332 1.00 0.00 O
+ATOM 349 CB LYS A 21 -11.524 11.198 -8.500 1.00 0.00 C
+ATOM 350 CG LYS A 21 -12.703 12.119 -8.218 1.00 0.00 C
+ATOM 351 CD LYS A 21 -12.883 13.143 -9.329 1.00 0.00 C
+ATOM 352 CE LYS A 21 -14.040 14.084 -9.033 1.00 0.00 C
+ATOM 353 NZ LYS A 21 -14.208 15.111 -10.097 1.00 0.00 N
+ATOM 354 H LYS A 21 -10.493 11.793 -6.246 1.00 0.00 H
+ATOM 355 HA LYS A 21 -12.205 9.693 -7.151 1.00 0.00 H
+ATOM 356 1HB LYS A 21 -10.639 11.820 -8.639 1.00 0.00 H
+ATOM 357 2HB LYS A 21 -11.716 10.687 -9.444 1.00 0.00 H
+ATOM 358 1HG LYS A 21 -13.615 11.527 -8.130 1.00 0.00 H
+ATOM 359 2HG LYS A 21 -12.539 12.642 -7.276 1.00 0.00 H
+ATOM 360 1HD LYS A 21 -11.968 13.727 -9.437 1.00 0.00 H
+ATOM 361 2HD LYS A 21 -13.077 12.628 -10.270 1.00 0.00 H
+ATOM 362 1HE LYS A 21 -14.963 13.512 -8.949 1.00 0.00 H
+ATOM 363 2HE LYS A 21 -13.865 14.589 -8.083 1.00 0.00 H
+ATOM 364 1HZ LYS A 21 -14.984 15.715 -9.864 1.00 0.00 H
+ATOM 365 2HZ LYS A 21 -13.364 15.662 -10.171 1.00 0.00 H
+ATOM 366 3HZ LYS A 21 -14.391 14.656 -10.980 1.00 0.00 H
+ATOM 367 N MET A 22 -9.008 9.395 -7.896 1.00 0.00 N
+ATOM 368 CA MET A 22 -7.991 8.451 -8.342 1.00 0.00 C
+ATOM 369 C MET A 22 -7.863 7.282 -7.374 1.00 0.00 C
+ATOM 370 O MET A 22 -7.567 6.158 -7.778 1.00 0.00 O
+ATOM 371 CB MET A 22 -6.647 9.159 -8.503 1.00 0.00 C
+ATOM 372 CG MET A 22 -6.620 10.217 -9.597 1.00 0.00 C
+ATOM 373 SD MET A 22 -7.239 9.600 -11.175 1.00 0.00 S
+ATOM 374 CE MET A 22 -5.953 8.432 -11.609 1.00 0.00 C
+ATOM 375 H MET A 22 -8.722 10.304 -7.559 1.00 0.00 H
+ATOM 376 HA MET A 22 -8.282 8.065 -9.319 1.00 0.00 H
+ATOM 377 1HB MET A 22 -6.377 9.642 -7.565 1.00 0.00 H
+ATOM 378 2HB MET A 22 -5.873 8.425 -8.728 1.00 0.00 H
+ATOM 379 1HG MET A 22 -7.231 11.067 -9.296 1.00 0.00 H
+ATOM 380 2HG MET A 22 -5.598 10.566 -9.741 1.00 0.00 H
+ATOM 381 1HE MET A 22 -6.193 7.965 -12.565 1.00 0.00 H
+ATOM 382 2HE MET A 22 -4.998 8.953 -11.688 1.00 0.00 H
+ATOM 383 3HE MET A 22 -5.884 7.664 -10.838 1.00 0.00 H
+ATOM 384 N GLN A 23 -8.087 7.554 -6.092 1.00 0.00 N
+ATOM 385 CA GLN A 23 -8.086 6.509 -5.076 1.00 0.00 C
+ATOM 386 C GLN A 23 -9.200 5.499 -5.322 1.00 0.00 C
+ATOM 387 O GLN A 23 -9.007 4.294 -5.156 1.00 0.00 O
+ATOM 388 CB GLN A 23 -8.233 7.119 -3.679 1.00 0.00 C
+ATOM 389 CG GLN A 23 -8.179 6.106 -2.548 1.00 0.00 C
+ATOM 390 CD GLN A 23 -8.230 6.762 -1.182 1.00 0.00 C
+ATOM 391 OE1 GLN A 23 -7.838 7.920 -1.018 1.00 0.00 O
+ATOM 392 NE2 GLN A 23 -8.716 6.023 -0.190 1.00 0.00 N
+ATOM 393 H GLN A 23 -8.264 8.509 -5.816 1.00 0.00 H
+ATOM 394 HA GLN A 23 -7.128 5.989 -5.115 1.00 0.00 H
+ATOM 395 1HB GLN A 23 -7.441 7.849 -3.516 1.00 0.00 H
+ATOM 396 2HB GLN A 23 -9.184 7.648 -3.612 1.00 0.00 H
+ATOM 397 1HG GLN A 23 -9.031 5.432 -2.637 1.00 0.00 H
+ATOM 398 2HG GLN A 23 -7.248 5.543 -2.623 1.00 0.00 H
+ATOM 399 1HE2 GLN A 23 -8.774 6.403 0.734 1.00 0.00 H
+ATOM 400 2HE2 GLN A 23 -9.023 5.088 -0.367 1.00 0.00 H
+ATOM 401 N LYS A 24 -10.366 5.997 -5.720 1.00 0.00 N
+ATOM 402 CA LYS A 24 -11.504 5.137 -6.020 1.00 0.00 C
+ATOM 403 C LYS A 24 -11.188 4.185 -7.167 1.00 0.00 C
+ATOM 404 O LYS A 24 -11.510 2.999 -7.108 1.00 0.00 O
+ATOM 405 CB LYS A 24 -12.736 5.977 -6.357 1.00 0.00 C
+ATOM 406 CG LYS A 24 -13.357 6.691 -5.164 1.00 0.00 C
+ATOM 407 CD LYS A 24 -14.548 7.538 -5.585 1.00 0.00 C
+ATOM 408 CE LYS A 24 -15.149 8.279 -4.399 1.00 0.00 C
+ATOM 409 NZ LYS A 24 -16.297 9.136 -4.801 1.00 0.00 N
+ATOM 410 H LYS A 24 -10.466 6.997 -5.817 1.00 0.00 H
+ATOM 411 HA LYS A 24 -11.736 4.548 -5.131 1.00 0.00 H
+ATOM 412 1HB LYS A 24 -12.470 6.732 -7.098 1.00 0.00 H
+ATOM 413 2HB LYS A 24 -13.502 5.339 -6.800 1.00 0.00 H
+ATOM 414 1HG LYS A 24 -13.686 5.955 -4.430 1.00 0.00 H
+ATOM 415 2HG LYS A 24 -12.611 7.334 -4.697 1.00 0.00 H
+ATOM 416 1HD LYS A 24 -14.232 8.265 -6.334 1.00 0.00 H
+ATOM 417 2HD LYS A 24 -15.312 6.898 -6.025 1.00 0.00 H
+ATOM 418 1HE LYS A 24 -15.491 7.560 -3.656 1.00 0.00 H
+ATOM 419 2HE LYS A 24 -14.386 8.908 -3.939 1.00 0.00 H
+ATOM 420 1HZ LYS A 24 -16.665 9.609 -3.989 1.00 0.00 H
+ATOM 421 2HZ LYS A 24 -15.986 9.820 -5.477 1.00 0.00 H
+ATOM 422 3HZ LYS A 24 -17.019 8.562 -5.212 1.00 0.00 H
+ATOM 423 N LEU A 25 -10.557 4.713 -8.210 1.00 0.00 N
+ATOM 424 CA LEU A 25 -10.140 3.900 -9.346 1.00 0.00 C
+ATOM 425 C LEU A 25 -9.126 2.844 -8.924 1.00 0.00 C
+ATOM 426 O LEU A 25 -9.192 1.696 -9.364 1.00 0.00 O
+ATOM 427 CB LEU A 25 -9.537 4.788 -10.441 1.00 0.00 C
+ATOM 428 CG LEU A 25 -10.520 5.724 -11.155 1.00 0.00 C
+ATOM 429 CD1 LEU A 25 -9.747 6.709 -12.020 1.00 0.00 C
+ATOM 430 CD2 LEU A 25 -11.487 4.901 -11.994 1.00 0.00 C
+ATOM 431 H LEU A 25 -10.361 5.704 -8.216 1.00 0.00 H
+ATOM 432 HA LEU A 25 -11.019 3.398 -9.753 1.00 0.00 H
+ATOM 433 1HB LEU A 25 -8.756 5.403 -9.998 1.00 0.00 H
+ATOM 434 2HB LEU A 25 -9.081 4.147 -11.196 1.00 0.00 H
+ATOM 435 HG LEU A 25 -11.079 6.297 -10.415 1.00 0.00 H
+ATOM 436 1HD1 LEU A 25 -10.445 7.375 -12.528 1.00 0.00 H
+ATOM 437 2HD1 LEU A 25 -9.077 7.298 -11.393 1.00 0.00 H
+ATOM 438 3HD1 LEU A 25 -9.164 6.163 -12.761 1.00 0.00 H
+ATOM 439 1HD2 LEU A 25 -12.186 5.567 -12.500 1.00 0.00 H
+ATOM 440 2HD2 LEU A 25 -10.929 4.328 -12.735 1.00 0.00 H
+ATOM 441 3HD2 LEU A 25 -12.039 4.218 -11.348 1.00 0.00 H
+ATOM 442 N LEU A 26 -8.189 3.238 -8.069 1.00 0.00 N
+ATOM 443 CA LEU A 26 -7.161 2.325 -7.584 1.00 0.00 C
+ATOM 444 C LEU A 26 -7.769 1.206 -6.749 1.00 0.00 C
+ATOM 445 O LEU A 26 -7.463 0.031 -6.952 1.00 0.00 O
+ATOM 446 CB LEU A 26 -6.125 3.089 -6.750 1.00 0.00 C
+ATOM 447 CG LEU A 26 -5.001 2.239 -6.144 1.00 0.00 C
+ATOM 448 CD1 LEU A 26 -4.211 1.571 -7.261 1.00 0.00 C
+ATOM 449 CD2 LEU A 26 -4.102 3.120 -5.290 1.00 0.00 C
+ATOM 450 H LEU A 26 -8.189 4.196 -7.747 1.00 0.00 H
+ATOM 451 HA LEU A 26 -6.655 1.885 -8.444 1.00 0.00 H
+ATOM 452 1HB LEU A 26 -5.663 3.848 -7.380 1.00 0.00 H
+ATOM 453 2HB LEU A 26 -6.639 3.591 -5.930 1.00 0.00 H
+ATOM 454 HG LEU A 26 -5.433 1.452 -5.525 1.00 0.00 H
+ATOM 455 1HD1 LEU A 26 -3.412 0.966 -6.831 1.00 0.00 H
+ATOM 456 2HD1 LEU A 26 -4.874 0.932 -7.844 1.00 0.00 H
+ATOM 457 3HD1 LEU A 26 -3.779 2.334 -7.908 1.00 0.00 H
+ATOM 458 1HD2 LEU A 26 -3.303 2.515 -4.859 1.00 0.00 H
+ATOM 459 2HD2 LEU A 26 -3.668 3.906 -5.908 1.00 0.00 H
+ATOM 460 3HD2 LEU A 26 -4.688 3.570 -4.489 1.00 0.00 H
+ATOM 461 N GLU A 27 -8.630 1.577 -5.808 1.00 0.00 N
+ATOM 462 CA GLU A 27 -9.239 0.610 -4.902 1.00 0.00 C
+ATOM 463 C GLU A 27 -10.160 -0.344 -5.652 1.00 0.00 C
+ATOM 464 O GLU A 27 -10.269 -1.519 -5.302 1.00 0.00 O
+ATOM 465 CB GLU A 27 -10.021 1.330 -3.801 1.00 0.00 C
+ATOM 466 CG GLU A 27 -9.152 2.040 -2.773 1.00 0.00 C
+ATOM 467 CD GLU A 27 -9.953 2.807 -1.759 1.00 0.00 C
+ATOM 468 OE1 GLU A 27 -11.149 2.884 -1.909 1.00 0.00 O
+ATOM 469 OE2 GLU A 27 -9.369 3.317 -0.832 1.00 0.00 O
+ATOM 470 H GLU A 27 -8.870 2.554 -5.718 1.00 0.00 H
+ATOM 471 HA GLU A 27 -8.445 0.031 -4.430 1.00 0.00 H
+ATOM 472 1HB GLU A 27 -10.682 2.072 -4.250 1.00 0.00 H
+ATOM 473 2HB GLU A 27 -10.647 0.612 -3.271 1.00 0.00 H
+ATOM 474 1HG GLU A 27 -8.543 1.300 -2.254 1.00 0.00 H
+ATOM 475 2HG GLU A 27 -8.480 2.724 -3.291 1.00 0.00 H
+ATOM 476 N ASN A 28 -10.821 0.169 -6.684 1.00 0.00 N
+ATOM 477 CA ASN A 28 -11.753 -0.630 -7.469 1.00 0.00 C
+ATOM 478 C ASN A 28 -11.015 -1.603 -8.380 1.00 0.00 C
+ATOM 479 O ASN A 28 -11.629 -2.454 -9.023 1.00 0.00 O
+ATOM 480 CB ASN A 28 -12.673 0.265 -8.279 1.00 0.00 C
+ATOM 481 CG ASN A 28 -13.679 0.984 -7.424 1.00 0.00 C
+ATOM 482 OD1 ASN A 28 -13.983 0.553 -6.306 1.00 0.00 O
+ATOM 483 ND2 ASN A 28 -14.202 2.073 -7.928 1.00 0.00 N
+ATOM 484 H ASN A 28 -10.673 1.137 -6.931 1.00 0.00 H
+ATOM 485 HA ASN A 28 -12.371 -1.213 -6.786 1.00 0.00 H
+ATOM 486 1HB ASN A 28 -12.080 1.003 -8.820 1.00 0.00 H
+ATOM 487 2HB ASN A 28 -13.205 -0.333 -9.019 1.00 0.00 H
+ATOM 488 1HD2 ASN A 28 -14.877 2.593 -7.403 1.00 0.00 H
+ATOM 489 2HD2 ASN A 28 -13.927 2.385 -8.836 1.00 0.00 H
+ATOM 490 N GLY A 29 -9.693 -1.472 -8.429 1.00 0.00 N
+ATOM 491 CA GLY A 29 -8.867 -2.345 -9.254 1.00 0.00 C
+ATOM 492 C GLY A 29 -8.951 -1.954 -10.724 1.00 0.00 C
+ATOM 493 O GLY A 29 -8.730 -2.781 -11.610 1.00 0.00 O
+ATOM 494 H GLY A 29 -9.250 -0.748 -7.881 1.00 0.00 H
+ATOM 495 1HA GLY A 29 -7.832 -2.290 -8.918 1.00 0.00 H
+ATOM 496 2HA GLY A 29 -9.192 -3.377 -9.129 1.00 0.00 H
+ATOM 497 N TYR A 30 -9.272 -0.690 -10.978 1.00 0.00 N
+ATOM 498 CA TYR A 30 -9.386 -0.188 -12.342 1.00 0.00 C
+ATOM 499 C TYR A 30 -8.051 -0.265 -13.071 1.00 0.00 C
+ATOM 500 O TYR A 30 -7.975 -0.756 -14.198 1.00 0.00 O
+ATOM 501 CB TYR A 30 -9.909 1.250 -12.341 1.00 0.00 C
+ATOM 502 CG TYR A 30 -9.957 1.883 -13.714 1.00 0.00 C
+ATOM 503 CD1 TYR A 30 -10.995 1.577 -14.583 1.00 0.00 C
+ATOM 504 CD2 TYR A 30 -8.964 2.769 -14.105 1.00 0.00 C
+ATOM 505 CE1 TYR A 30 -11.039 2.156 -15.837 1.00 0.00 C
+ATOM 506 CE2 TYR A 30 -9.009 3.347 -15.358 1.00 0.00 C
+ATOM 507 CZ TYR A 30 -10.041 3.043 -16.222 1.00 0.00 C
+ATOM 508 OH TYR A 30 -10.085 3.619 -17.471 1.00 0.00 O
+ATOM 509 H TYR A 30 -9.441 -0.061 -10.207 1.00 0.00 H
+ATOM 510 HA TYR A 30 -10.112 -0.802 -12.877 1.00 0.00 H
+ATOM 511 1HB TYR A 30 -10.915 1.272 -11.921 1.00 0.00 H
+ATOM 512 2HB TYR A 30 -9.275 1.867 -11.705 1.00 0.00 H
+ATOM 513 HD1 TYR A 30 -11.775 0.881 -14.276 1.00 0.00 H
+ATOM 514 HD2 TYR A 30 -8.148 3.009 -13.423 1.00 0.00 H
+ATOM 515 HE1 TYR A 30 -11.854 1.915 -16.519 1.00 0.00 H
+ATOM 516 HE2 TYR A 30 -8.228 4.043 -15.666 1.00 0.00 H
+ATOM 517 HH TYR A 30 -10.882 3.335 -17.925 1.00 0.00 H
+ATOM 518 N ALA A 31 -7.000 0.225 -12.423 1.00 0.00 N
+ATOM 519 CA ALA A 31 -5.667 0.226 -13.015 1.00 0.00 C
+ATOM 520 C ALA A 31 -4.590 0.358 -11.946 1.00 0.00 C
+ATOM 521 O ALA A 31 -4.861 0.797 -10.828 1.00 0.00 O
+ATOM 522 CB ALA A 31 -5.541 1.350 -14.033 1.00 0.00 C
+ATOM 523 H ALA A 31 -7.127 0.605 -11.496 1.00 0.00 H
+ATOM 524 HA ALA A 31 -5.520 -0.728 -13.521 1.00 0.00 H
+ATOM 525 1HB ALA A 31 -4.541 1.338 -14.466 1.00 0.00 H
+ATOM 526 2HB ALA A 31 -6.280 1.209 -14.823 1.00 0.00 H
+ATOM 527 3HB ALA A 31 -5.712 2.306 -13.543 1.00 0.00 H
+ATOM 528 N SER A 32 -3.367 -0.025 -12.295 1.00 0.00 N
+ATOM 529 CA SER A 32 -2.226 0.148 -11.404 1.00 0.00 C
+ATOM 530 C SER A 32 -1.835 1.615 -11.288 1.00 0.00 C
+ATOM 531 O SER A 32 -2.221 2.438 -12.118 1.00 0.00 O
+ATOM 532 CB SER A 32 -1.045 -0.661 -11.905 1.00 0.00 C
+ATOM 533 OG SER A 32 -0.512 -0.101 -13.073 1.00 0.00 O
+ATOM 534 H SER A 32 -3.223 -0.446 -13.202 1.00 0.00 H
+ATOM 535 HA SER A 32 -2.504 -0.212 -10.413 1.00 0.00 H
+ATOM 536 1HB SER A 32 -0.277 -0.699 -11.133 1.00 0.00 H
+ATOM 537 2HB SER A 32 -1.362 -1.685 -12.101 1.00 0.00 H
+ATOM 538 HG SER A 32 0.199 -0.685 -13.347 1.00 0.00 H
+ATOM 539 N ILE A 33 -1.067 1.937 -10.252 1.00 0.00 N
+ATOM 540 CA ILE A 33 -0.659 3.314 -10.000 1.00 0.00 C
+ATOM 541 C ILE A 33 0.302 3.810 -11.073 1.00 0.00 C
+ATOM 542 O ILE A 33 0.388 5.009 -11.337 1.00 0.00 O
+ATOM 543 CB ILE A 33 0.003 3.446 -8.616 1.00 0.00 C
+ATOM 544 CG1 ILE A 33 1.276 2.598 -8.551 1.00 0.00 C
+ATOM 545 CG2 ILE A 33 -0.969 3.038 -7.520 1.00 0.00 C
+ATOM 546 CD1 ILE A 33 2.080 2.801 -7.286 1.00 0.00 C
+ATOM 547 H ILE A 33 -0.757 1.210 -9.624 1.00 0.00 H
+ATOM 548 HA ILE A 33 -1.548 3.946 -10.009 1.00 0.00 H
+ATOM 549 HB ILE A 33 0.305 4.480 -8.454 1.00 0.00 H
+ATOM 550 1HG1 ILE A 33 1.014 1.543 -8.623 1.00 0.00 H
+ATOM 551 2HG1 ILE A 33 1.915 2.835 -9.401 1.00 0.00 H
+ATOM 552 1HG2 ILE A 33 -0.485 3.137 -6.549 1.00 0.00 H
+ATOM 553 2HG2 ILE A 33 -1.847 3.682 -7.555 1.00 0.00 H
+ATOM 554 3HG2 ILE A 33 -1.273 2.002 -7.671 1.00 0.00 H
+ATOM 555 1HD1 ILE A 33 2.967 2.167 -7.314 1.00 0.00 H
+ATOM 556 2HD1 ILE A 33 2.383 3.846 -7.211 1.00 0.00 H
+ATOM 557 3HD1 ILE A 33 1.472 2.536 -6.423 1.00 0.00 H
+ATOM 558 N GLU A 34 1.024 2.880 -11.689 1.00 0.00 N
+ATOM 559 CA GLU A 34 1.847 3.193 -12.850 1.00 0.00 C
+ATOM 560 C GLU A 34 0.987 3.571 -14.050 1.00 0.00 C
+ATOM 561 O GLU A 34 1.298 4.515 -14.776 1.00 0.00 O
+ATOM 562 CB GLU A 34 2.742 2.004 -13.206 1.00 0.00 C
+ATOM 563 CG GLU A 34 3.786 1.665 -12.152 1.00 0.00 C
+ATOM 564 CD GLU A 34 3.221 0.883 -10.999 1.00 0.00 C
+ATOM 565 OE1 GLU A 34 2.074 0.511 -11.064 1.00 0.00 O
+ATOM 566 OE2 GLU A 34 3.937 0.658 -10.052 1.00 0.00 O
+ATOM 567 H GLU A 34 1.001 1.931 -11.343 1.00 0.00 H
+ATOM 568 HA GLU A 34 2.490 4.039 -12.601 1.00 0.00 H
+ATOM 569 1HB GLU A 34 2.126 1.119 -13.364 1.00 0.00 H
+ATOM 570 2HB GLU A 34 3.265 2.209 -14.141 1.00 0.00 H
+ATOM 571 1HG GLU A 34 4.581 1.082 -12.617 1.00 0.00 H
+ATOM 572 2HG GLU A 34 4.223 2.590 -11.778 1.00 0.00 H
+ATOM 573 N GLN A 35 -0.096 2.828 -14.252 1.00 0.00 N
+ATOM 574 CA GLN A 35 -1.031 3.115 -15.333 1.00 0.00 C
+ATOM 575 C GLN A 35 -1.805 4.399 -15.066 1.00 0.00 C
+ATOM 576 O GLN A 35 -2.014 5.209 -15.969 1.00 0.00 O
+ATOM 577 CB GLN A 35 -2.003 1.948 -15.525 1.00 0.00 C
+ATOM 578 CG GLN A 35 -1.367 0.696 -16.104 1.00 0.00 C
+ATOM 579 CD GLN A 35 -2.311 -0.492 -16.091 1.00 0.00 C
+ATOM 580 OE1 GLN A 35 -2.895 -0.827 -15.056 1.00 0.00 O
+ATOM 581 NE2 GLN A 35 -2.465 -1.136 -17.242 1.00 0.00 N
+ATOM 582 H GLN A 35 -0.277 2.045 -13.640 1.00 0.00 H
+ATOM 583 HA GLN A 35 -0.464 3.234 -16.258 1.00 0.00 H
+ATOM 584 1HB GLN A 35 -2.450 1.686 -14.565 1.00 0.00 H
+ATOM 585 2HB GLN A 35 -2.811 2.253 -16.189 1.00 0.00 H
+ATOM 586 1HG GLN A 35 -1.078 0.892 -17.136 1.00 0.00 H
+ATOM 587 2HG GLN A 35 -0.488 0.441 -15.512 1.00 0.00 H
+ATOM 588 1HE2 GLN A 35 -3.076 -1.928 -17.294 1.00 0.00 H
+ATOM 589 2HE2 GLN A 35 -1.973 -0.830 -18.056 1.00 0.00 H
+ATOM 590 N LEU A 36 -2.230 4.580 -13.820 1.00 0.00 N
+ATOM 591 CA LEU A 36 -3.005 5.754 -13.437 1.00 0.00 C
+ATOM 592 C LEU A 36 -2.170 7.023 -13.544 1.00 0.00 C
+ATOM 593 O LEU A 36 -2.668 8.072 -13.955 1.00 0.00 O
+ATOM 594 CB LEU A 36 -3.529 5.599 -12.004 1.00 0.00 C
+ATOM 595 CG LEU A 36 -4.562 4.485 -11.790 1.00 0.00 C
+ATOM 596 CD1 LEU A 36 -4.762 4.256 -10.298 1.00 0.00 C
+ATOM 597 CD2 LEU A 36 -5.871 4.871 -12.464 1.00 0.00 C
+ATOM 598 H LEU A 36 -2.010 3.885 -13.120 1.00 0.00 H
+ATOM 599 HA LEU A 36 -3.859 5.839 -14.109 1.00 0.00 H
+ATOM 600 1HB LEU A 36 -2.685 5.398 -11.345 1.00 0.00 H
+ATOM 601 2HB LEU A 36 -3.986 6.539 -11.697 1.00 0.00 H
+ATOM 602 HG LEU A 36 -4.191 3.556 -12.224 1.00 0.00 H
+ATOM 603 1HD1 LEU A 36 -5.496 3.465 -10.146 1.00 0.00 H
+ATOM 604 2HD1 LEU A 36 -3.815 3.963 -9.845 1.00 0.00 H
+ATOM 605 3HD1 LEU A 36 -5.117 5.175 -9.833 1.00 0.00 H
+ATOM 606 1HD2 LEU A 36 -6.605 4.080 -12.313 1.00 0.00 H
+ATOM 607 2HD2 LEU A 36 -6.243 5.800 -12.030 1.00 0.00 H
+ATOM 608 3HD2 LEU A 36 -5.703 5.012 -13.532 1.00 0.00 H
+ATOM 609 N GLN A 37 -0.898 6.923 -13.173 1.00 0.00 N
+ATOM 610 CA GLN A 37 0.022 8.049 -13.277 1.00 0.00 C
+ATOM 611 C GLN A 37 0.181 8.499 -14.723 1.00 0.00 C
+ATOM 612 O GLN A 37 0.180 9.695 -15.015 1.00 0.00 O
+ATOM 613 CB GLN A 37 1.387 7.681 -12.690 1.00 0.00 C
+ATOM 614 CG GLN A 37 2.421 8.792 -12.775 1.00 0.00 C
+ATOM 615 CD GLN A 37 2.072 9.975 -11.893 1.00 0.00 C
+ATOM 616 OE1 GLN A 37 1.649 9.809 -10.745 1.00 0.00 O
+ATOM 617 NE2 GLN A 37 2.248 11.180 -12.424 1.00 0.00 N
+ATOM 618 H GLN A 37 -0.560 6.043 -12.810 1.00 0.00 H
+ATOM 619 HA GLN A 37 -0.381 8.879 -12.695 1.00 0.00 H
+ATOM 620 1HB GLN A 37 1.272 7.409 -11.641 1.00 0.00 H
+ATOM 621 2HB GLN A 37 1.785 6.811 -13.212 1.00 0.00 H
+ATOM 622 1HG GLN A 37 3.387 8.400 -12.456 1.00 0.00 H
+ATOM 623 2HG GLN A 37 2.481 9.140 -13.806 1.00 0.00 H
+ATOM 624 1HE2 GLN A 37 2.034 11.999 -11.889 1.00 0.00 H
+ATOM 625 2HE2 GLN A 37 2.593 11.270 -13.358 1.00 0.00 H
+ATOM 626 N LYS A 38 0.319 7.534 -15.626 1.00 0.00 N
+ATOM 627 CA LYS A 38 0.435 7.827 -17.049 1.00 0.00 C
+ATOM 628 C LYS A 38 -0.824 8.504 -17.577 1.00 0.00 C
+ATOM 629 O LYS A 38 -0.749 9.441 -18.372 1.00 0.00 O
+ATOM 630 CB LYS A 38 0.714 6.547 -17.839 1.00 0.00 C
+ATOM 631 CG LYS A 38 2.117 5.987 -17.653 1.00 0.00 C
+ATOM 632 CD LYS A 38 2.301 4.689 -18.426 1.00 0.00 C
+ATOM 633 CE LYS A 38 3.696 4.117 -18.225 1.00 0.00 C
+ATOM 634 NZ LYS A 38 3.883 2.835 -18.958 1.00 0.00 N
+ATOM 635 H LYS A 38 0.344 6.572 -15.318 1.00 0.00 H
+ATOM 636 HA LYS A 38 1.281 8.499 -17.196 1.00 0.00 H
+ATOM 637 1HB LYS A 38 0.003 5.775 -17.543 1.00 0.00 H
+ATOM 638 2HB LYS A 38 0.567 6.737 -18.903 1.00 0.00 H
+ATOM 639 1HG LYS A 38 2.850 6.715 -18.004 1.00 0.00 H
+ATOM 640 2HG LYS A 38 2.296 5.798 -16.595 1.00 0.00 H
+ATOM 641 1HD LYS A 38 1.565 3.957 -18.089 1.00 0.00 H
+ATOM 642 2HD LYS A 38 2.144 4.873 -19.489 1.00 0.00 H
+ATOM 643 1HE LYS A 38 4.437 4.834 -18.577 1.00 0.00 H
+ATOM 644 2HE LYS A 38 3.869 3.942 -17.163 1.00 0.00 H
+ATOM 645 1HZ LYS A 38 4.819 2.489 -18.799 1.00 0.00 H
+ATOM 646 2HZ LYS A 38 3.213 2.156 -18.626 1.00 0.00 H
+ATOM 647 3HZ LYS A 38 3.745 2.989 -19.947 1.00 0.00 H
+ATOM 648 N GLN A 39 -1.979 8.025 -17.129 1.00 0.00 N
+ATOM 649 CA GLN A 39 -3.257 8.581 -17.557 1.00 0.00 C
+ATOM 650 C GLN A 39 -3.401 10.032 -17.116 1.00 0.00 C
+ATOM 651 O GLN A 39 -3.939 10.863 -17.848 1.00 0.00 O
+ATOM 652 CB GLN A 39 -4.417 7.749 -17.003 1.00 0.00 C
+ATOM 653 CG GLN A 39 -4.559 6.378 -17.640 1.00 0.00 C
+ATOM 654 CD GLN A 39 -5.569 5.506 -16.918 1.00 0.00 C
+ATOM 655 OE1 GLN A 39 -6.060 5.861 -15.843 1.00 0.00 O
+ATOM 656 NE2 GLN A 39 -5.885 4.358 -17.506 1.00 0.00 N
+ATOM 657 H GLN A 39 -1.972 7.254 -16.476 1.00 0.00 H
+ATOM 658 HA GLN A 39 -3.305 8.540 -18.646 1.00 0.00 H
+ATOM 659 1HB GLN A 39 -4.285 7.610 -15.930 1.00 0.00 H
+ATOM 660 2HB GLN A 39 -5.353 8.287 -17.150 1.00 0.00 H
+ATOM 661 1HG GLN A 39 -4.888 6.500 -18.672 1.00 0.00 H
+ATOM 662 2HG GLN A 39 -3.592 5.874 -17.614 1.00 0.00 H
+ATOM 663 1HE2 GLN A 39 -6.546 3.741 -17.077 1.00 0.00 H
+ATOM 664 2HE2 GLN A 39 -5.462 4.108 -18.378 1.00 0.00 H
+ATOM 665 N LEU A 40 -2.917 10.331 -15.916 1.00 0.00 N
+ATOM 666 CA LEU A 40 -2.959 11.690 -15.389 1.00 0.00 C
+ATOM 667 C LEU A 40 -2.102 12.632 -16.226 1.00 0.00 C
+ATOM 668 O LEU A 40 -2.466 13.787 -16.447 1.00 0.00 O
+ATOM 669 CB LEU A 40 -2.478 11.710 -13.933 1.00 0.00 C
+ATOM 670 CG LEU A 40 -3.451 11.120 -12.904 1.00 0.00 C
+ATOM 671 CD1 LEU A 40 -2.713 10.859 -11.598 1.00 0.00 C
+ATOM 672 CD2 LEU A 40 -4.612 12.082 -12.693 1.00 0.00 C
+ATOM 673 H LEU A 40 -2.509 9.598 -15.353 1.00 0.00 H
+ATOM 674 HA LEU A 40 -3.991 12.040 -15.417 1.00 0.00 H
+ATOM 675 1HB LEU A 40 -1.547 11.150 -13.867 1.00 0.00 H
+ATOM 676 2HB LEU A 40 -2.278 12.742 -13.646 1.00 0.00 H
+ATOM 677 HG LEU A 40 -3.833 10.166 -13.268 1.00 0.00 H
+ATOM 678 1HD1 LEU A 40 -3.404 10.440 -10.866 1.00 0.00 H
+ATOM 679 2HD1 LEU A 40 -1.901 10.153 -11.774 1.00 0.00 H
+ATOM 680 3HD1 LEU A 40 -2.306 11.795 -11.217 1.00 0.00 H
+ATOM 681 1HD2 LEU A 40 -5.304 11.663 -11.962 1.00 0.00 H
+ATOM 682 2HD2 LEU A 40 -4.232 13.036 -12.327 1.00 0.00 H
+ATOM 683 3HD2 LEU A 40 -5.132 12.237 -13.638 1.00 0.00 H
+ATOM 684 N GLU A 41 -0.961 12.131 -16.688 1.00 0.00 N
+ATOM 685 CA GLU A 41 -0.024 12.943 -17.456 1.00 0.00 C
+ATOM 686 C GLU A 41 -0.514 13.147 -18.884 1.00 0.00 C
+ATOM 687 O GLU A 41 -0.308 14.207 -19.475 1.00 0.00 O
+ATOM 688 CB GLU A 41 1.360 12.290 -17.470 1.00 0.00 C
+ATOM 689 CG GLU A 41 2.055 12.260 -16.116 1.00 0.00 C
+ATOM 690 CD GLU A 41 3.329 11.462 -16.129 1.00 0.00 C
+ATOM 691 OE1 GLU A 41 3.731 11.038 -17.186 1.00 0.00 O
+ATOM 692 OE2 GLU A 41 3.901 11.276 -15.081 1.00 0.00 O
+ATOM 693 H GLU A 41 -0.737 11.164 -16.503 1.00 0.00 H
+ATOM 694 HA GLU A 41 0.065 13.917 -16.974 1.00 0.00 H
+ATOM 695 1HB GLU A 41 1.274 11.263 -17.825 1.00 0.00 H
+ATOM 696 2HB GLU A 41 2.007 12.824 -18.166 1.00 0.00 H
+ATOM 697 1HG GLU A 41 2.283 13.282 -15.813 1.00 0.00 H
+ATOM 698 2HG GLU A 41 1.373 11.836 -15.379 1.00 0.00 H
+ATOM 699 N LYS A 42 -1.163 12.126 -19.433 1.00 0.00 N
+ATOM 700 CA LYS A 42 -1.650 12.177 -20.807 1.00 0.00 C
+ATOM 701 C LYS A 42 -2.862 13.091 -20.928 1.00 0.00 C
+ATOM 702 O LYS A 42 -3.009 13.817 -21.911 1.00 0.00 O
+ATOM 703 CB LYS A 42 -1.998 10.773 -21.304 1.00 0.00 C
+ATOM 704 CG LYS A 42 -0.790 9.889 -21.588 1.00 0.00 C
+ATOM 705 CD LYS A 42 -1.216 8.505 -22.052 1.00 0.00 C
+ATOM 706 CE LYS A 42 -0.011 7.629 -22.363 1.00 0.00 C
+ATOM 707 NZ LYS A 42 -0.413 6.273 -22.826 1.00 0.00 N
+ATOM 708 H LYS A 42 -1.323 11.293 -18.885 1.00 0.00 H
+ATOM 709 HA LYS A 42 -0.853 12.567 -21.442 1.00 0.00 H
+ATOM 710 1HB LYS A 42 -2.616 10.267 -20.563 1.00 0.00 H
+ATOM 711 2HB LYS A 42 -2.582 10.847 -22.222 1.00 0.00 H
+ATOM 712 1HG LYS A 42 -0.176 10.350 -22.363 1.00 0.00 H
+ATOM 713 2HG LYS A 42 -0.190 9.792 -20.684 1.00 0.00 H
+ATOM 714 1HD LYS A 42 -1.811 8.027 -21.273 1.00 0.00 H
+ATOM 715 2HD LYS A 42 -1.829 8.594 -22.949 1.00 0.00 H
+ATOM 716 1HE LYS A 42 0.591 8.101 -23.138 1.00 0.00 H
+ATOM 717 2HE LYS A 42 0.604 7.526 -21.469 1.00 0.00 H
+ATOM 718 1HZ LYS A 42 0.413 5.725 -23.021 1.00 0.00 H
+ATOM 719 2HZ LYS A 42 -0.957 5.818 -22.106 1.00 0.00 H
+ATOM 720 3HZ LYS A 42 -0.968 6.354 -23.666 1.00 0.00 H
+ATOM 721 N ARG A 43 -3.729 13.052 -19.922 1.00 0.00 N
+ATOM 722 CA ARG A 43 -4.965 13.825 -19.945 1.00 0.00 C
+ATOM 723 C ARG A 43 -4.708 15.285 -19.596 1.00 0.00 C
+ATOM 724 O ARG A 43 -3.787 15.601 -18.843 1.00 0.00 O
+ATOM 725 OXT ARG A 43 -5.408 16.144 -20.057 1.00 0.00 O
+ATOM 726 CB ARG A 43 -5.978 13.244 -18.969 1.00 0.00 C
+ATOM 727 CG ARG A 43 -6.565 11.903 -19.379 1.00 0.00 C
+ATOM 728 CD ARG A 43 -7.440 11.339 -18.319 1.00 0.00 C
+ATOM 729 NE ARG A 43 -6.681 10.942 -17.144 1.00 0.00 N
+ATOM 730 CZ ARG A 43 -7.228 10.527 -15.985 1.00 0.00 C
+ATOM 731 NH1 ARG A 43 -8.536 10.460 -15.861 1.00 0.00 N
+ATOM 732 NH2 ARG A 43 -6.451 10.186 -14.972 1.00 0.00 N
+ATOM 733 H ARG A 43 -3.527 12.472 -19.120 1.00 0.00 H
+ATOM 734 HA ARG A 43 -5.376 13.790 -20.954 1.00 0.00 H
+ATOM 735 1HB ARG A 43 -5.511 13.115 -17.994 1.00 0.00 H
+ATOM 736 2HB ARG A 43 -6.806 13.942 -18.845 1.00 0.00 H
+ATOM 737 1HG ARG A 43 -7.159 12.027 -20.284 1.00 0.00 H
+ATOM 738 2HG ARG A 43 -5.757 11.195 -19.569 1.00 0.00 H
+ATOM 739 1HD ARG A 43 -8.171 12.087 -18.016 1.00 0.00 H
+ATOM 740 2HD ARG A 43 -7.957 10.461 -18.704 1.00 0.00 H
+ATOM 741 HE ARG A 43 -5.672 10.979 -17.201 1.00 0.00 H
+ATOM 742 1HH1 ARG A 43 -9.130 10.720 -16.636 1.00 0.00 H
+ATOM 743 2HH1 ARG A 43 -8.945 10.149 -14.993 1.00 0.00 H
+ATOM 744 1HH2 ARG A 43 -5.446 10.237 -15.067 1.00 0.00 H
+ATOM 745 2HH2 ARG A 43 -6.861 9.875 -14.103 1.00 0.00 H
+TER
+##Begin comments##
+BINARY SILENTFILE
+DSSP LHHHHHHHHHHHLLLHHHHHHHHHHHHLLLLLHHHHHHHHHHL
+PHI 0,-65.6799,-63.8104,-66.0263,-62.5271,-63.1416,-57.6222,-67.0053,-62.2625,-56.6742,-75.7099,-57.8253,-59.5951,-107.553,-158.662,-60.2188,-77.7239,-66.7359,-58.2893,-63.5141,-64.2113,-69.9906,-63.1678,-61.3419,-62.4798,-64.8606,-66.0919,-74.3867,76.6392,-63.1835,-159.692,-71.5312,-68.1504,-67.3677,-69.8458,-66.384,-61.5778,-62.7411,-63.4724,-64.4646,-76.1323,-73.1789,-78.7192
+PSI 169.096,-38.4861,-37.4453,-40.0341,-41.8348,-41.0619,-51.5816,-34.9416,-44.6638,-38.5331,-45.425,-36.898,-23.3969,-35.928,95.4854,-25.6739,-37.5483,-38.9789,-41.1155,-41.7877,-41.0823,-32.5856,-40.3212,-43.8018,-41.6542,-48.3199,-34.354,-7.22523,25.0225,-48.7312,160.462,162.465,-26.4203,-42.2544,-41.7621,-38.3438,-43.4532,-41.1213,-38.1019,-37.7779,-35.2113,-38.3446,0
+##End comments##
+
+AlaCount 2
+AverageDegree 13.465
+BuriedUnsatHbond 0
+Buried_non_polar_SASA_per_res 45.79
+CavityVolume 16.368
+CoreAverageDegree 19.625
+CoreResidueCount 8
+ExposeCoreHydrophobicsPerCoreResidue 10.509
+ExposeCoreHydrophobicsSASA 84.069
+ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent 4.454
+ExposedHydrophobics_on_TotalSASAPercent 2.384
+HasCoreResidueNum 7
+MaxDistanceToToMassCenter 7.56
+PackStat 0.616
+Rg 9.814
+SSShapeComplementarity 0.811
+ScorePerResFilter -1.753
+driftRMSD 0.801
+frac_helix 76.744
+frac_loop 23.256
+frac_sheet 0
+n_hydrophobic 13
+nres_helix 33
+nres_loop 10
+nres_sheet 0
+nres_total 43
+percent_core 0.163
+score -107.145
+ss_mismatch_probability 0.281
+
diff --git a/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb
new file mode 100644
index 0000000..308eabc
--- /dev/null
+++ b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb
@@ -0,0 +1,802 @@
+HEADER 31-AUG-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 31-AUG-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.31+release.c7009b3115c
+ATOM 1 N ASP A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA ASP A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C ASP A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O ASP A 1 1.297 2.372 -0.319 1.00 0.00 O
+ATOM 5 CB ASP A 1 1.995 -0.762 -1.214 1.00 0.00 C
+ATOM 6 CG ASP A 1 1.489 -0.200 -2.537 1.00 0.00 C
+ATOM 7 OD1 ASP A 1 1.024 0.915 -2.547 1.00 0.00 O
+ATOM 8 OD2 ASP A 1 1.573 -0.892 -3.523 1.00 0.00 O
+ATOM 9 1H ASP A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 10 2H ASP A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 11 3H ASP A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 12 HA ASP A 1 1.804 -0.502 0.905 1.00 0.00 H
+ATOM 13 1HB ASP A 1 3.084 -0.726 -1.214 1.00 0.00 H
+ATOM 14 2HB ASP A 1 1.701 -1.810 -1.145 1.00 0.00 H
+ATOM 15 N PRO A 2 3.281 1.556 0.359 1.00 0.00 N
+ATOM 16 CA PRO A 2 3.922 2.863 0.427 1.00 0.00 C
+ATOM 17 C PRO A 2 3.785 3.613 -0.892 1.00 0.00 C
+ATOM 18 O PRO A 2 3.659 4.837 -0.911 1.00 0.00 O
+ATOM 19 CB PRO A 2 5.383 2.515 0.729 1.00 0.00 C
+ATOM 20 CG PRO A 2 5.303 1.249 1.512 1.00 0.00 C
+ATOM 21 CD PRO A 2 4.198 0.470 0.850 1.00 0.00 C
+ATOM 22 HA PRO A 2 3.439 3.446 1.212 1.00 0.00 H
+ATOM 23 1HB PRO A 2 5.945 2.402 -0.210 1.00 0.00 H
+ATOM 24 2HB PRO A 2 5.857 3.335 1.290 1.00 0.00 H
+ATOM 25 1HG PRO A 2 6.269 0.723 1.484 1.00 0.00 H
+ATOM 26 2HG PRO A 2 5.092 1.469 2.569 1.00 0.00 H
+ATOM 27 1HD PRO A 2 4.613 -0.123 0.021 1.00 0.00 H
+ATOM 28 2HD PRO A 2 3.715 -0.184 1.592 1.00 0.00 H
+ATOM 29 N LYS A 3 3.811 2.871 -1.994 1.00 0.00 N
+ATOM 30 CA LYS A 3 3.730 3.468 -3.322 1.00 0.00 C
+ATOM 31 C LYS A 3 2.431 4.243 -3.500 1.00 0.00 C
+ATOM 32 O LYS A 3 2.437 5.386 -3.958 1.00 0.00 O
+ATOM 33 CB LYS A 3 3.852 2.392 -4.402 1.00 0.00 C
+ATOM 34 CG LYS A 3 3.816 2.924 -5.828 1.00 0.00 C
+ATOM 35 CD LYS A 3 4.020 1.807 -6.840 1.00 0.00 C
+ATOM 36 CE LYS A 3 3.952 2.332 -8.267 1.00 0.00 C
+ATOM 37 NZ LYS A 3 4.170 1.253 -9.268 1.00 0.00 N
+ATOM 38 H LYS A 3 3.887 1.867 -1.910 1.00 0.00 H
+ATOM 39 HA LYS A 3 4.568 4.156 -3.443 1.00 0.00 H
+ATOM 40 1HB LYS A 3 4.789 1.849 -4.271 1.00 0.00 H
+ATOM 41 2HB LYS A 3 3.040 1.673 -4.292 1.00 0.00 H
+ATOM 42 1HG LYS A 3 2.853 3.400 -6.014 1.00 0.00 H
+ATOM 43 2HG LYS A 3 4.601 3.669 -5.958 1.00 0.00 H
+ATOM 44 1HD LYS A 3 4.993 1.342 -6.679 1.00 0.00 H
+ATOM 45 2HD LYS A 3 3.248 1.049 -6.706 1.00 0.00 H
+ATOM 46 1HE LYS A 3 2.976 2.782 -8.442 1.00 0.00 H
+ATOM 47 2HE LYS A 3 4.712 3.101 -8.408 1.00 0.00 H
+ATOM 48 1HZ LYS A 3 4.118 1.642 -10.199 1.00 0.00 H
+ATOM 49 2HZ LYS A 3 5.082 0.841 -9.126 1.00 0.00 H
+ATOM 50 3HZ LYS A 3 3.460 0.544 -9.160 1.00 0.00 H
+ATOM 51 N THR A 4 1.319 3.615 -3.134 1.00 0.00 N
+ATOM 52 CA THR A 4 0.012 4.254 -3.231 1.00 0.00 C
+ATOM 53 C THR A 4 -0.056 5.505 -2.365 1.00 0.00 C
+ATOM 54 O THR A 4 -0.550 6.546 -2.799 1.00 0.00 O
+ATOM 55 CB THR A 4 -1.112 3.282 -2.824 1.00 0.00 C
+ATOM 56 OG1 THR A 4 -1.116 2.154 -3.709 1.00 0.00 O
+ATOM 57 CG2 THR A 4 -2.464 3.975 -2.885 1.00 0.00 C
+ATOM 58 H THR A 4 1.380 2.671 -2.780 1.00 0.00 H
+ATOM 59 HA THR A 4 -0.159 4.538 -4.270 1.00 0.00 H
+ATOM 60 HB THR A 4 -0.936 2.929 -1.808 1.00 0.00 H
+ATOM 61 HG1 THR A 4 -0.353 1.601 -3.524 1.00 0.00 H
+ATOM 62 1HG2 THR A 4 -3.246 3.273 -2.594 1.00 0.00 H
+ATOM 63 2HG2 THR A 4 -2.468 4.826 -2.205 1.00 0.00 H
+ATOM 64 3HG2 THR A 4 -2.649 4.322 -3.901 1.00 0.00 H
+ATOM 65 N GLU A 5 0.445 5.398 -1.139 1.00 0.00 N
+ATOM 66 CA GLU A 5 0.404 6.508 -0.195 1.00 0.00 C
+ATOM 67 C GLU A 5 1.162 7.716 -0.731 1.00 0.00 C
+ATOM 68 O GLU A 5 0.711 8.853 -0.598 1.00 0.00 O
+ATOM 69 CB GLU A 5 0.989 6.084 1.153 1.00 0.00 C
+ATOM 70 CG GLU A 5 0.135 5.087 1.924 1.00 0.00 C
+ATOM 71 CD GLU A 5 0.768 4.649 3.215 1.00 0.00 C
+ATOM 72 OE1 GLU A 5 1.865 5.072 3.491 1.00 0.00 O
+ATOM 73 OE2 GLU A 5 0.154 3.890 3.927 1.00 0.00 O
+ATOM 74 H GLU A 5 0.865 4.525 -0.854 1.00 0.00 H
+ATOM 75 HA GLU A 5 -0.638 6.791 -0.039 1.00 0.00 H
+ATOM 76 1HB GLU A 5 1.970 5.634 0.999 1.00 0.00 H
+ATOM 77 2HB GLU A 5 1.128 6.963 1.783 1.00 0.00 H
+ATOM 78 1HG GLU A 5 -0.830 5.545 2.143 1.00 0.00 H
+ATOM 79 2HG GLU A 5 -0.042 4.215 1.297 1.00 0.00 H
+ATOM 80 N GLU A 6 2.317 7.462 -1.338 1.00 0.00 N
+ATOM 81 CA GLU A 6 3.148 8.529 -1.880 1.00 0.00 C
+ATOM 82 C GLU A 6 2.456 9.231 -3.041 1.00 0.00 C
+ATOM 83 O GLU A 6 2.461 10.459 -3.129 1.00 0.00 O
+ATOM 84 CB GLU A 6 4.498 7.972 -2.341 1.00 0.00 C
+ATOM 85 CG GLU A 6 5.428 9.008 -2.956 1.00 0.00 C
+ATOM 86 CD GLU A 6 5.893 10.039 -1.966 1.00 0.00 C
+ATOM 87 OE1 GLU A 6 5.811 9.784 -0.788 1.00 0.00 O
+ATOM 88 OE2 GLU A 6 6.331 11.084 -2.387 1.00 0.00 O
+ATOM 89 H GLU A 6 2.626 6.504 -1.425 1.00 0.00 H
+ATOM 90 HA GLU A 6 3.334 9.258 -1.091 1.00 0.00 H
+ATOM 91 1HB GLU A 6 5.013 7.521 -1.493 1.00 0.00 H
+ATOM 92 2HB GLU A 6 4.335 7.188 -3.080 1.00 0.00 H
+ATOM 93 1HG GLU A 6 6.299 8.499 -3.369 1.00 0.00 H
+ATOM 94 2HG GLU A 6 4.910 9.505 -3.775 1.00 0.00 H
+ATOM 95 N LEU A 7 1.859 8.445 -3.931 1.00 0.00 N
+ATOM 96 CA LEU A 7 1.172 8.989 -5.096 1.00 0.00 C
+ATOM 97 C LEU A 7 -0.018 9.846 -4.683 1.00 0.00 C
+ATOM 98 O LEU A 7 -0.268 10.900 -5.267 1.00 0.00 O
+ATOM 99 CB LEU A 7 0.699 7.853 -6.011 1.00 0.00 C
+ATOM 100 CG LEU A 7 1.809 7.050 -6.702 1.00 0.00 C
+ATOM 101 CD1 LEU A 7 1.212 5.804 -7.341 1.00 0.00 C
+ATOM 102 CD2 LEU A 7 2.495 7.923 -7.742 1.00 0.00 C
+ATOM 103 H LEU A 7 1.882 7.444 -3.796 1.00 0.00 H
+ATOM 104 HA LEU A 7 1.875 9.611 -5.652 1.00 0.00 H
+ATOM 105 1HB LEU A 7 0.105 7.157 -5.422 1.00 0.00 H
+ATOM 106 2HB LEU A 7 0.063 8.275 -6.789 1.00 0.00 H
+ATOM 107 HG LEU A 7 2.540 6.727 -5.960 1.00 0.00 H
+ATOM 108 1HD1 LEU A 7 2.000 5.233 -7.832 1.00 0.00 H
+ATOM 109 2HD1 LEU A 7 0.744 5.189 -6.572 1.00 0.00 H
+ATOM 110 3HD1 LEU A 7 0.464 6.095 -8.077 1.00 0.00 H
+ATOM 111 1HD2 LEU A 7 3.285 7.352 -8.233 1.00 0.00 H
+ATOM 112 2HD2 LEU A 7 1.766 8.245 -8.485 1.00 0.00 H
+ATOM 113 3HD2 LEU A 7 2.928 8.797 -7.256 1.00 0.00 H
+ATOM 114 N ILE A 8 -0.749 9.387 -3.674 1.00 0.00 N
+ATOM 115 CA ILE A 8 -1.889 10.132 -3.152 1.00 0.00 C
+ATOM 116 C ILE A 8 -1.445 11.444 -2.519 1.00 0.00 C
+ATOM 117 O ILE A 8 -2.044 12.493 -2.757 1.00 0.00 O
+ATOM 118 CB ILE A 8 -2.663 9.297 -2.116 1.00 0.00 C
+ATOM 119 CG1 ILE A 8 -3.275 8.059 -2.777 1.00 0.00 C
+ATOM 120 CG2 ILE A 8 -3.743 10.139 -1.453 1.00 0.00 C
+ATOM 121 CD1 ILE A 8 -4.433 8.369 -3.698 1.00 0.00 C
+ATOM 122 H ILE A 8 -0.510 8.499 -3.257 1.00 0.00 H
+ATOM 123 HA ILE A 8 -2.565 10.353 -3.978 1.00 0.00 H
+ATOM 124 HB ILE A 8 -1.975 8.938 -1.351 1.00 0.00 H
+ATOM 125 1HG1 ILE A 8 -2.510 7.539 -3.353 1.00 0.00 H
+ATOM 126 2HG1 ILE A 8 -3.628 7.372 -2.007 1.00 0.00 H
+ATOM 127 1HG2 ILE A 8 -4.281 9.534 -0.725 1.00 0.00 H
+ATOM 128 2HG2 ILE A 8 -3.283 10.989 -0.950 1.00 0.00 H
+ATOM 129 3HG2 ILE A 8 -4.439 10.499 -2.211 1.00 0.00 H
+ATOM 130 1HD1 ILE A 8 -4.814 7.442 -4.129 1.00 0.00 H
+ATOM 131 2HD1 ILE A 8 -5.226 8.860 -3.134 1.00 0.00 H
+ATOM 132 3HD1 ILE A 8 -4.095 9.027 -4.498 1.00 0.00 H
+ATOM 133 N LYS A 9 -0.392 11.380 -1.711 1.00 0.00 N
+ATOM 134 CA LYS A 9 0.115 12.558 -1.018 1.00 0.00 C
+ATOM 135 C LYS A 9 0.599 13.612 -2.005 1.00 0.00 C
+ATOM 136 O LYS A 9 0.396 14.808 -1.799 1.00 0.00 O
+ATOM 137 CB LYS A 9 1.247 12.172 -0.064 1.00 0.00 C
+ATOM 138 CG LYS A 9 0.790 11.434 1.188 1.00 0.00 C
+ATOM 139 CD LYS A 9 1.977 10.953 2.010 1.00 0.00 C
+ATOM 140 CE LYS A 9 1.523 10.192 3.246 1.00 0.00 C
+ATOM 141 NZ LYS A 9 2.671 9.617 3.999 1.00 0.00 N
+ATOM 142 H LYS A 9 0.068 10.491 -1.573 1.00 0.00 H
+ATOM 143 HA LYS A 9 -0.693 12.983 -0.420 1.00 0.00 H
+ATOM 144 1HB LYS A 9 1.962 11.535 -0.585 1.00 0.00 H
+ATOM 145 2HB LYS A 9 1.778 13.070 0.253 1.00 0.00 H
+ATOM 146 1HG LYS A 9 0.180 12.098 1.801 1.00 0.00 H
+ATOM 147 2HG LYS A 9 0.185 10.574 0.903 1.00 0.00 H
+ATOM 148 1HD LYS A 9 2.601 10.299 1.399 1.00 0.00 H
+ATOM 149 2HD LYS A 9 2.574 11.810 2.322 1.00 0.00 H
+ATOM 150 1HE LYS A 9 0.972 10.862 3.904 1.00 0.00 H
+ATOM 151 2HE LYS A 9 0.857 9.381 2.950 1.00 0.00 H
+ATOM 152 1HZ LYS A 9 2.328 9.121 4.809 1.00 0.00 H
+ATOM 153 2HZ LYS A 9 3.179 8.978 3.403 1.00 0.00 H
+ATOM 154 3HZ LYS A 9 3.286 10.361 4.295 1.00 0.00 H
+ATOM 155 N GLN A 10 1.240 13.160 -3.078 1.00 0.00 N
+ATOM 156 CA GLN A 10 1.722 14.061 -4.118 1.00 0.00 C
+ATOM 157 C GLN A 10 0.566 14.786 -4.797 1.00 0.00 C
+ATOM 158 O GLN A 10 0.665 15.971 -5.115 1.00 0.00 O
+ATOM 159 CB GLN A 10 2.539 13.291 -5.158 1.00 0.00 C
+ATOM 160 CG GLN A 10 3.908 12.848 -4.670 1.00 0.00 C
+ATOM 161 CD GLN A 10 4.640 11.999 -5.692 1.00 0.00 C
+ATOM 162 OE1 GLN A 10 4.162 11.801 -6.812 1.00 0.00 O
+ATOM 163 NE2 GLN A 10 5.807 11.492 -5.311 1.00 0.00 N
+ATOM 164 H GLN A 10 1.398 12.168 -3.175 1.00 0.00 H
+ATOM 165 HA GLN A 10 2.377 14.802 -3.658 1.00 0.00 H
+ATOM 166 1HB GLN A 10 1.989 12.402 -5.468 1.00 0.00 H
+ATOM 167 2HB GLN A 10 2.682 13.912 -6.042 1.00 0.00 H
+ATOM 168 1HG GLN A 10 4.512 13.732 -4.464 1.00 0.00 H
+ATOM 169 2HG GLN A 10 3.786 12.260 -3.761 1.00 0.00 H
+ATOM 170 1HE2 GLN A 10 6.336 10.924 -5.943 1.00 0.00 H
+ATOM 171 2HE2 GLN A 10 6.158 11.678 -4.394 1.00 0.00 H
+ATOM 172 N TYR A 11 -0.529 14.066 -5.017 1.00 0.00 N
+ATOM 173 CA TYR A 11 -1.742 14.664 -5.561 1.00 0.00 C
+ATOM 174 C TYR A 11 -2.324 15.697 -4.604 1.00 0.00 C
+ATOM 175 O TYR A 11 -2.680 16.803 -5.011 1.00 0.00 O
+ATOM 176 CB TYR A 11 -2.780 13.583 -5.870 1.00 0.00 C
+ATOM 177 CG TYR A 11 -4.104 14.129 -6.357 1.00 0.00 C
+ATOM 178 CD1 TYR A 11 -4.200 14.688 -7.623 1.00 0.00 C
+ATOM 179 CD2 TYR A 11 -5.222 14.071 -5.538 1.00 0.00 C
+ATOM 180 CE1 TYR A 11 -5.409 15.187 -8.068 1.00 0.00 C
+ATOM 181 CE2 TYR A 11 -6.431 14.570 -5.983 1.00 0.00 C
+ATOM 182 CZ TYR A 11 -6.526 15.126 -7.242 1.00 0.00 C
+ATOM 183 OH TYR A 11 -7.731 15.623 -7.685 1.00 0.00 O
+ATOM 184 H TYR A 11 -0.521 13.079 -4.802 1.00 0.00 H
+ATOM 185 HA TYR A 11 -1.493 15.159 -6.501 1.00 0.00 H
+ATOM 186 1HB TYR A 11 -2.388 12.910 -6.634 1.00 0.00 H
+ATOM 187 2HB TYR A 11 -2.965 12.990 -4.975 1.00 0.00 H
+ATOM 188 HD1 TYR A 11 -3.322 14.734 -8.267 1.00 0.00 H
+ATOM 189 HD2 TYR A 11 -5.146 13.633 -4.543 1.00 0.00 H
+ATOM 190 HE1 TYR A 11 -5.485 15.626 -9.062 1.00 0.00 H
+ATOM 191 HE2 TYR A 11 -7.309 14.525 -5.338 1.00 0.00 H
+ATOM 192 HH TYR A 11 -7.616 16.004 -8.559 1.00 0.00 H
+ATOM 193 N GLN A 12 -2.418 15.329 -3.331 1.00 0.00 N
+ATOM 194 CA GLN A 12 -3.006 16.203 -2.323 1.00 0.00 C
+ATOM 195 C GLN A 12 -2.239 17.515 -2.216 1.00 0.00 C
+ATOM 196 O GLN A 12 -2.826 18.571 -1.980 1.00 0.00 O
+ATOM 197 CB GLN A 12 -3.039 15.504 -0.961 1.00 0.00 C
+ATOM 198 CG GLN A 12 -4.020 14.347 -0.879 1.00 0.00 C
+ATOM 199 CD GLN A 12 -3.882 13.563 0.412 1.00 0.00 C
+ATOM 200 OE1 GLN A 12 -2.869 13.661 1.110 1.00 0.00 O
+ATOM 201 NE2 GLN A 12 -4.903 12.778 0.738 1.00 0.00 N
+ATOM 202 H GLN A 12 -2.073 14.421 -3.054 1.00 0.00 H
+ATOM 203 HA GLN A 12 -4.035 16.422 -2.612 1.00 0.00 H
+ATOM 204 1HB GLN A 12 -2.046 15.121 -0.725 1.00 0.00 H
+ATOM 205 2HB GLN A 12 -3.303 16.225 -0.188 1.00 0.00 H
+ATOM 206 1HG GLN A 12 -5.035 14.740 -0.934 1.00 0.00 H
+ATOM 207 2HG GLN A 12 -3.836 13.669 -1.712 1.00 0.00 H
+ATOM 208 1HE2 GLN A 12 -4.869 12.236 1.579 1.00 0.00 H
+ATOM 209 2HE2 GLN A 12 -5.705 12.727 0.143 1.00 0.00 H
+ATOM 210 N ARG A 13 -0.924 17.441 -2.390 1.00 0.00 N
+ATOM 211 CA ARG A 13 -0.075 18.625 -2.322 1.00 0.00 C
+ATOM 212 C ARG A 13 -0.063 19.370 -3.651 1.00 0.00 C
+ATOM 213 O ARG A 13 0.614 20.388 -3.796 1.00 0.00 O
+ATOM 214 CB ARG A 13 1.349 18.242 -1.946 1.00 0.00 C
+ATOM 215 CG ARG A 13 1.517 17.720 -0.528 1.00 0.00 C
+ATOM 216 CD ARG A 13 2.941 17.728 -0.105 1.00 0.00 C
+ATOM 217 NE ARG A 13 3.782 16.969 -1.017 1.00 0.00 N
+ATOM 218 CZ ARG A 13 4.061 15.658 -0.888 1.00 0.00 C
+ATOM 219 NH1 ARG A 13 3.560 14.975 0.118 1.00 0.00 N
+ATOM 220 NH2 ARG A 13 4.839 15.057 -1.772 1.00 0.00 N
+ATOM 221 H ARG A 13 -0.501 16.543 -2.573 1.00 0.00 H
+ATOM 222 HA ARG A 13 -0.470 19.291 -1.555 1.00 0.00 H
+ATOM 223 1HB ARG A 13 1.710 17.472 -2.626 1.00 0.00 H
+ATOM 224 2HB ARG A 13 2.000 19.109 -2.058 1.00 0.00 H
+ATOM 225 1HG ARG A 13 0.951 18.348 0.160 1.00 0.00 H
+ATOM 226 2HG ARG A 13 1.148 16.695 -0.471 1.00 0.00 H
+ATOM 227 1HD ARG A 13 3.306 18.754 -0.078 1.00 0.00 H
+ATOM 228 2HD ARG A 13 3.028 17.286 0.887 1.00 0.00 H
+ATOM 229 HE ARG A 13 4.186 17.461 -1.803 1.00 0.00 H
+ATOM 230 1HH1 ARG A 13 2.966 15.434 0.794 1.00 0.00 H
+ATOM 231 2HH1 ARG A 13 3.770 13.992 0.215 1.00 0.00 H
+ATOM 232 1HH2 ARG A 13 5.224 15.583 -2.545 1.00 0.00 H
+ATOM 233 2HH2 ARG A 13 5.048 14.075 -1.675 1.00 0.00 H
+ATOM 234 N LYS A 14 -0.816 18.858 -4.618 1.00 0.00 N
+ATOM 235 CA LYS A 14 -0.908 19.484 -5.931 1.00 0.00 C
+ATOM 236 C LYS A 14 0.462 19.588 -6.589 1.00 0.00 C
+ATOM 237 O LYS A 14 0.800 20.610 -7.186 1.00 0.00 O
+ATOM 238 CB LYS A 14 -1.543 20.871 -5.820 1.00 0.00 C
+ATOM 239 CG LYS A 14 -2.879 20.894 -5.089 1.00 0.00 C
+ATOM 240 CD LYS A 14 -3.967 20.209 -5.903 1.00 0.00 C
+ATOM 241 CE LYS A 14 -5.345 20.457 -5.308 1.00 0.00 C
+ATOM 242 NZ LYS A 14 -5.551 19.695 -4.046 1.00 0.00 N
+ATOM 243 H LYS A 14 -1.339 18.012 -4.439 1.00 0.00 H
+ATOM 244 HA LYS A 14 -1.538 18.863 -6.568 1.00 0.00 H
+ATOM 245 1HB LYS A 14 -0.863 21.542 -5.294 1.00 0.00 H
+ATOM 246 2HB LYS A 14 -1.701 21.280 -6.818 1.00 0.00 H
+ATOM 247 1HG LYS A 14 -2.779 20.383 -4.130 1.00 0.00 H
+ATOM 248 2HG LYS A 14 -3.174 21.926 -4.901 1.00 0.00 H
+ATOM 249 1HD LYS A 14 -3.948 20.588 -6.926 1.00 0.00 H
+ATOM 250 2HD LYS A 14 -3.780 19.135 -5.929 1.00 0.00 H
+ATOM 251 1HE LYS A 14 -5.465 21.519 -5.100 1.00 0.00 H
+ATOM 252 2HE LYS A 14 -6.110 20.160 -6.025 1.00 0.00 H
+ATOM 253 1HZ LYS A 14 -6.474 19.886 -3.684 1.00 0.00 H
+ATOM 254 2HZ LYS A 14 -5.459 18.706 -4.230 1.00 0.00 H
+ATOM 255 3HZ LYS A 14 -4.859 19.976 -3.366 1.00 0.00 H
+ATOM 256 N GLU A 15 1.248 18.522 -6.477 1.00 0.00 N
+ATOM 257 CA GLU A 15 2.552 18.461 -7.127 1.00 0.00 C
+ATOM 258 C GLU A 15 2.471 17.722 -8.456 1.00 0.00 C
+ATOM 259 O GLU A 15 3.426 17.715 -9.233 1.00 0.00 O
+ATOM 260 CB GLU A 15 3.571 17.777 -6.213 1.00 0.00 C
+ATOM 261 CG GLU A 15 3.879 18.539 -4.932 1.00 0.00 C
+ATOM 262 CD GLU A 15 4.850 17.817 -4.040 1.00 0.00 C
+ATOM 263 OE1 GLU A 15 5.285 16.752 -4.407 1.00 0.00 O
+ATOM 264 OE2 GLU A 15 5.157 18.331 -2.990 1.00 0.00 O
+ATOM 265 H GLU A 15 0.935 17.735 -5.928 1.00 0.00 H
+ATOM 266 HA GLU A 15 2.889 19.479 -7.324 1.00 0.00 H
+ATOM 267 1HB GLU A 15 3.205 16.789 -5.934 1.00 0.00 H
+ATOM 268 2HB GLU A 15 4.508 17.638 -6.753 1.00 0.00 H
+ATOM 269 1HG GLU A 15 4.297 19.512 -5.192 1.00 0.00 H
+ATOM 270 2HG GLU A 15 2.950 18.707 -4.389 1.00 0.00 H
+ATOM 271 N ARG A 16 1.326 17.100 -8.713 1.00 0.00 N
+ATOM 272 CA ARG A 16 1.164 16.242 -9.881 1.00 0.00 C
+ATOM 273 C ARG A 16 -0.185 16.471 -10.550 1.00 0.00 C
+ATOM 274 O ARG A 16 -1.155 16.858 -9.898 1.00 0.00 O
+ATOM 275 CB ARG A 16 1.292 14.777 -9.491 1.00 0.00 C
+ATOM 276 CG ARG A 16 2.649 14.379 -8.935 1.00 0.00 C
+ATOM 277 CD ARG A 16 3.694 14.368 -9.991 1.00 0.00 C
+ATOM 278 NE ARG A 16 4.964 13.866 -9.493 1.00 0.00 N
+ATOM 279 CZ ARG A 16 5.897 14.620 -8.879 1.00 0.00 C
+ATOM 280 NH1 ARG A 16 5.687 15.905 -8.695 1.00 0.00 N
+ATOM 281 NH2 ARG A 16 7.023 14.068 -8.461 1.00 0.00 N
+ATOM 282 H ARG A 16 0.546 17.224 -8.082 1.00 0.00 H
+ATOM 283 HA ARG A 16 1.954 16.479 -10.595 1.00 0.00 H
+ATOM 284 1HB ARG A 16 0.543 14.535 -8.738 1.00 0.00 H
+ATOM 285 2HB ARG A 16 1.095 14.150 -10.361 1.00 0.00 H
+ATOM 286 1HG ARG A 16 2.949 15.088 -8.163 1.00 0.00 H
+ATOM 287 2HG ARG A 16 2.587 13.379 -8.504 1.00 0.00 H
+ATOM 288 1HD ARG A 16 3.374 13.729 -10.813 1.00 0.00 H
+ATOM 289 2HD ARG A 16 3.849 15.382 -10.359 1.00 0.00 H
+ATOM 290 HE ARG A 16 5.162 12.882 -9.615 1.00 0.00 H
+ATOM 291 1HH1 ARG A 16 4.827 16.327 -9.015 1.00 0.00 H
+ATOM 292 2HH1 ARG A 16 6.386 16.470 -8.235 1.00 0.00 H
+ATOM 293 1HH2 ARG A 16 7.184 13.080 -8.602 1.00 0.00 H
+ATOM 294 2HH2 ARG A 16 7.721 14.633 -8.001 1.00 0.00 H
+ATOM 295 N SER A 17 -0.241 16.229 -11.855 1.00 0.00 N
+ATOM 296 CA SER A 17 -1.498 16.288 -12.592 1.00 0.00 C
+ATOM 297 C SER A 17 -2.448 15.184 -12.148 1.00 0.00 C
+ATOM 298 O SER A 17 -2.016 14.114 -11.718 1.00 0.00 O
+ATOM 299 CB SER A 17 -1.235 16.173 -14.081 1.00 0.00 C
+ATOM 300 OG SER A 17 -0.452 17.241 -14.537 1.00 0.00 O
+ATOM 301 H SER A 17 0.609 16.000 -12.350 1.00 0.00 H
+ATOM 302 HA SER A 17 -1.973 17.248 -12.390 1.00 0.00 H
+ATOM 303 1HB SER A 17 -0.728 15.231 -14.289 1.00 0.00 H
+ATOM 304 2HB SER A 17 -2.183 16.158 -14.617 1.00 0.00 H
+ATOM 305 HG SER A 17 -0.341 17.104 -15.481 1.00 0.00 H
+ATOM 306 N GLU A 18 -3.746 15.449 -12.253 1.00 0.00 N
+ATOM 307 CA GLU A 18 -4.760 14.508 -11.796 1.00 0.00 C
+ATOM 308 C GLU A 18 -4.749 13.236 -12.634 1.00 0.00 C
+ATOM 309 O GLU A 18 -5.336 12.223 -12.251 1.00 0.00 O
+ATOM 310 CB GLU A 18 -6.148 15.151 -11.847 1.00 0.00 C
+ATOM 311 CG GLU A 18 -6.654 15.442 -13.253 1.00 0.00 C
+ATOM 312 CD GLU A 18 -6.200 16.777 -13.774 1.00 0.00 C
+ATOM 313 OE1 GLU A 18 -5.232 17.293 -13.268 1.00 0.00 O
+ATOM 314 OE2 GLU A 18 -6.822 17.282 -14.679 1.00 0.00 O
+ATOM 315 H GLU A 18 -4.037 16.327 -12.661 1.00 0.00 H
+ATOM 316 HA GLU A 18 -4.547 14.245 -10.759 1.00 0.00 H
+ATOM 317 1HB GLU A 18 -6.871 14.497 -11.360 1.00 0.00 H
+ATOM 318 2HB GLU A 18 -6.133 16.091 -11.296 1.00 0.00 H
+ATOM 319 1HG GLU A 18 -6.298 14.662 -13.925 1.00 0.00 H
+ATOM 320 2HG GLU A 18 -7.743 15.410 -13.249 1.00 0.00 H
+ATOM 321 N GLU A 19 -4.078 13.294 -13.779 1.00 0.00 N
+ATOM 322 CA GLU A 19 -3.956 12.135 -14.655 1.00 0.00 C
+ATOM 323 C GLU A 19 -3.269 10.976 -13.944 1.00 0.00 C
+ATOM 324 O GLU A 19 -3.522 9.811 -14.248 1.00 0.00 O
+ATOM 325 CB GLU A 19 -3.179 12.502 -15.921 1.00 0.00 C
+ATOM 326 CG GLU A 19 -3.915 13.448 -16.859 1.00 0.00 C
+ATOM 327 CD GLU A 19 -3.094 13.845 -18.054 1.00 0.00 C
+ATOM 328 OE1 GLU A 19 -1.934 13.511 -18.091 1.00 0.00 O
+ATOM 329 OE2 GLU A 19 -3.627 14.483 -18.931 1.00 0.00 O
+ATOM 330 H GLU A 19 -3.641 14.163 -14.050 1.00 0.00 H
+ATOM 331 HA GLU A 19 -4.957 11.819 -14.952 1.00 0.00 H
+ATOM 332 1HB GLU A 19 -2.235 12.973 -15.645 1.00 0.00 H
+ATOM 333 2HB GLU A 19 -2.941 11.596 -16.479 1.00 0.00 H
+ATOM 334 1HG GLU A 19 -4.828 12.963 -17.205 1.00 0.00 H
+ATOM 335 2HG GLU A 19 -4.200 14.343 -16.306 1.00 0.00 H
+ATOM 336 N MET A 20 -2.397 11.304 -12.996 1.00 0.00 N
+ATOM 337 CA MET A 20 -1.671 10.291 -12.240 1.00 0.00 C
+ATOM 338 C MET A 20 -2.619 9.442 -11.403 1.00 0.00 C
+ATOM 339 O MET A 20 -2.357 8.266 -11.152 1.00 0.00 O
+ATOM 340 CB MET A 20 -0.619 10.950 -11.350 1.00 0.00 C
+ATOM 341 CG MET A 20 0.290 9.972 -10.619 1.00 0.00 C
+ATOM 342 SD MET A 20 1.589 10.799 -9.680 1.00 0.00 S
+ATOM 343 CE MET A 20 0.680 11.314 -8.226 1.00 0.00 C
+ATOM 344 H MET A 20 -2.234 12.280 -12.794 1.00 0.00 H
+ATOM 345 HA MET A 20 -1.149 9.641 -12.944 1.00 0.00 H
+ATOM 346 1HB MET A 20 0.010 11.604 -11.953 1.00 0.00 H
+ATOM 347 2HB MET A 20 -1.113 11.571 -10.601 1.00 0.00 H
+ATOM 348 1HG MET A 20 -0.302 9.369 -9.931 1.00 0.00 H
+ATOM 349 2HG MET A 20 0.759 9.303 -11.341 1.00 0.00 H
+ATOM 350 1HE MET A 20 1.350 11.842 -7.547 1.00 0.00 H
+ATOM 351 2HE MET A 20 -0.134 11.977 -8.522 1.00 0.00 H
+ATOM 352 3HE MET A 20 0.270 10.438 -7.724 1.00 0.00 H
+ATOM 353 N MET A 21 -3.723 10.046 -10.974 1.00 0.00 N
+ATOM 354 CA MET A 21 -4.702 9.353 -10.145 1.00 0.00 C
+ATOM 355 C MET A 21 -5.558 8.408 -10.978 1.00 0.00 C
+ATOM 356 O MET A 21 -5.939 7.331 -10.518 1.00 0.00 O
+ATOM 357 CB MET A 21 -5.581 10.363 -9.412 1.00 0.00 C
+ATOM 358 CG MET A 21 -4.851 11.188 -8.361 1.00 0.00 C
+ATOM 359 SD MET A 21 -4.222 10.183 -7.002 1.00 0.00 S
+ATOM 360 CE MET A 21 -2.502 10.019 -7.470 1.00 0.00 C
+ATOM 361 H MET A 21 -3.887 11.009 -11.229 1.00 0.00 H
+ATOM 362 HA MET A 21 -4.168 8.770 -9.393 1.00 0.00 H
+ATOM 363 1HB MET A 21 -6.021 11.053 -10.131 1.00 0.00 H
+ATOM 364 2HB MET A 21 -6.401 9.841 -8.916 1.00 0.00 H
+ATOM 365 1HG MET A 21 -4.012 11.706 -8.824 1.00 0.00 H
+ATOM 366 2HG MET A 21 -5.529 11.937 -7.951 1.00 0.00 H
+ATOM 367 1HE MET A 21 -1.977 9.421 -6.725 1.00 0.00 H
+ATOM 368 2HE MET A 21 -2.434 9.530 -8.443 1.00 0.00 H
+ATOM 369 3HE MET A 21 -2.045 11.007 -7.529 1.00 0.00 H
+ATOM 370 N GLU A 22 -5.859 8.817 -12.206 1.00 0.00 N
+ATOM 371 CA GLU A 22 -6.595 7.970 -13.137 1.00 0.00 C
+ATOM 372 C GLU A 22 -5.778 6.747 -13.534 1.00 0.00 C
+ATOM 373 O GLU A 22 -6.311 5.644 -13.651 1.00 0.00 O
+ATOM 374 CB GLU A 22 -6.983 8.763 -14.387 1.00 0.00 C
+ATOM 375 CG GLU A 22 -8.116 9.757 -14.175 1.00 0.00 C
+ATOM 376 CD GLU A 22 -9.419 9.092 -13.827 1.00 0.00 C
+ATOM 377 OE1 GLU A 22 -9.854 8.252 -14.577 1.00 0.00 O
+ATOM 378 OE2 GLU A 22 -9.981 9.425 -12.810 1.00 0.00 O
+ATOM 379 H GLU A 22 -5.570 9.738 -12.502 1.00 0.00 H
+ATOM 380 HA GLU A 22 -7.511 7.635 -12.650 1.00 0.00 H
+ATOM 381 1HB GLU A 22 -6.117 9.317 -14.750 1.00 0.00 H
+ATOM 382 2HB GLU A 22 -7.285 8.075 -15.176 1.00 0.00 H
+ATOM 383 1HG GLU A 22 -7.843 10.437 -13.369 1.00 0.00 H
+ATOM 384 2HG GLU A 22 -8.245 10.345 -15.082 1.00 0.00 H
+ATOM 385 N GLU A 23 -4.481 6.950 -13.739 1.00 0.00 N
+ATOM 386 CA GLU A 23 -3.576 5.853 -14.061 1.00 0.00 C
+ATOM 387 C GLU A 23 -3.405 4.913 -12.874 1.00 0.00 C
+ATOM 388 O GLU A 23 -3.308 3.698 -13.042 1.00 0.00 O
+ATOM 389 CB GLU A 23 -2.212 6.396 -14.494 1.00 0.00 C
+ATOM 390 CG GLU A 23 -2.219 7.117 -15.834 1.00 0.00 C
+ATOM 391 CD GLU A 23 -2.668 6.239 -16.969 1.00 0.00 C
+ATOM 392 OE1 GLU A 23 -2.185 5.136 -17.068 1.00 0.00 O
+ATOM 393 OE2 GLU A 23 -3.494 6.671 -17.737 1.00 0.00 O
+ATOM 394 H GLU A 23 -4.112 7.888 -13.670 1.00 0.00 H
+ATOM 395 HA GLU A 23 -3.997 5.290 -14.895 1.00 0.00 H
+ATOM 396 1HB GLU A 23 -1.842 7.093 -13.741 1.00 0.00 H
+ATOM 397 2HB GLU A 23 -1.497 5.576 -14.559 1.00 0.00 H
+ATOM 398 1HG GLU A 23 -2.887 7.976 -15.769 1.00 0.00 H
+ATOM 399 2HG GLU A 23 -1.216 7.487 -16.042 1.00 0.00 H
+ATOM 400 N LEU A 24 -3.369 5.484 -11.675 1.00 0.00 N
+ATOM 401 CA LEU A 24 -3.307 4.693 -10.452 1.00 0.00 C
+ATOM 402 C LEU A 24 -4.563 3.849 -10.277 1.00 0.00 C
+ATOM 403 O LEU A 24 -4.487 2.666 -9.946 1.00 0.00 O
+ATOM 404 CB LEU A 24 -3.127 5.610 -9.235 1.00 0.00 C
+ATOM 405 CG LEU A 24 -3.156 4.915 -7.868 1.00 0.00 C
+ATOM 406 CD1 LEU A 24 -2.053 3.867 -7.807 1.00 0.00 C
+ATOM 407 CD2 LEU A 24 -2.986 5.952 -6.768 1.00 0.00 C
+ATOM 408 H LEU A 24 -3.384 6.491 -11.608 1.00 0.00 H
+ATOM 409 HA LEU A 24 -2.445 4.028 -10.513 1.00 0.00 H
+ATOM 410 1HB LEU A 24 -2.171 6.123 -9.326 1.00 0.00 H
+ATOM 411 2HB LEU A 24 -3.919 6.358 -9.244 1.00 0.00 H
+ATOM 412 HG LEU A 24 -4.110 4.403 -7.740 1.00 0.00 H
+ATOM 413 1HD1 LEU A 24 -2.074 3.373 -6.835 1.00 0.00 H
+ATOM 414 2HD1 LEU A 24 -2.210 3.127 -8.592 1.00 0.00 H
+ATOM 415 3HD1 LEU A 24 -1.086 4.348 -7.948 1.00 0.00 H
+ATOM 416 1HD2 LEU A 24 -3.008 5.458 -5.796 1.00 0.00 H
+ATOM 417 2HD2 LEU A 24 -2.032 6.464 -6.894 1.00 0.00 H
+ATOM 418 3HD2 LEU A 24 -3.798 6.678 -6.824 1.00 0.00 H
+ATOM 419 N ARG A 25 -5.719 4.464 -10.503 1.00 0.00 N
+ATOM 420 CA ARG A 25 -6.995 3.774 -10.358 1.00 0.00 C
+ATOM 421 C ARG A 25 -7.102 2.604 -11.328 1.00 0.00 C
+ATOM 422 O ARG A 25 -7.517 1.508 -10.951 1.00 0.00 O
+ATOM 423 CB ARG A 25 -8.152 4.733 -10.595 1.00 0.00 C
+ATOM 424 CG ARG A 25 -9.533 4.133 -10.386 1.00 0.00 C
+ATOM 425 CD ARG A 25 -10.599 5.164 -10.470 1.00 0.00 C
+ATOM 426 NE ARG A 25 -10.703 5.728 -11.807 1.00 0.00 N
+ATOM 427 CZ ARG A 25 -11.308 5.123 -12.847 1.00 0.00 C
+ATOM 428 NH1 ARG A 25 -11.856 3.938 -12.691 1.00 0.00 N
+ATOM 429 NH2 ARG A 25 -11.350 5.720 -14.026 1.00 0.00 N
+ATOM 430 H ARG A 25 -5.713 5.434 -10.782 1.00 0.00 H
+ATOM 431 HA ARG A 25 -7.068 3.391 -9.340 1.00 0.00 H
+ATOM 432 1HB ARG A 25 -8.059 5.587 -9.925 1.00 0.00 H
+ATOM 433 2HB ARG A 25 -8.108 5.111 -11.616 1.00 0.00 H
+ATOM 434 1HG ARG A 25 -9.723 3.380 -11.152 1.00 0.00 H
+ATOM 435 2HG ARG A 25 -9.583 3.668 -9.400 1.00 0.00 H
+ATOM 436 1HD ARG A 25 -11.559 4.717 -10.213 1.00 0.00 H
+ATOM 437 2HD ARG A 25 -10.378 5.973 -9.775 1.00 0.00 H
+ATOM 438 HE ARG A 25 -10.293 6.638 -11.966 1.00 0.00 H
+ATOM 439 1HH1 ARG A 25 -11.824 3.482 -11.790 1.00 0.00 H
+ATOM 440 2HH1 ARG A 25 -12.309 3.484 -13.471 1.00 0.00 H
+ATOM 441 1HH2 ARG A 25 -10.928 6.631 -14.146 1.00 0.00 H
+ATOM 442 2HH2 ARG A 25 -11.803 5.266 -14.805 1.00 0.00 H
+ATOM 443 N LYS A 26 -6.726 2.844 -12.580 1.00 0.00 N
+ATOM 444 CA LYS A 26 -6.797 1.816 -13.612 1.00 0.00 C
+ATOM 445 C LYS A 26 -5.869 0.652 -13.293 1.00 0.00 C
+ATOM 446 O LYS A 26 -6.279 -0.509 -13.327 1.00 0.00 O
+ATOM 447 CB LYS A 26 -6.451 2.406 -14.980 1.00 0.00 C
+ATOM 448 CG LYS A 26 -7.545 3.275 -15.586 1.00 0.00 C
+ATOM 449 CD LYS A 26 -7.214 3.661 -17.019 1.00 0.00 C
+ATOM 450 CE LYS A 26 -6.052 4.641 -17.075 1.00 0.00 C
+ATOM 451 NZ LYS A 26 -5.814 5.145 -18.455 1.00 0.00 N
+ATOM 452 H LYS A 26 -6.383 3.762 -12.823 1.00 0.00 H
+ATOM 453 HA LYS A 26 -7.821 1.444 -13.660 1.00 0.00 H
+ATOM 454 1HB LYS A 26 -5.549 3.013 -14.897 1.00 0.00 H
+ATOM 455 2HB LYS A 26 -6.239 1.599 -15.681 1.00 0.00 H
+ATOM 456 1HG LYS A 26 -8.491 2.731 -15.574 1.00 0.00 H
+ATOM 457 2HG LYS A 26 -7.661 4.181 -14.991 1.00 0.00 H
+ATOM 458 1HD LYS A 26 -6.952 2.767 -17.586 1.00 0.00 H
+ATOM 459 2HD LYS A 26 -8.087 4.122 -17.483 1.00 0.00 H
+ATOM 460 1HE LYS A 26 -6.259 5.489 -16.422 1.00 0.00 H
+ATOM 461 2HE LYS A 26 -5.145 4.151 -16.720 1.00 0.00 H
+ATOM 462 1HZ LYS A 26 -5.036 5.790 -18.449 1.00 0.00 H
+ATOM 463 2HZ LYS A 26 -5.602 4.369 -19.065 1.00 0.00 H
+ATOM 464 3HZ LYS A 26 -6.641 5.619 -18.788 1.00 0.00 H
+ATOM 465 N LYS A 27 -4.616 0.968 -12.984 1.00 0.00 N
+ATOM 466 CA LYS A 27 -3.607 -0.055 -12.735 1.00 0.00 C
+ATOM 467 C LYS A 27 -3.930 -0.853 -11.479 1.00 0.00 C
+ATOM 468 O LYS A 27 -3.657 -2.051 -11.406 1.00 0.00 O
+ATOM 469 CB LYS A 27 -2.220 0.579 -12.613 1.00 0.00 C
+ATOM 470 CG LYS A 27 -1.650 1.102 -13.924 1.00 0.00 C
+ATOM 471 CD LYS A 27 -0.295 1.761 -13.714 1.00 0.00 C
+ATOM 472 CE LYS A 27 0.265 2.308 -15.019 1.00 0.00 C
+ATOM 473 NZ LYS A 27 1.577 2.982 -14.823 1.00 0.00 N
+ATOM 474 H LYS A 27 -4.355 1.941 -12.921 1.00 0.00 H
+ATOM 475 HA LYS A 27 -3.586 -0.736 -13.587 1.00 0.00 H
+ATOM 476 1HB LYS A 27 -2.261 1.412 -11.910 1.00 0.00 H
+ATOM 477 2HB LYS A 27 -1.519 -0.153 -12.212 1.00 0.00 H
+ATOM 478 1HG LYS A 27 -1.537 0.277 -14.628 1.00 0.00 H
+ATOM 479 2HG LYS A 27 -2.336 1.831 -14.354 1.00 0.00 H
+ATOM 480 1HD LYS A 27 -0.395 2.580 -13.000 1.00 0.00 H
+ATOM 481 2HD LYS A 27 0.405 1.032 -13.307 1.00 0.00 H
+ATOM 482 1HE LYS A 27 0.391 1.493 -15.730 1.00 0.00 H
+ATOM 483 2HE LYS A 27 -0.438 3.026 -15.443 1.00 0.00 H
+ATOM 484 1HZ LYS A 27 1.913 3.330 -15.710 1.00 0.00 H
+ATOM 485 2HZ LYS A 27 1.468 3.753 -14.179 1.00 0.00 H
+ATOM 486 3HZ LYS A 27 2.242 2.321 -14.448 1.00 0.00 H
+ATOM 487 N ALA A 28 -4.514 -0.183 -10.492 1.00 0.00 N
+ATOM 488 CA ALA A 28 -4.857 -0.824 -9.228 1.00 0.00 C
+ATOM 489 C ALA A 28 -6.179 -1.575 -9.332 1.00 0.00 C
+ATOM 490 O ALA A 28 -6.625 -2.201 -8.371 1.00 0.00 O
+ATOM 491 CB ALA A 28 -4.922 0.207 -8.111 1.00 0.00 C
+ATOM 492 H ALA A 28 -4.726 0.796 -10.620 1.00 0.00 H
+ATOM 493 HA ALA A 28 -4.082 -1.552 -8.988 1.00 0.00 H
+ATOM 494 1HB ALA A 28 -5.179 -0.287 -7.174 1.00 0.00 H
+ATOM 495 2HB ALA A 28 -3.952 0.695 -8.010 1.00 0.00 H
+ATOM 496 3HB ALA A 28 -5.679 0.953 -8.348 1.00 0.00 H
+ATOM 497 N ASN A 29 -6.801 -1.508 -10.504 1.00 0.00 N
+ATOM 498 CA ASN A 29 -8.098 -2.137 -10.720 1.00 0.00 C
+ATOM 499 C ASN A 29 -9.117 -1.665 -9.691 1.00 0.00 C
+ATOM 500 O ASN A 29 -9.873 -2.465 -9.140 1.00 0.00 O
+ATOM 501 CB ASN A 29 -7.970 -3.649 -10.691 1.00 0.00 C
+ATOM 502 CG ASN A 29 -9.148 -4.341 -11.318 1.00 0.00 C
+ATOM 503 OD1 ASN A 29 -9.758 -3.823 -12.261 1.00 0.00 O
+ATOM 504 ND2 ASN A 29 -9.479 -5.502 -10.815 1.00 0.00 N
+ATOM 505 H ASN A 29 -6.364 -1.008 -11.265 1.00 0.00 H
+ATOM 506 HA ASN A 29 -8.469 -1.838 -11.702 1.00 0.00 H
+ATOM 507 1HB ASN A 29 -7.064 -3.948 -11.219 1.00 0.00 H
+ATOM 508 2HB ASN A 29 -7.874 -3.985 -9.658 1.00 0.00 H
+ATOM 509 1HD2 ASN A 29 -10.255 -6.008 -11.193 1.00 0.00 H
+ATOM 510 2HD2 ASN A 29 -8.958 -5.883 -10.052 1.00 0.00 H
+ATOM 511 N ASN A 30 -9.133 -0.361 -9.437 1.00 0.00 N
+ATOM 512 CA ASN A 30 -10.104 0.230 -8.523 1.00 0.00 C
+ATOM 513 C ASN A 30 -9.917 -0.298 -7.106 1.00 0.00 C
+ATOM 514 O ASN A 30 -10.822 -0.207 -6.275 1.00 0.00 O
+ATOM 515 CB ASN A 30 -11.519 -0.028 -9.007 1.00 0.00 C
+ATOM 516 CG ASN A 30 -11.828 0.684 -10.294 1.00 0.00 C
+ATOM 517 OD1 ASN A 30 -11.606 1.894 -10.417 1.00 0.00 O
+ATOM 518 ND2 ASN A 30 -12.337 -0.043 -11.256 1.00 0.00 N
+ATOM 519 H ASN A 30 -8.456 0.237 -9.888 1.00 0.00 H
+ATOM 520 HA ASN A 30 -9.938 1.308 -8.491 1.00 0.00 H
+ATOM 521 1HB ASN A 30 -11.664 -1.100 -9.153 1.00 0.00 H
+ATOM 522 2HB ASN A 30 -12.229 0.297 -8.246 1.00 0.00 H
+ATOM 523 1HD2 ASN A 30 -12.563 0.378 -12.135 1.00 0.00 H
+ATOM 524 2HD2 ASN A 30 -12.500 -1.019 -11.112 1.00 0.00 H
+ATOM 525 N ARG A 31 -8.739 -0.848 -6.835 1.00 0.00 N
+ATOM 526 CA ARG A 31 -8.354 -1.205 -5.475 1.00 0.00 C
+ATOM 527 C ARG A 31 -8.035 0.034 -4.649 1.00 0.00 C
+ATOM 528 O ARG A 31 -8.364 0.105 -3.465 1.00 0.00 O
+ATOM 529 CB ARG A 31 -7.145 -2.129 -5.485 1.00 0.00 C
+ATOM 530 CG ARG A 31 -6.709 -2.628 -4.117 1.00 0.00 C
+ATOM 531 CD ARG A 31 -5.604 -3.614 -4.218 1.00 0.00 C
+ATOM 532 NE ARG A 31 -4.372 -3.003 -4.691 1.00 0.00 N
+ATOM 533 CZ ARG A 31 -3.846 -3.192 -5.917 1.00 0.00 C
+ATOM 534 NH1 ARG A 31 -4.453 -3.977 -6.779 1.00 0.00 N
+ATOM 535 NH2 ARG A 31 -2.719 -2.589 -6.252 1.00 0.00 N
+ATOM 536 H ARG A 31 -8.093 -1.024 -7.591 1.00 0.00 H
+ATOM 537 HA ARG A 31 -9.193 -1.715 -5.001 1.00 0.00 H
+ATOM 538 1HB ARG A 31 -7.359 -3.001 -6.101 1.00 0.00 H
+ATOM 539 2HB ARG A 31 -6.296 -1.612 -5.933 1.00 0.00 H
+ATOM 540 1HG ARG A 31 -6.364 -1.786 -3.516 1.00 0.00 H
+ATOM 541 2HG ARG A 31 -7.553 -3.108 -3.619 1.00 0.00 H
+ATOM 542 1HD ARG A 31 -5.413 -4.049 -3.237 1.00 0.00 H
+ATOM 543 2HD ARG A 31 -5.883 -4.403 -4.916 1.00 0.00 H
+ATOM 544 HE ARG A 31 -3.876 -2.392 -4.055 1.00 0.00 H
+ATOM 545 1HH1 ARG A 31 -5.315 -4.438 -6.523 1.00 0.00 H
+ATOM 546 2HH1 ARG A 31 -4.058 -4.118 -7.698 1.00 0.00 H
+ATOM 547 1HH2 ARG A 31 -2.252 -1.985 -5.589 1.00 0.00 H
+ATOM 548 2HH2 ARG A 31 -2.324 -2.730 -7.170 1.00 0.00 H
+ATOM 549 N ASN A 32 -7.393 1.011 -5.281 1.00 0.00 N
+ATOM 550 CA ASN A 32 -6.975 2.225 -4.591 1.00 0.00 C
+ATOM 551 C ASN A 32 -7.937 3.374 -4.865 1.00 0.00 C
+ATOM 552 O ASN A 32 -7.617 4.536 -4.616 1.00 0.00 O
+ATOM 553 CB ASN A 32 -5.561 2.606 -4.989 1.00 0.00 C
+ATOM 554 CG ASN A 32 -4.540 1.603 -4.527 1.00 0.00 C
+ATOM 555 OD1 ASN A 32 -4.716 0.953 -3.490 1.00 0.00 O
+ATOM 556 ND2 ASN A 32 -3.476 1.466 -5.275 1.00 0.00 N
+ATOM 557 H ASN A 32 -7.189 0.909 -6.265 1.00 0.00 H
+ATOM 558 HA ASN A 32 -6.994 2.036 -3.516 1.00 0.00 H
+ATOM 559 1HB ASN A 32 -5.500 2.694 -6.075 1.00 0.00 H
+ATOM 560 2HB ASN A 32 -5.313 3.580 -4.567 1.00 0.00 H
+ATOM 561 1HD2 ASN A 32 -2.763 0.813 -5.017 1.00 0.00 H
+ATOM 562 2HD2 ASN A 32 -3.375 2.013 -6.106 1.00 0.00 H
+ATOM 563 N LYS A 33 -9.116 3.041 -5.378 1.00 0.00 N
+ATOM 564 CA LYS A 33 -10.121 4.047 -5.703 1.00 0.00 C
+ATOM 565 C LYS A 33 -10.528 4.839 -4.468 1.00 0.00 C
+ATOM 566 O LYS A 33 -10.750 6.047 -4.539 1.00 0.00 O
+ATOM 567 CB LYS A 33 -11.350 3.391 -6.336 1.00 0.00 C
+ATOM 568 CG LYS A 33 -12.430 4.371 -6.774 1.00 0.00 C
+ATOM 569 CD LYS A 33 -13.575 3.654 -7.474 1.00 0.00 C
+ATOM 570 CE LYS A 33 -14.670 4.628 -7.885 1.00 0.00 C
+ATOM 571 NZ LYS A 33 -15.808 3.937 -8.549 1.00 0.00 N
+ATOM 572 H LYS A 33 -9.322 2.067 -5.548 1.00 0.00 H
+ATOM 573 HA LYS A 33 -9.698 4.735 -6.436 1.00 0.00 H
+ATOM 574 1HB LYS A 33 -11.045 2.815 -7.211 1.00 0.00 H
+ATOM 575 2HB LYS A 33 -11.797 2.695 -5.626 1.00 0.00 H
+ATOM 576 1HG LYS A 33 -12.821 4.895 -5.901 1.00 0.00 H
+ATOM 577 2HG LYS A 33 -12.001 5.105 -7.455 1.00 0.00 H
+ATOM 578 1HD LYS A 33 -13.198 3.148 -8.364 1.00 0.00 H
+ATOM 579 2HD LYS A 33 -14.000 2.906 -6.805 1.00 0.00 H
+ATOM 580 1HE LYS A 33 -15.041 5.149 -7.004 1.00 0.00 H
+ATOM 581 2HE LYS A 33 -14.260 5.367 -8.572 1.00 0.00 H
+ATOM 582 1HZ LYS A 33 -16.511 4.616 -8.805 1.00 0.00 H
+ATOM 583 2HZ LYS A 33 -15.479 3.464 -9.379 1.00 0.00 H
+ATOM 584 3HZ LYS A 33 -16.209 3.261 -7.914 1.00 0.00 H
+ATOM 585 N GLU A 34 -10.624 4.150 -3.335 1.00 0.00 N
+ATOM 586 CA GLU A 34 -11.043 4.781 -2.089 1.00 0.00 C
+ATOM 587 C GLU A 34 -10.040 5.836 -1.641 1.00 0.00 C
+ATOM 588 O GLU A 34 -10.421 6.898 -1.147 1.00 0.00 O
+ATOM 589 CB GLU A 34 -11.216 3.729 -0.991 1.00 0.00 C
+ATOM 590 CG GLU A 34 -12.400 2.795 -1.196 1.00 0.00 C
+ATOM 591 CD GLU A 34 -12.504 1.739 -0.130 1.00 0.00 C
+ATOM 592 OE1 GLU A 34 -11.610 1.646 0.676 1.00 0.00 O
+ATOM 593 OE2 GLU A 34 -13.479 1.025 -0.122 1.00 0.00 O
+ATOM 594 H GLU A 34 -10.401 3.165 -3.338 1.00 0.00 H
+ATOM 595 HA GLU A 34 -12.008 5.262 -2.252 1.00 0.00 H
+ATOM 596 1HB GLU A 34 -10.315 3.118 -0.927 1.00 0.00 H
+ATOM 597 2HB GLU A 34 -11.343 4.225 -0.029 1.00 0.00 H
+ATOM 598 1HG GLU A 34 -13.317 3.383 -1.199 1.00 0.00 H
+ATOM 599 2HG GLU A 34 -12.306 2.314 -2.168 1.00 0.00 H
+ATOM 600 N MET A 35 -8.757 5.538 -1.816 1.00 0.00 N
+ATOM 601 CA MET A 35 -7.699 6.482 -1.478 1.00 0.00 C
+ATOM 602 C MET A 35 -7.763 7.721 -2.362 1.00 0.00 C
+ATOM 603 O MET A 35 -7.579 8.843 -1.889 1.00 0.00 O
+ATOM 604 CB MET A 35 -6.333 5.809 -1.601 1.00 0.00 C
+ATOM 605 CG MET A 35 -6.036 4.784 -0.516 1.00 0.00 C
+ATOM 606 SD MET A 35 -5.898 5.526 1.122 1.00 0.00 S
+ATOM 607 CE MET A 35 -4.323 6.367 0.981 1.00 0.00 C
+ATOM 608 H MET A 35 -8.509 4.635 -2.193 1.00 0.00 H
+ATOM 609 HA MET A 35 -7.826 6.787 -0.438 1.00 0.00 H
+ATOM 610 1HB MET A 35 -6.261 5.306 -2.564 1.00 0.00 H
+ATOM 611 2HB MET A 35 -5.549 6.567 -1.568 1.00 0.00 H
+ATOM 612 1HG MET A 35 -6.831 4.040 -0.491 1.00 0.00 H
+ATOM 613 2HG MET A 35 -5.100 4.275 -0.743 1.00 0.00 H
+ATOM 614 1HE MET A 35 -4.097 6.876 1.919 1.00 0.00 H
+ATOM 615 2HE MET A 35 -3.540 5.640 0.763 1.00 0.00 H
+ATOM 616 3HE MET A 35 -4.373 7.099 0.174 1.00 0.00 H
+ATOM 617 N ILE A 36 -8.025 7.512 -3.647 1.00 0.00 N
+ATOM 618 CA ILE A 36 -8.123 8.613 -4.598 1.00 0.00 C
+ATOM 619 C ILE A 36 -9.362 9.459 -4.335 1.00 0.00 C
+ATOM 620 O ILE A 36 -9.295 10.688 -4.322 1.00 0.00 O
+ATOM 621 CB ILE A 36 -8.157 8.088 -6.045 1.00 0.00 C
+ATOM 622 CG1 ILE A 36 -6.834 7.402 -6.396 1.00 0.00 C
+ATOM 623 CG2 ILE A 36 -8.447 9.222 -7.016 1.00 0.00 C
+ATOM 624 CD1 ILE A 36 -6.895 6.563 -7.652 1.00 0.00 C
+ATOM 625 H ILE A 36 -8.159 6.566 -3.974 1.00 0.00 H
+ATOM 626 HA ILE A 36 -7.239 9.243 -4.490 1.00 0.00 H
+ATOM 627 HB ILE A 36 -8.938 7.333 -6.139 1.00 0.00 H
+ATOM 628 1HG1 ILE A 36 -6.058 8.155 -6.526 1.00 0.00 H
+ATOM 629 2HG1 ILE A 36 -6.529 6.758 -5.571 1.00 0.00 H
+ATOM 630 1HG2 ILE A 36 -8.467 8.833 -8.034 1.00 0.00 H
+ATOM 631 2HG2 ILE A 36 -9.412 9.667 -6.778 1.00 0.00 H
+ATOM 632 3HG2 ILE A 36 -7.667 9.980 -6.932 1.00 0.00 H
+ATOM 633 1HD1 ILE A 36 -5.921 6.109 -7.834 1.00 0.00 H
+ATOM 634 2HD1 ILE A 36 -7.644 5.779 -7.530 1.00 0.00 H
+ATOM 635 3HD1 ILE A 36 -7.165 7.194 -8.497 1.00 0.00 H
+ATOM 636 N LYS A 37 -10.493 8.794 -4.125 1.00 0.00 N
+ATOM 637 CA LYS A 37 -11.751 9.484 -3.868 1.00 0.00 C
+ATOM 638 C LYS A 37 -11.651 10.372 -2.633 1.00 0.00 C
+ATOM 639 O LYS A 37 -12.125 11.507 -2.633 1.00 0.00 O
+ATOM 640 CB LYS A 37 -12.890 8.477 -3.700 1.00 0.00 C
+ATOM 641 CG LYS A 37 -14.260 9.107 -3.483 1.00 0.00 C
+ATOM 642 CD LYS A 37 -15.347 8.047 -3.393 1.00 0.00 C
+ATOM 643 CE LYS A 37 -16.711 8.672 -3.141 1.00 0.00 C
+ATOM 644 NZ LYS A 37 -17.785 7.646 -3.047 1.00 0.00 N
+ATOM 645 H LYS A 37 -10.480 7.784 -4.143 1.00 0.00 H
+ATOM 646 HA LYS A 37 -11.985 10.110 -4.730 1.00 0.00 H
+ATOM 647 1HB LYS A 37 -12.949 7.844 -4.586 1.00 0.00 H
+ATOM 648 2HB LYS A 37 -12.681 7.830 -2.848 1.00 0.00 H
+ATOM 649 1HG LYS A 37 -14.252 9.686 -2.559 1.00 0.00 H
+ATOM 650 2HG LYS A 37 -14.486 9.778 -4.310 1.00 0.00 H
+ATOM 651 1HD LYS A 37 -15.382 7.481 -4.325 1.00 0.00 H
+ATOM 652 2HD LYS A 37 -15.118 7.358 -2.580 1.00 0.00 H
+ATOM 653 1HE LYS A 37 -16.685 9.238 -2.211 1.00 0.00 H
+ATOM 654 2HE LYS A 37 -16.952 9.359 -3.952 1.00 0.00 H
+ATOM 655 1HZ LYS A 37 -18.672 8.100 -2.880 1.00 0.00 H
+ATOM 656 2HZ LYS A 37 -17.831 7.126 -3.912 1.00 0.00 H
+ATOM 657 3HZ LYS A 37 -17.582 7.014 -2.286 1.00 0.00 H
+ATOM 658 N LYS A 38 -11.030 9.847 -1.582 1.00 0.00 N
+ATOM 659 CA LYS A 38 -10.871 10.588 -0.337 1.00 0.00 C
+ATOM 660 C LYS A 38 -10.011 11.829 -0.540 1.00 0.00 C
+ATOM 661 O LYS A 38 -10.333 12.907 -0.042 1.00 0.00 O
+ATOM 662 CB LYS A 38 -10.260 9.695 0.744 1.00 0.00 C
+ATOM 663 CG LYS A 38 -10.046 10.386 2.084 1.00 0.00 C
+ATOM 664 CD LYS A 38 -11.362 10.875 2.670 1.00 0.00 C
+ATOM 665 CE LYS A 38 -11.215 11.233 4.142 1.00 0.00 C
+ATOM 666 NZ LYS A 38 -10.271 12.365 4.347 1.00 0.00 N
+ATOM 667 H LYS A 38 -10.658 8.910 -1.648 1.00 0.00 H
+ATOM 668 HA LYS A 38 -11.858 10.899 0.008 1.00 0.00 H
+ATOM 669 1HB LYS A 38 -10.905 8.833 0.911 1.00 0.00 H
+ATOM 670 2HB LYS A 38 -9.294 9.321 0.403 1.00 0.00 H
+ATOM 671 1HG LYS A 38 -9.583 9.689 2.783 1.00 0.00 H
+ATOM 672 2HG LYS A 38 -9.379 11.238 1.952 1.00 0.00 H
+ATOM 673 1HD LYS A 38 -11.700 11.755 2.122 1.00 0.00 H
+ATOM 674 2HD LYS A 38 -12.117 10.094 2.570 1.00 0.00 H
+ATOM 675 1HE LYS A 38 -12.187 11.508 4.548 1.00 0.00 H
+ATOM 676 2HE LYS A 38 -10.848 10.366 4.692 1.00 0.00 H
+ATOM 677 1HZ LYS A 38 -10.201 12.570 5.334 1.00 0.00 H
+ATOM 678 2HZ LYS A 38 -9.360 12.113 3.990 1.00 0.00 H
+ATOM 679 3HZ LYS A 38 -10.611 13.180 3.857 1.00 0.00 H
+ATOM 680 N ALA A 39 -8.916 11.669 -1.275 1.00 0.00 N
+ATOM 681 CA ALA A 39 -8.030 12.786 -1.582 1.00 0.00 C
+ATOM 682 C ALA A 39 -8.761 13.871 -2.362 1.00 0.00 C
+ATOM 683 O ALA A 39 -8.558 15.062 -2.125 1.00 0.00 O
+ATOM 684 CB ALA A 39 -6.816 12.300 -2.361 1.00 0.00 C
+ATOM 685 H ALA A 39 -8.692 10.751 -1.631 1.00 0.00 H
+ATOM 686 HA ALA A 39 -7.671 13.211 -0.644 1.00 0.00 H
+ATOM 687 1HB ALA A 39 -6.164 13.145 -2.583 1.00 0.00 H
+ATOM 688 2HB ALA A 39 -6.271 11.567 -1.766 1.00 0.00 H
+ATOM 689 3HB ALA A 39 -7.143 11.841 -3.293 1.00 0.00 H
+ATOM 690 N ARG A 40 -9.611 13.453 -3.293 1.00 0.00 N
+ATOM 691 CA ARG A 40 -10.405 14.388 -4.081 1.00 0.00 C
+ATOM 692 C ARG A 40 -11.493 15.036 -3.236 1.00 0.00 C
+ATOM 693 O ARG A 40 -11.803 16.216 -3.403 1.00 0.00 O
+ATOM 694 CB ARG A 40 -11.043 13.680 -5.268 1.00 0.00 C
+ATOM 695 CG ARG A 40 -10.072 13.264 -6.361 1.00 0.00 C
+ATOM 696 CD ARG A 40 -10.746 12.470 -7.421 1.00 0.00 C
+ATOM 697 NE ARG A 40 -9.833 12.115 -8.496 1.00 0.00 N
+ATOM 698 CZ ARG A 40 -10.155 11.336 -9.547 1.00 0.00 C
+ATOM 699 NH1 ARG A 40 -11.368 10.839 -9.650 1.00 0.00 N
+ATOM 700 NH2 ARG A 40 -9.251 11.071 -10.474 1.00 0.00 N
+ATOM 701 H ARG A 40 -9.710 12.461 -3.459 1.00 0.00 H
+ATOM 702 HA ARG A 40 -9.744 15.169 -4.460 1.00 0.00 H
+ATOM 703 1HB ARG A 40 -11.556 12.784 -4.924 1.00 0.00 H
+ATOM 704 2HB ARG A 40 -11.790 14.332 -5.721 1.00 0.00 H
+ATOM 705 1HG ARG A 40 -9.639 14.152 -6.822 1.00 0.00 H
+ATOM 706 2HG ARG A 40 -9.277 12.654 -5.930 1.00 0.00 H
+ATOM 707 1HD ARG A 40 -11.140 11.550 -6.991 1.00 0.00 H
+ATOM 708 2HD ARG A 40 -11.563 13.051 -7.846 1.00 0.00 H
+ATOM 709 HE ARG A 40 -8.890 12.478 -8.451 1.00 0.00 H
+ATOM 710 1HH1 ARG A 40 -12.058 11.042 -8.941 1.00 0.00 H
+ATOM 711 2HH1 ARG A 40 -11.609 10.255 -10.437 1.00 0.00 H
+ATOM 712 1HH2 ARG A 40 -8.319 11.453 -10.395 1.00 0.00 H
+ATOM 713 2HH2 ARG A 40 -9.493 10.487 -11.261 1.00 0.00 H
+ATOM 714 N LYS A 41 -12.071 14.258 -2.327 1.00 0.00 N
+ATOM 715 CA LYS A 41 -13.091 14.769 -1.418 1.00 0.00 C
+ATOM 716 C LYS A 41 -12.523 15.845 -0.502 1.00 0.00 C
+ATOM 717 O LYS A 41 -13.159 16.872 -0.266 1.00 0.00 O
+ATOM 718 CB LYS A 41 -13.686 13.631 -0.587 1.00 0.00 C
+ATOM 719 CG LYS A 41 -14.821 14.054 0.336 1.00 0.00 C
+ATOM 720 CD LYS A 41 -15.422 12.856 1.057 1.00 0.00 C
+ATOM 721 CE LYS A 41 -16.543 13.279 1.995 1.00 0.00 C
+ATOM 722 NZ LYS A 41 -17.143 12.117 2.705 1.00 0.00 N
+ATOM 723 H LYS A 41 -11.797 13.288 -2.263 1.00 0.00 H
+ATOM 724 HA LYS A 41 -13.896 15.204 -2.011 1.00 0.00 H
+ATOM 725 1HB LYS A 41 -14.067 12.855 -1.252 1.00 0.00 H
+ATOM 726 2HB LYS A 41 -12.905 13.182 0.027 1.00 0.00 H
+ATOM 727 1HG LYS A 41 -14.445 14.761 1.076 1.00 0.00 H
+ATOM 728 2HG LYS A 41 -15.600 14.545 -0.247 1.00 0.00 H
+ATOM 729 1HD LYS A 41 -15.819 12.152 0.325 1.00 0.00 H
+ATOM 730 2HD LYS A 41 -14.647 12.354 1.636 1.00 0.00 H
+ATOM 731 1HE LYS A 41 -16.154 13.979 2.734 1.00 0.00 H
+ATOM 732 2HE LYS A 41 -17.324 13.783 1.425 1.00 0.00 H
+ATOM 733 1HZ LYS A 41 -17.881 12.439 3.315 1.00 0.00 H
+ATOM 734 2HZ LYS A 41 -17.524 11.469 2.029 1.00 0.00 H
+ATOM 735 3HZ LYS A 41 -16.433 11.653 3.252 1.00 0.00 H
+ATOM 736 N ASP A 42 -11.322 15.604 0.013 1.00 0.00 N
+ATOM 737 CA ASP A 42 -10.652 16.567 0.878 1.00 0.00 C
+ATOM 738 C ASP A 42 -10.428 17.891 0.159 1.00 0.00 C
+ATOM 739 O ASP A 42 -10.605 18.961 0.741 1.00 0.00 O
+ATOM 740 CB ASP A 42 -9.311 16.010 1.363 1.00 0.00 C
+ATOM 741 CG ASP A 42 -9.468 14.917 2.413 1.00 0.00 C
+ATOM 742 OD1 ASP A 42 -10.546 14.779 2.941 1.00 0.00 O
+ATOM 743 OD2 ASP A 42 -8.509 14.232 2.676 1.00 0.00 O
+ATOM 744 H ASP A 42 -10.862 14.730 -0.201 1.00 0.00 H
+ATOM 745 HA ASP A 42 -11.281 16.744 1.751 1.00 0.00 H
+ATOM 746 1HB ASP A 42 -8.758 15.603 0.516 1.00 0.00 H
+ATOM 747 2HB ASP A 42 -8.713 16.817 1.787 1.00 0.00 H
+ATOM 748 N GLY A 43 -10.038 17.811 -1.108 1.00 0.00 N
+ATOM 749 CA GLY A 43 -9.894 18.999 -1.941 1.00 0.00 C
+ATOM 750 C GLY A 43 -8.426 19.356 -2.142 1.00 0.00 C
+ATOM 751 O GLY A 43 -7.590 19.092 -1.279 1.00 0.00 O
+ATOM 752 OXT GLY A 43 -8.074 19.902 -3.151 1.00 0.00 O
+ATOM 753 H GLY A 43 -9.837 16.905 -1.505 1.00 0.00 H
+ATOM 754 1HA GLY A 43 -10.365 18.825 -2.909 1.00 0.00 H
+ATOM 755 2HA GLY A 43 -10.415 19.835 -1.476 1.00 0.00 H
+TER
+##Begin comments##
+BINARY SILENTFILE
+DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL
+PHI 0,-54.5572,-60.2467,-60.9634,-60.4676,-65.7719,-63.5563,-65.2464,-62.5039,-63.2215,-64.1208,-60.0195,-83.1244,58.7484,-96.7981,-137.854,-66.3124,-66.1585,-59.9077,-64.3169,-76.7933,-66.3685,-68.1659,-64.0473,-61.7068,-63.6098,-65.9486,-82.1598,54.8093,63.5734,-73.0406,-100.497,-59.9985,-64.1426,-64.8969,-68.9793,-58.905,-63.5249,-60.743,-71.1887,-63.4747,-59.8767,104.914
+PSI 162.467,-34.3712,-48.1987,-44.7463,-41.5844,-44.1755,-40.4318,-45.5086,-39.0213,-39.2029,-46.8664,-35.3137,1.05838,42.4349,-9.48289,152.05,150.804,-14.5255,-29.2664,-30.3987,-35.6775,-39.8363,-37.3589,-45.123,-45.4977,-50.0044,-34.3209,-1.27599,44.0987,19.181,-38.3722,15.6062,-38.2438,-39.3684,-41.2412,-45.7938,-43.1405,-43.8152,-39.8081,-36.9813,-42.7778,-41.0853,0
+##End comments##
+
+AlaCount 2
+AverageDegree 13.651
+BuriedUnsatHbond 1
+Buried_non_polar_SASA_per_res 35.924
+CavityVolume 2.871
+CoreAverageDegree 18.9
+CoreResidueCount 10
+ExposeCoreHydrophobicsPerCoreResidue 19.122
+ExposeCoreHydrophobicsSASA 191.218
+ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent 10.367
+ExposedHydrophobics_on_TotalSASAPercent 5.318
+HasCoreResidueNum 7
+MaxDistanceToToMassCenter 6.967
+PackStat 0.65
+Rg 9.786
+SSShapeComplementarity 0.69
+ScorePerResFilter -1.713
+driftRMSD 0.87
+frac_helix 72.093
+frac_loop 27.907
+frac_sheet 0
+n_hydrophobic 10
+nres_helix 31
+nres_loop 12
+nres_sheet 0
+nres_total 43
+percent_core 0.163
+score -104.212
+ss_mismatch_probability 0.334
+
diff --git a/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb
new file mode 100644
index 0000000..c045b07
--- /dev/null
+++ b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb
@@ -0,0 +1,793 @@
+HEADER 31-AUG-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 31-AUG-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.31+release.c7009b3115c
+ATOM 1 N THR A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA THR A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C THR A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O THR A 1 1.805 2.175 -0.950 1.00 0.00 O
+ATOM 5 CB THR A 1 2.012 -0.770 -1.213 1.00 0.00 C
+ATOM 6 OG1 THR A 1 1.561 -2.130 -1.166 1.00 0.00 O
+ATOM 7 CG2 THR A 1 3.533 -0.744 -1.212 1.00 0.00 C
+ATOM 8 1H THR A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 9 2H THR A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 10 3H THR A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 11 HA THR A 1 1.804 -0.495 0.908 1.00 0.00 H
+ATOM 12 HB THR A 1 1.647 -0.312 -2.132 1.00 0.00 H
+ATOM 13 HG1 THR A 1 1.693 -2.540 -2.024 1.00 0.00 H
+ATOM 14 1HG2 THR A 1 3.907 -1.292 -2.076 1.00 0.00 H
+ATOM 15 2HG2 THR A 1 3.879 0.289 -1.259 1.00 0.00 H
+ATOM 16 3HG2 THR A 1 3.904 -1.209 -0.299 1.00 0.00 H
+ATOM 17 N GLU A 2 2.708 1.778 1.072 1.00 0.00 N
+ATOM 18 CA GLU A 2 3.194 3.141 1.249 1.00 0.00 C
+ATOM 19 C GLU A 2 4.162 3.530 0.139 1.00 0.00 C
+ATOM 20 O GLU A 2 4.163 4.670 -0.326 1.00 0.00 O
+ATOM 21 CB GLU A 2 3.878 3.291 2.610 1.00 0.00 C
+ATOM 22 CG GLU A 2 2.949 3.113 3.803 1.00 0.00 C
+ATOM 23 CD GLU A 2 2.660 1.670 4.109 1.00 0.00 C
+ATOM 24 OE1 GLU A 2 3.192 0.821 3.434 1.00 0.00 O
+ATOM 25 OE2 GLU A 2 1.905 1.415 5.018 1.00 0.00 O
+ATOM 26 H GLU A 2 2.908 1.088 1.781 1.00 0.00 H
+ATOM 27 HA GLU A 2 2.341 3.819 1.222 1.00 0.00 H
+ATOM 28 1HB GLU A 2 4.679 2.557 2.698 1.00 0.00 H
+ATOM 29 2HB GLU A 2 4.330 4.280 2.683 1.00 0.00 H
+ATOM 30 1HG GLU A 2 3.406 3.573 4.678 1.00 0.00 H
+ATOM 31 2HG GLU A 2 2.012 3.631 3.601 1.00 0.00 H
+ATOM 32 N VAL A 3 4.985 2.575 -0.283 1.00 0.00 N
+ATOM 33 CA VAL A 3 5.990 2.828 -1.308 1.00 0.00 C
+ATOM 34 C VAL A 3 5.344 3.265 -2.617 1.00 0.00 C
+ATOM 35 O VAL A 3 5.808 4.202 -3.267 1.00 0.00 O
+ATOM 36 CB VAL A 3 6.834 1.563 -1.553 1.00 0.00 C
+ATOM 37 CG1 VAL A 3 7.715 1.740 -2.781 1.00 0.00 C
+ATOM 38 CG2 VAL A 3 7.676 1.257 -0.324 1.00 0.00 C
+ATOM 39 H VAL A 3 4.912 1.651 0.117 1.00 0.00 H
+ATOM 40 HA VAL A 3 6.647 3.626 -0.959 1.00 0.00 H
+ATOM 41 HB VAL A 3 6.166 0.726 -1.754 1.00 0.00 H
+ATOM 42 1HG1 VAL A 3 8.304 0.836 -2.939 1.00 0.00 H
+ATOM 43 2HG1 VAL A 3 7.089 1.922 -3.654 1.00 0.00 H
+ATOM 44 3HG1 VAL A 3 8.384 2.587 -2.629 1.00 0.00 H
+ATOM 45 1HG2 VAL A 3 8.270 0.361 -0.504 1.00 0.00 H
+ATOM 46 2HG2 VAL A 3 8.340 2.098 -0.119 1.00 0.00 H
+ATOM 47 3HG2 VAL A 3 7.023 1.094 0.533 1.00 0.00 H
+ATOM 48 N GLU A 4 4.271 2.581 -2.998 1.00 0.00 N
+ATOM 49 CA GLU A 4 3.570 2.885 -4.240 1.00 0.00 C
+ATOM 50 C GLU A 4 2.953 4.277 -4.197 1.00 0.00 C
+ATOM 51 O GLU A 4 3.016 5.025 -5.173 1.00 0.00 O
+ATOM 52 CB GLU A 4 2.482 1.843 -4.508 1.00 0.00 C
+ATOM 53 CG GLU A 4 3.010 0.470 -4.898 1.00 0.00 C
+ATOM 54 CD GLU A 4 1.921 -0.556 -5.044 1.00 0.00 C
+ATOM 55 OE1 GLU A 4 0.847 -0.331 -4.538 1.00 0.00 O
+ATOM 56 OE2 GLU A 4 2.162 -1.567 -5.661 1.00 0.00 O
+ATOM 57 H GLU A 4 3.932 1.831 -2.413 1.00 0.00 H
+ATOM 58 HA GLU A 4 4.287 2.846 -5.061 1.00 0.00 H
+ATOM 59 1HB GLU A 4 1.866 1.723 -3.617 1.00 0.00 H
+ATOM 60 2HB GLU A 4 1.833 2.192 -5.310 1.00 0.00 H
+ATOM 61 1HG GLU A 4 3.543 0.553 -5.845 1.00 0.00 H
+ATOM 62 2HG GLU A 4 3.719 0.136 -4.142 1.00 0.00 H
+ATOM 63 N GLU A 5 2.356 4.620 -3.060 1.00 0.00 N
+ATOM 64 CA GLU A 5 1.744 5.931 -2.880 1.00 0.00 C
+ATOM 65 C GLU A 5 2.783 7.041 -2.970 1.00 0.00 C
+ATOM 66 O GLU A 5 2.529 8.098 -3.546 1.00 0.00 O
+ATOM 67 CB GLU A 5 1.021 6.002 -1.533 1.00 0.00 C
+ATOM 68 CG GLU A 5 -0.225 5.134 -1.442 1.00 0.00 C
+ATOM 69 CD GLU A 5 -0.880 5.191 -0.090 1.00 0.00 C
+ATOM 70 OE1 GLU A 5 -0.343 5.831 0.783 1.00 0.00 O
+ATOM 71 OE2 GLU A 5 -1.918 4.594 0.071 1.00 0.00 O
+ATOM 72 H GLU A 5 2.325 3.954 -2.301 1.00 0.00 H
+ATOM 73 HA GLU A 5 1.006 6.079 -3.669 1.00 0.00 H
+ATOM 74 1HB GLU A 5 1.702 5.696 -0.739 1.00 0.00 H
+ATOM 75 2HB GLU A 5 0.727 7.033 -1.333 1.00 0.00 H
+ATOM 76 1HG GLU A 5 -0.942 5.464 -2.193 1.00 0.00 H
+ATOM 77 2HG GLU A 5 0.046 4.103 -1.666 1.00 0.00 H
+ATOM 78 N ILE A 6 3.956 6.794 -2.396 1.00 0.00 N
+ATOM 79 CA ILE A 6 5.046 7.761 -2.433 1.00 0.00 C
+ATOM 80 C ILE A 6 5.526 7.996 -3.859 1.00 0.00 C
+ATOM 81 O ILE A 6 5.718 9.137 -4.280 1.00 0.00 O
+ATOM 82 CB ILE A 6 6.227 7.292 -1.564 1.00 0.00 C
+ATOM 83 CG1 ILE A 6 5.843 7.318 -0.082 1.00 0.00 C
+ATOM 84 CG2 ILE A 6 7.451 8.159 -1.815 1.00 0.00 C
+ATOM 85 CD1 ILE A 6 6.786 6.539 0.807 1.00 0.00 C
+ATOM 86 H ILE A 6 4.096 5.913 -1.922 1.00 0.00 H
+ATOM 87 HA ILE A 6 4.684 8.706 -2.026 1.00 0.00 H
+ATOM 88 HB ILE A 6 6.470 6.258 -1.808 1.00 0.00 H
+ATOM 89 1HG1 ILE A 6 5.817 8.349 0.269 1.00 0.00 H
+ATOM 90 2HG1 ILE A 6 4.841 6.906 0.042 1.00 0.00 H
+ATOM 91 1HG2 ILE A 6 8.276 7.814 -1.193 1.00 0.00 H
+ATOM 92 2HG2 ILE A 6 7.735 8.091 -2.865 1.00 0.00 H
+ATOM 93 3HG2 ILE A 6 7.219 9.195 -1.569 1.00 0.00 H
+ATOM 94 1HD1 ILE A 6 6.448 6.604 1.841 1.00 0.00 H
+ATOM 95 2HD1 ILE A 6 6.801 5.494 0.495 1.00 0.00 H
+ATOM 96 3HD1 ILE A 6 7.789 6.956 0.727 1.00 0.00 H
+ATOM 97 N LEU A 7 5.719 6.910 -4.600 1.00 0.00 N
+ATOM 98 CA LEU A 7 6.209 6.994 -5.970 1.00 0.00 C
+ATOM 99 C LEU A 7 5.209 7.708 -6.870 1.00 0.00 C
+ATOM 100 O LEU A 7 5.590 8.496 -7.736 1.00 0.00 O
+ATOM 101 CB LEU A 7 6.490 5.590 -6.520 1.00 0.00 C
+ATOM 102 CG LEU A 7 7.659 4.841 -5.868 1.00 0.00 C
+ATOM 103 CD1 LEU A 7 7.616 3.375 -6.277 1.00 0.00 C
+ATOM 104 CD2 LEU A 7 8.972 5.487 -6.286 1.00 0.00 C
+ATOM 105 H LEU A 7 5.521 6.002 -4.203 1.00 0.00 H
+ATOM 106 HA LEU A 7 7.143 7.557 -5.970 1.00 0.00 H
+ATOM 107 1HB LEU A 7 5.595 4.982 -6.392 1.00 0.00 H
+ATOM 108 2HB LEU A 7 6.701 5.670 -7.586 1.00 0.00 H
+ATOM 109 HG LEU A 7 7.562 4.888 -4.783 1.00 0.00 H
+ATOM 110 1HD1 LEU A 7 8.447 2.843 -5.813 1.00 0.00 H
+ATOM 111 2HD1 LEU A 7 6.675 2.934 -5.948 1.00 0.00 H
+ATOM 112 3HD1 LEU A 7 7.695 3.297 -7.360 1.00 0.00 H
+ATOM 113 1HD2 LEU A 7 9.803 4.955 -5.822 1.00 0.00 H
+ATOM 114 2HD2 LEU A 7 9.071 5.439 -7.371 1.00 0.00 H
+ATOM 115 3HD2 LEU A 7 8.983 6.529 -5.966 1.00 0.00 H
+ATOM 116 N LYS A 8 3.927 7.427 -6.661 1.00 0.00 N
+ATOM 117 CA LYS A 8 2.869 8.047 -7.449 1.00 0.00 C
+ATOM 118 C LYS A 8 2.877 9.561 -7.290 1.00 0.00 C
+ATOM 119 O LYS A 8 2.673 10.298 -8.255 1.00 0.00 O
+ATOM 120 CB LYS A 8 1.504 7.483 -7.050 1.00 0.00 C
+ATOM 121 CG LYS A 8 1.234 6.072 -7.555 1.00 0.00 C
+ATOM 122 CD LYS A 8 -0.092 5.541 -7.031 1.00 0.00 C
+ATOM 123 CE LYS A 8 -0.342 4.115 -7.497 1.00 0.00 C
+ATOM 124 NZ LYS A 8 -1.612 3.565 -6.951 1.00 0.00 N
+ATOM 125 H LYS A 8 3.680 6.768 -5.936 1.00 0.00 H
+ATOM 126 HA LYS A 8 3.033 7.805 -8.500 1.00 0.00 H
+ATOM 127 1HB LYS A 8 1.418 7.471 -5.963 1.00 0.00 H
+ATOM 128 2HB LYS A 8 0.716 8.132 -7.434 1.00 0.00 H
+ATOM 129 1HG LYS A 8 1.209 6.074 -8.646 1.00 0.00 H
+ATOM 130 2HG LYS A 8 2.035 5.409 -7.229 1.00 0.00 H
+ATOM 131 1HD LYS A 8 -0.087 5.562 -5.940 1.00 0.00 H
+ATOM 132 2HD LYS A 8 -0.904 6.176 -7.385 1.00 0.00 H
+ATOM 133 1HE LYS A 8 -0.388 4.091 -8.585 1.00 0.00 H
+ATOM 134 2HE LYS A 8 0.482 3.477 -7.177 1.00 0.00 H
+ATOM 135 1HZ LYS A 8 -1.741 2.619 -7.282 1.00 0.00 H
+ATOM 136 2HZ LYS A 8 -1.573 3.565 -5.941 1.00 0.00 H
+ATOM 137 3HZ LYS A 8 -2.386 4.136 -7.257 1.00 0.00 H
+ATOM 138 N ARG A 9 3.114 10.021 -6.066 1.00 0.00 N
+ATOM 139 CA ARG A 9 3.213 11.449 -5.789 1.00 0.00 C
+ATOM 140 C ARG A 9 4.500 12.032 -6.356 1.00 0.00 C
+ATOM 141 O ARG A 9 4.496 13.109 -6.952 1.00 0.00 O
+ATOM 142 CB ARG A 9 3.158 11.709 -4.291 1.00 0.00 C
+ATOM 143 CG ARG A 9 1.799 11.478 -3.651 1.00 0.00 C
+ATOM 144 CD ARG A 9 1.718 12.086 -2.298 1.00 0.00 C
+ATOM 145 NE ARG A 9 2.686 11.502 -1.383 1.00 0.00 N
+ATOM 146 CZ ARG A 9 2.472 10.391 -0.650 1.00 0.00 C
+ATOM 147 NH1 ARG A 9 1.324 9.758 -0.736 1.00 0.00 N
+ATOM 148 NH2 ARG A 9 3.418 9.939 0.155 1.00 0.00 N
+ATOM 149 H ARG A 9 3.228 9.364 -5.307 1.00 0.00 H
+ATOM 150 HA ARG A 9 2.365 11.952 -6.257 1.00 0.00 H
+ATOM 151 1HB ARG A 9 3.875 11.065 -3.784 1.00 0.00 H
+ATOM 152 2HB ARG A 9 3.446 12.741 -4.090 1.00 0.00 H
+ATOM 153 1HG ARG A 9 1.022 11.924 -4.273 1.00 0.00 H
+ATOM 154 2HG ARG A 9 1.618 10.407 -3.557 1.00 0.00 H
+ATOM 155 1HD ARG A 9 1.917 13.155 -2.367 1.00 0.00 H
+ATOM 156 2HD ARG A 9 0.722 11.927 -1.887 1.00 0.00 H
+ATOM 157 HE ARG A 9 3.582 11.961 -1.290 1.00 0.00 H
+ATOM 158 1HH1 ARG A 9 0.601 10.104 -1.351 1.00 0.00 H
+ATOM 159 2HH1 ARG A 9 1.164 8.926 -0.187 1.00 0.00 H
+ATOM 160 1HH2 ARG A 9 4.301 10.426 0.221 1.00 0.00 H
+ATOM 161 2HH2 ARG A 9 3.258 9.107 0.704 1.00 0.00 H
+ATOM 162 N ALA A 10 5.602 11.314 -6.168 1.00 0.00 N
+ATOM 163 CA ALA A 10 6.904 11.770 -6.641 1.00 0.00 C
+ATOM 164 C ALA A 10 6.930 11.881 -8.160 1.00 0.00 C
+ATOM 165 O ALA A 10 7.627 12.728 -8.718 1.00 0.00 O
+ATOM 166 CB ALA A 10 8.001 10.830 -6.161 1.00 0.00 C
+ATOM 167 H ALA A 10 5.537 10.430 -5.684 1.00 0.00 H
+ATOM 168 HA ALA A 10 7.102 12.754 -6.214 1.00 0.00 H
+ATOM 169 1HB ALA A 10 8.967 11.184 -6.522 1.00 0.00 H
+ATOM 170 2HB ALA A 10 8.008 10.806 -5.071 1.00 0.00 H
+ATOM 171 3HB ALA A 10 7.815 9.828 -6.544 1.00 0.00 H
+ATOM 172 N ALA A 11 6.166 11.021 -8.824 1.00 0.00 N
+ATOM 173 CA ALA A 11 6.140 10.986 -10.281 1.00 0.00 C
+ATOM 174 C ALA A 11 5.490 12.240 -10.851 1.00 0.00 C
+ATOM 175 O ALA A 11 5.593 12.515 -12.047 1.00 0.00 O
+ATOM 176 CB ALA A 11 5.409 9.743 -10.769 1.00 0.00 C
+ATOM 177 H ALA A 11 5.587 10.375 -8.306 1.00 0.00 H
+ATOM 178 HA ALA A 11 7.167 10.928 -10.644 1.00 0.00 H
+ATOM 179 1HB ALA A 11 5.399 9.731 -11.859 1.00 0.00 H
+ATOM 180 2HB ALA A 11 5.920 8.853 -10.401 1.00 0.00 H
+ATOM 181 3HB ALA A 11 4.386 9.754 -10.396 1.00 0.00 H
+ATOM 182 N LYS A 12 4.822 12.998 -9.989 1.00 0.00 N
+ATOM 183 CA LYS A 12 4.160 14.229 -10.404 1.00 0.00 C
+ATOM 184 C LYS A 12 5.114 15.415 -10.344 1.00 0.00 C
+ATOM 185 O LYS A 12 4.764 16.526 -10.741 1.00 0.00 O
+ATOM 186 CB LYS A 12 2.932 14.497 -9.531 1.00 0.00 C
+ATOM 187 CG LYS A 12 1.816 13.473 -9.684 1.00 0.00 C
+ATOM 188 CD LYS A 12 0.633 13.807 -8.788 1.00 0.00 C
+ATOM 189 CE LYS A 12 -0.489 12.793 -8.950 1.00 0.00 C
+ATOM 190 NZ LYS A 12 -1.646 13.096 -8.065 1.00 0.00 N
+ATOM 191 H LYS A 12 4.771 12.714 -9.021 1.00 0.00 H
+ATOM 192 HA LYS A 12 3.817 14.108 -11.432 1.00 0.00 H
+ATOM 193 1HB LYS A 12 3.228 14.515 -8.482 1.00 0.00 H
+ATOM 194 2HB LYS A 12 2.522 15.478 -9.773 1.00 0.00 H
+ATOM 195 1HG LYS A 12 1.480 13.453 -10.722 1.00 0.00 H
+ATOM 196 2HG LYS A 12 2.191 12.484 -9.423 1.00 0.00 H
+ATOM 197 1HD LYS A 12 0.957 13.815 -7.746 1.00 0.00 H
+ATOM 198 2HD LYS A 12 0.254 14.797 -9.040 1.00 0.00 H
+ATOM 199 1HE LYS A 12 -0.830 12.790 -9.985 1.00 0.00 H
+ATOM 200 2HE LYS A 12 -0.117 11.797 -8.711 1.00 0.00 H
+ATOM 201 1HZ LYS A 12 -2.367 12.402 -8.202 1.00 0.00 H
+ATOM 202 2HZ LYS A 12 -1.346 13.083 -7.100 1.00 0.00 H
+ATOM 203 3HZ LYS A 12 -2.013 14.010 -8.290 1.00 0.00 H
+ATOM 204 N LYS A 13 6.322 15.171 -9.846 1.00 0.00 N
+ATOM 205 CA LYS A 13 7.330 16.219 -9.733 1.00 0.00 C
+ATOM 206 C LYS A 13 6.783 17.431 -8.990 1.00 0.00 C
+ATOM 207 O LYS A 13 6.757 18.539 -9.526 1.00 0.00 O
+ATOM 208 CB LYS A 13 7.830 16.632 -11.118 1.00 0.00 C
+ATOM 209 CG LYS A 13 8.432 15.495 -11.934 1.00 0.00 C
+ATOM 210 CD LYS A 13 9.008 16.003 -13.247 1.00 0.00 C
+ATOM 211 CE LYS A 13 9.511 14.856 -14.112 1.00 0.00 C
+ATOM 212 NZ LYS A 13 10.077 15.338 -15.401 1.00 0.00 N
+ATOM 213 H LYS A 13 6.547 14.236 -9.537 1.00 0.00 H
+ATOM 214 HA LYS A 13 8.179 15.823 -9.174 1.00 0.00 H
+ATOM 215 1HB LYS A 13 7.005 17.055 -11.692 1.00 0.00 H
+ATOM 216 2HB LYS A 13 8.589 17.408 -11.015 1.00 0.00 H
+ATOM 217 1HG LYS A 13 9.226 15.016 -11.360 1.00 0.00 H
+ATOM 218 2HG LYS A 13 7.663 14.753 -12.147 1.00 0.00 H
+ATOM 219 1HD LYS A 13 8.239 16.550 -13.795 1.00 0.00 H
+ATOM 220 2HD LYS A 13 9.836 16.681 -13.043 1.00 0.00 H
+ATOM 221 1HE LYS A 13 10.281 14.306 -13.574 1.00 0.00 H
+ATOM 222 2HE LYS A 13 8.688 14.173 -14.325 1.00 0.00 H
+ATOM 223 1HZ LYS A 13 10.398 14.549 -15.944 1.00 0.00 H
+ATOM 224 2HZ LYS A 13 9.365 15.835 -15.918 1.00 0.00 H
+ATOM 225 3HZ LYS A 13 10.853 15.958 -15.218 1.00 0.00 H
+ATOM 226 N PRO A 14 6.348 17.215 -7.754 1.00 0.00 N
+ATOM 227 CA PRO A 14 5.832 18.296 -6.923 1.00 0.00 C
+ATOM 228 C PRO A 14 6.929 19.293 -6.572 1.00 0.00 C
+ATOM 229 O PRO A 14 6.652 20.447 -6.245 1.00 0.00 O
+ATOM 230 CB PRO A 14 5.318 17.561 -5.681 1.00 0.00 C
+ATOM 231 CG PRO A 14 6.127 16.310 -5.636 1.00 0.00 C
+ATOM 232 CD PRO A 14 6.287 15.916 -7.080 1.00 0.00 C
+ATOM 233 HA PRO A 14 5.009 18.798 -7.453 1.00 0.00 H
+ATOM 234 1HB PRO A 14 5.454 18.190 -4.789 1.00 0.00 H
+ATOM 235 2HB PRO A 14 4.239 17.369 -5.777 1.00 0.00 H
+ATOM 236 1HG PRO A 14 7.090 16.498 -5.138 1.00 0.00 H
+ATOM 237 2HG PRO A 14 5.607 15.543 -5.043 1.00 0.00 H
+ATOM 238 1HD PRO A 14 7.219 15.344 -7.203 1.00 0.00 H
+ATOM 239 2HD PRO A 14 5.420 15.317 -7.396 1.00 0.00 H
+ATOM 240 N ASP A 15 8.177 18.841 -6.641 1.00 0.00 N
+ATOM 241 CA ASP A 15 9.322 19.714 -6.415 1.00 0.00 C
+ATOM 242 C ASP A 15 10.589 19.131 -7.028 1.00 0.00 C
+ATOM 243 O ASP A 15 10.571 18.037 -7.591 1.00 0.00 O
+ATOM 244 CB ASP A 15 9.533 19.945 -4.916 1.00 0.00 C
+ATOM 245 CG ASP A 15 10.184 21.287 -4.609 1.00 0.00 C
+ATOM 246 OD1 ASP A 15 10.818 21.831 -5.482 1.00 0.00 O
+ATOM 247 OD2 ASP A 15 10.041 21.755 -3.505 1.00 0.00 O
+ATOM 248 H ASP A 15 8.336 17.867 -6.856 1.00 0.00 H
+ATOM 249 HA ASP A 15 9.124 20.675 -6.891 1.00 0.00 H
+ATOM 250 1HB ASP A 15 8.573 19.897 -4.402 1.00 0.00 H
+ATOM 251 2HB ASP A 15 10.161 19.151 -4.511 1.00 0.00 H
+ATOM 252 N HIS A 16 11.688 19.869 -6.915 1.00 0.00 N
+ATOM 253 CA HIS A 16 12.958 19.445 -7.492 1.00 0.00 C
+ATOM 254 C HIS A 16 13.558 18.283 -6.711 1.00 0.00 C
+ATOM 255 O HIS A 16 14.525 17.661 -7.149 1.00 0.00 O
+ATOM 256 CB HIS A 16 13.952 20.610 -7.529 1.00 0.00 C
+ATOM 257 CG HIS A 16 14.389 21.071 -6.173 1.00 0.00 C
+ATOM 258 ND1 HIS A 16 13.580 21.822 -5.346 1.00 0.00 N
+ATOM 259 CD2 HIS A 16 15.549 20.889 -5.500 1.00 0.00 C
+ATOM 260 CE1 HIS A 16 14.225 22.081 -4.222 1.00 0.00 C
+ATOM 261 NE2 HIS A 16 15.421 21.526 -4.291 1.00 0.00 N
+ATOM 262 H HIS A 16 11.643 20.747 -6.417 1.00 0.00 H
+ATOM 263 HA HIS A 16 12.779 19.110 -8.514 1.00 0.00 H
+ATOM 264 1HB HIS A 16 14.839 20.315 -8.091 1.00 0.00 H
+ATOM 265 2HB HIS A 16 13.502 21.456 -8.048 1.00 0.00 H
+ATOM 266 HD1 HIS A 16 12.625 22.068 -5.517 1.00 0.00 H
+ATOM 267 HD2 HIS A 16 16.474 20.367 -5.747 1.00 0.00 H
+ATOM 268 HE1 HIS A 16 13.752 22.665 -3.433 1.00 0.00 H
+ATOM 269 N LYS A 17 12.977 17.995 -5.551 1.00 0.00 N
+ATOM 270 CA LYS A 17 13.506 16.965 -4.665 1.00 0.00 C
+ATOM 271 C LYS A 17 12.874 15.610 -4.956 1.00 0.00 C
+ATOM 272 O LYS A 17 13.176 14.617 -4.294 1.00 0.00 O
+ATOM 273 CB LYS A 17 13.277 17.348 -3.202 1.00 0.00 C
+ATOM 274 CG LYS A 17 14.045 18.581 -2.747 1.00 0.00 C
+ATOM 275 CD LYS A 17 13.825 18.855 -1.267 1.00 0.00 C
+ATOM 276 CE LYS A 17 14.601 20.081 -0.808 1.00 0.00 C
+ATOM 277 NZ LYS A 17 14.382 20.370 0.635 1.00 0.00 N
+ATOM 278 H LYS A 17 12.148 18.502 -5.276 1.00 0.00 H
+ATOM 279 HA LYS A 17 14.579 16.876 -4.838 1.00 0.00 H
+ATOM 280 1HB LYS A 17 12.216 17.535 -3.036 1.00 0.00 H
+ATOM 281 2HB LYS A 17 13.567 16.517 -2.558 1.00 0.00 H
+ATOM 282 1HG LYS A 17 15.111 18.433 -2.925 1.00 0.00 H
+ATOM 283 2HG LYS A 17 13.716 19.447 -3.321 1.00 0.00 H
+ATOM 284 1HD LYS A 17 12.762 19.018 -1.081 1.00 0.00 H
+ATOM 285 2HD LYS A 17 14.149 17.993 -0.685 1.00 0.00 H
+ATOM 286 1HE LYS A 17 15.665 19.922 -0.977 1.00 0.00 H
+ATOM 287 2HE LYS A 17 14.289 20.948 -1.390 1.00 0.00 H
+ATOM 288 1HZ LYS A 17 14.913 21.188 0.899 1.00 0.00 H
+ATOM 289 2HZ LYS A 17 13.400 20.538 0.801 1.00 0.00 H
+ATOM 290 3HZ LYS A 17 14.686 19.581 1.187 1.00 0.00 H
+ATOM 291 N PHE A 18 11.994 15.575 -5.952 1.00 0.00 N
+ATOM 292 CA PHE A 18 11.267 14.357 -6.289 1.00 0.00 C
+ATOM 293 C PHE A 18 12.223 13.229 -6.655 1.00 0.00 C
+ATOM 294 O PHE A 18 11.901 12.052 -6.490 1.00 0.00 O
+ATOM 295 CB PHE A 18 10.305 14.614 -7.451 1.00 0.00 C
+ATOM 296 CG PHE A 18 10.936 14.461 -8.806 1.00 0.00 C
+ATOM 297 CD1 PHE A 18 10.958 13.229 -9.442 1.00 0.00 C
+ATOM 298 CD2 PHE A 18 11.510 15.549 -9.446 1.00 0.00 C
+ATOM 299 CE1 PHE A 18 11.538 13.088 -10.688 1.00 0.00 C
+ATOM 300 CE2 PHE A 18 12.090 15.411 -10.692 1.00 0.00 C
+ATOM 301 CZ PHE A 18 12.104 14.179 -11.314 1.00 0.00 C
+ATOM 302 H PHE A 18 11.825 16.414 -6.488 1.00 0.00 H
+ATOM 303 HA PHE A 18 10.681 14.052 -5.422 1.00 0.00 H
+ATOM 304 1HB PHE A 18 9.466 13.922 -7.387 1.00 0.00 H
+ATOM 305 2HB PHE A 18 9.904 15.623 -7.374 1.00 0.00 H
+ATOM 306 HD1 PHE A 18 10.509 12.367 -8.948 1.00 0.00 H
+ATOM 307 HD2 PHE A 18 11.500 16.523 -8.955 1.00 0.00 H
+ATOM 308 HE1 PHE A 18 11.548 12.114 -11.177 1.00 0.00 H
+ATOM 309 HE2 PHE A 18 12.538 16.274 -11.185 1.00 0.00 H
+ATOM 310 HZ PHE A 18 12.563 14.068 -12.295 1.00 0.00 H
+ATOM 311 N ARG A 19 13.400 13.594 -7.152 1.00 0.00 N
+ATOM 312 CA ARG A 19 14.409 12.614 -7.532 1.00 0.00 C
+ATOM 313 C ARG A 19 15.007 11.935 -6.307 1.00 0.00 C
+ATOM 314 O ARG A 19 15.411 10.774 -6.363 1.00 0.00 O
+ATOM 315 CB ARG A 19 15.520 13.273 -8.336 1.00 0.00 C
+ATOM 316 CG ARG A 19 15.106 13.768 -9.713 1.00 0.00 C
+ATOM 317 CD ARG A 19 16.274 14.242 -10.500 1.00 0.00 C
+ATOM 318 NE ARG A 19 15.871 14.824 -11.770 1.00 0.00 N
+ATOM 319 CZ ARG A 19 15.516 14.114 -12.859 1.00 0.00 C
+ATOM 320 NH1 ARG A 19 15.519 12.800 -12.816 1.00 0.00 N
+ATOM 321 NH2 ARG A 19 15.165 14.739 -13.969 1.00 0.00 N
+ATOM 322 H ARG A 19 13.600 14.577 -7.270 1.00 0.00 H
+ATOM 323 HA ARG A 19 13.936 11.854 -8.156 1.00 0.00 H
+ATOM 324 1HB ARG A 19 15.912 14.125 -7.783 1.00 0.00 H
+ATOM 325 2HB ARG A 19 16.339 12.566 -8.472 1.00 0.00 H
+ATOM 326 1HG ARG A 19 14.628 12.958 -10.263 1.00 0.00 H
+ATOM 327 2HG ARG A 19 14.406 14.597 -9.606 1.00 0.00 H
+ATOM 328 1HD ARG A 19 16.811 15.001 -9.932 1.00 0.00 H
+ATOM 329 2HD ARG A 19 16.938 13.403 -10.705 1.00 0.00 H
+ATOM 330 HE ARG A 19 15.856 15.833 -11.841 1.00 0.00 H
+ATOM 331 1HH1 ARG A 19 15.787 12.323 -11.967 1.00 0.00 H
+ATOM 332 2HH1 ARG A 19 15.253 12.268 -13.632 1.00 0.00 H
+ATOM 333 1HH2 ARG A 19 15.163 15.749 -14.002 1.00 0.00 H
+ATOM 334 2HH2 ARG A 19 14.899 14.207 -14.785 1.00 0.00 H
+ATOM 335 N GLU A 20 15.061 12.667 -5.199 1.00 0.00 N
+ATOM 336 CA GLU A 20 15.603 12.134 -3.955 1.00 0.00 C
+ATOM 337 C GLU A 20 14.687 11.067 -3.368 1.00 0.00 C
+ATOM 338 O GLU A 20 15.150 10.118 -2.736 1.00 0.00 O
+ATOM 339 CB GLU A 20 15.809 13.259 -2.938 1.00 0.00 C
+ATOM 340 CG GLU A 20 16.873 14.274 -3.330 1.00 0.00 C
+ATOM 341 CD GLU A 20 18.233 13.658 -3.503 1.00 0.00 C
+ATOM 342 OE1 GLU A 20 18.590 12.820 -2.711 1.00 0.00 O
+ATOM 343 OE2 GLU A 20 18.917 14.026 -4.429 1.00 0.00 O
+ATOM 344 H GLU A 20 14.718 13.617 -5.220 1.00 0.00 H
+ATOM 345 HA GLU A 20 16.574 11.685 -4.164 1.00 0.00 H
+ATOM 346 1HB GLU A 20 14.871 13.796 -2.794 1.00 0.00 H
+ATOM 347 2HB GLU A 20 16.092 12.832 -1.975 1.00 0.00 H
+ATOM 348 1HG GLU A 20 16.580 14.749 -4.266 1.00 0.00 H
+ATOM 349 2HG GLU A 20 16.924 15.046 -2.563 1.00 0.00 H
+ATOM 350 N ILE A 21 13.386 11.229 -3.580 1.00 0.00 N
+ATOM 351 CA ILE A 21 12.410 10.235 -3.151 1.00 0.00 C
+ATOM 352 C ILE A 21 12.605 8.917 -3.890 1.00 0.00 C
+ATOM 353 O ILE A 21 12.614 7.848 -3.281 1.00 0.00 O
+ATOM 354 CB ILE A 21 10.974 10.742 -3.376 1.00 0.00 C
+ATOM 355 CG1 ILE A 21 10.673 11.921 -2.447 1.00 0.00 C
+ATOM 356 CG2 ILE A 21 9.972 9.619 -3.156 1.00 0.00 C
+ATOM 357 CD1 ILE A 21 9.408 12.670 -2.800 1.00 0.00 C
+ATOM 358 H ILE A 21 13.064 12.063 -4.051 1.00 0.00 H
+ATOM 359 HA ILE A 21 12.541 10.059 -2.083 1.00 0.00 H
+ATOM 360 HB ILE A 21 10.874 11.112 -4.396 1.00 0.00 H
+ATOM 361 1HG1 ILE A 21 10.582 11.563 -1.422 1.00 0.00 H
+ATOM 362 2HG1 ILE A 21 11.504 12.627 -2.473 1.00 0.00 H
+ATOM 363 1HG2 ILE A 21 8.962 9.995 -3.318 1.00 0.00 H
+ATOM 364 2HG2 ILE A 21 10.175 8.810 -3.857 1.00 0.00 H
+ATOM 365 3HG2 ILE A 21 10.061 9.246 -2.136 1.00 0.00 H
+ATOM 366 1HD1 ILE A 21 9.263 13.491 -2.098 1.00 0.00 H
+ATOM 367 2HD1 ILE A 21 9.492 13.069 -3.812 1.00 0.00 H
+ATOM 368 3HD1 ILE A 21 8.557 11.993 -2.746 1.00 0.00 H
+ATOM 369 N PHE A 22 12.760 9.001 -5.207 1.00 0.00 N
+ATOM 370 CA PHE A 22 13.013 7.821 -6.025 1.00 0.00 C
+ATOM 371 C PHE A 22 14.335 7.163 -5.650 1.00 0.00 C
+ATOM 372 O PHE A 22 14.425 5.939 -5.555 1.00 0.00 O
+ATOM 373 CB PHE A 22 13.025 8.192 -7.509 1.00 0.00 C
+ATOM 374 CG PHE A 22 11.655 8.307 -8.116 1.00 0.00 C
+ATOM 375 CD1 PHE A 22 11.058 9.547 -8.285 1.00 0.00 C
+ATOM 376 CD2 PHE A 22 10.961 7.176 -8.519 1.00 0.00 C
+ATOM 377 CE1 PHE A 22 9.798 9.655 -8.843 1.00 0.00 C
+ATOM 378 CE2 PHE A 22 9.703 7.280 -9.078 1.00 0.00 C
+ATOM 379 CZ PHE A 22 9.121 8.521 -9.240 1.00 0.00 C
+ATOM 380 H PHE A 22 12.701 9.905 -5.653 1.00 0.00 H
+ATOM 381 HA PHE A 22 12.207 7.105 -5.859 1.00 0.00 H
+ATOM 382 1HB PHE A 22 13.537 9.144 -7.642 1.00 0.00 H
+ATOM 383 2HB PHE A 22 13.582 7.440 -8.068 1.00 0.00 H
+ATOM 384 HD1 PHE A 22 11.595 10.444 -7.972 1.00 0.00 H
+ATOM 385 HD2 PHE A 22 11.421 6.195 -8.391 1.00 0.00 H
+ATOM 386 HE1 PHE A 22 9.341 10.635 -8.970 1.00 0.00 H
+ATOM 387 HE2 PHE A 22 9.168 6.383 -9.391 1.00 0.00 H
+ATOM 388 HZ PHE A 22 8.127 8.605 -9.679 1.00 0.00 H
+ATOM 389 N ARG A 23 15.358 7.983 -5.439 1.00 0.00 N
+ATOM 390 CA ARG A 23 16.693 7.480 -5.135 1.00 0.00 C
+ATOM 391 C ARG A 23 16.695 6.672 -3.844 1.00 0.00 C
+ATOM 392 O ARG A 23 17.266 5.583 -3.783 1.00 0.00 O
+ATOM 393 CB ARG A 23 17.683 8.629 -5.012 1.00 0.00 C
+ATOM 394 CG ARG A 23 19.125 8.209 -4.780 1.00 0.00 C
+ATOM 395 CD ARG A 23 20.049 9.372 -4.813 1.00 0.00 C
+ATOM 396 NE ARG A 23 19.884 10.228 -3.649 1.00 0.00 N
+ATOM 397 CZ ARG A 23 20.419 9.984 -2.437 1.00 0.00 C
+ATOM 398 NH1 ARG A 23 21.150 8.908 -2.246 1.00 0.00 N
+ATOM 399 NH2 ARG A 23 20.210 10.827 -1.441 1.00 0.00 N
+ATOM 400 H ARG A 23 15.209 8.981 -5.491 1.00 0.00 H
+ATOM 401 HA ARG A 23 17.014 6.834 -5.952 1.00 0.00 H
+ATOM 402 1HB ARG A 23 17.657 9.230 -5.920 1.00 0.00 H
+ATOM 403 2HB ARG A 23 17.390 9.275 -4.184 1.00 0.00 H
+ATOM 404 1HG ARG A 23 19.212 7.730 -3.804 1.00 0.00 H
+ATOM 405 2HG ARG A 23 19.429 7.507 -5.557 1.00 0.00 H
+ATOM 406 1HD ARG A 23 21.079 9.018 -4.832 1.00 0.00 H
+ATOM 407 2HD ARG A 23 19.853 9.966 -5.704 1.00 0.00 H
+ATOM 408 HE ARG A 23 19.328 11.066 -3.758 1.00 0.00 H
+ATOM 409 1HH1 ARG A 23 21.309 8.264 -3.008 1.00 0.00 H
+ATOM 410 2HH1 ARG A 23 21.551 8.725 -1.338 1.00 0.00 H
+ATOM 411 1HH2 ARG A 23 19.649 11.654 -1.588 1.00 0.00 H
+ATOM 412 2HH2 ARG A 23 20.611 10.644 -0.533 1.00 0.00 H
+ATOM 413 N GLU A 24 16.054 7.211 -2.812 1.00 0.00 N
+ATOM 414 CA GLU A 24 16.010 6.557 -1.510 1.00 0.00 C
+ATOM 415 C GLU A 24 15.343 5.190 -1.603 1.00 0.00 C
+ATOM 416 O GLU A 24 15.854 4.203 -1.075 1.00 0.00 O
+ATOM 417 CB GLU A 24 15.266 7.431 -0.499 1.00 0.00 C
+ATOM 418 CG GLU A 24 15.143 6.820 0.890 1.00 0.00 C
+ATOM 419 CD GLU A 24 14.445 7.724 1.867 1.00 0.00 C
+ATOM 420 OE1 GLU A 24 14.220 8.864 1.537 1.00 0.00 O
+ATOM 421 OE2 GLU A 24 14.135 7.274 2.945 1.00 0.00 O
+ATOM 422 H GLU A 24 15.585 8.097 -2.934 1.00 0.00 H
+ATOM 423 HA GLU A 24 17.033 6.423 -1.155 1.00 0.00 H
+ATOM 424 1HB GLU A 24 15.778 8.388 -0.399 1.00 0.00 H
+ATOM 425 2HB GLU A 24 14.260 7.635 -0.865 1.00 0.00 H
+ATOM 426 1HG GLU A 24 14.588 5.885 0.817 1.00 0.00 H
+ATOM 427 2HG GLU A 24 16.140 6.590 1.264 1.00 0.00 H
+ATOM 428 N LEU A 25 14.199 5.140 -2.276 1.00 0.00 N
+ATOM 429 CA LEU A 25 13.428 3.908 -2.386 1.00 0.00 C
+ATOM 430 C LEU A 25 14.178 2.860 -3.199 1.00 0.00 C
+ATOM 431 O LEU A 25 14.029 1.660 -2.970 1.00 0.00 O
+ATOM 432 CB LEU A 25 12.067 4.190 -3.035 1.00 0.00 C
+ATOM 433 CG LEU A 25 11.078 4.995 -2.183 1.00 0.00 C
+ATOM 434 CD1 LEU A 25 9.895 5.419 -3.042 1.00 0.00 C
+ATOM 435 CD2 LEU A 25 10.622 4.151 -1.002 1.00 0.00 C
+ATOM 436 H LEU A 25 13.855 5.978 -2.724 1.00 0.00 H
+ATOM 437 HA LEU A 25 13.257 3.516 -1.383 1.00 0.00 H
+ATOM 438 1HB LEU A 25 12.231 4.741 -3.960 1.00 0.00 H
+ATOM 439 2HB LEU A 25 11.595 3.239 -3.281 1.00 0.00 H
+ATOM 440 HG LEU A 25 11.565 5.899 -1.816 1.00 0.00 H
+ATOM 441 1HD1 LEU A 25 9.192 5.991 -2.436 1.00 0.00 H
+ATOM 442 2HD1 LEU A 25 10.247 6.037 -3.868 1.00 0.00 H
+ATOM 443 3HD1 LEU A 25 9.396 4.535 -3.437 1.00 0.00 H
+ATOM 444 1HD2 LEU A 25 9.919 4.724 -0.395 1.00 0.00 H
+ATOM 445 2HD2 LEU A 25 10.133 3.248 -1.367 1.00 0.00 H
+ATOM 446 3HD2 LEU A 25 11.485 3.877 -0.395 1.00 0.00 H
+ATOM 447 N ILE A 26 14.983 3.321 -4.150 1.00 0.00 N
+ATOM 448 CA ILE A 26 15.828 2.430 -4.937 1.00 0.00 C
+ATOM 449 C ILE A 26 16.986 1.893 -4.106 1.00 0.00 C
+ATOM 450 O ILE A 26 17.216 0.685 -4.053 1.00 0.00 O
+ATOM 451 CB ILE A 26 16.378 3.152 -6.181 1.00 0.00 C
+ATOM 452 CG1 ILE A 26 15.245 3.469 -7.160 1.00 0.00 C
+ATOM 453 CG2 ILE A 26 17.449 2.308 -6.855 1.00 0.00 C
+ATOM 454 CD1 ILE A 26 15.627 4.460 -8.235 1.00 0.00 C
+ATOM 455 H ILE A 26 15.011 4.314 -4.333 1.00 0.00 H
+ATOM 456 HA ILE A 26 15.222 1.590 -5.277 1.00 0.00 H
+ATOM 457 HB ILE A 26 16.814 4.105 -5.884 1.00 0.00 H
+ATOM 458 1HG1 ILE A 26 14.915 2.550 -7.644 1.00 0.00 H
+ATOM 459 2HG1 ILE A 26 14.393 3.873 -6.612 1.00 0.00 H
+ATOM 460 1HG2 ILE A 26 17.827 2.832 -7.732 1.00 0.00 H
+ATOM 461 2HG2 ILE A 26 18.266 2.132 -6.157 1.00 0.00 H
+ATOM 462 3HG2 ILE A 26 17.020 1.353 -7.160 1.00 0.00 H
+ATOM 463 1HD1 ILE A 26 14.772 4.634 -8.890 1.00 0.00 H
+ATOM 464 2HD1 ILE A 26 15.927 5.401 -7.773 1.00 0.00 H
+ATOM 465 3HD1 ILE A 26 16.455 4.062 -8.820 1.00 0.00 H
+ATOM 466 N GLU A 27 17.712 2.797 -3.459 1.00 0.00 N
+ATOM 467 CA GLU A 27 18.927 2.432 -2.739 1.00 0.00 C
+ATOM 468 C GLU A 27 18.611 1.541 -1.544 1.00 0.00 C
+ATOM 469 O GLU A 27 19.387 0.649 -1.201 1.00 0.00 O
+ATOM 470 CB GLU A 27 19.667 3.687 -2.270 1.00 0.00 C
+ATOM 471 CG GLU A 27 20.332 4.478 -3.388 1.00 0.00 C
+ATOM 472 CD GLU A 27 21.136 5.643 -2.881 1.00 0.00 C
+ATOM 473 OE1 GLU A 27 21.281 5.766 -1.688 1.00 0.00 O
+ATOM 474 OE2 GLU A 27 21.605 6.411 -3.687 1.00 0.00 O
+ATOM 475 H GLU A 27 17.416 3.763 -3.465 1.00 0.00 H
+ATOM 476 HA GLU A 27 19.581 1.886 -3.419 1.00 0.00 H
+ATOM 477 1HB GLU A 27 18.970 4.351 -1.759 1.00 0.00 H
+ATOM 478 2HB GLU A 27 20.439 3.407 -1.554 1.00 0.00 H
+ATOM 479 1HG GLU A 27 20.989 3.814 -3.948 1.00 0.00 H
+ATOM 480 2HG GLU A 27 19.563 4.842 -4.068 1.00 0.00 H
+ATOM 481 N ARG A 28 17.468 1.788 -0.914 1.00 0.00 N
+ATOM 482 CA ARG A 28 17.075 1.045 0.278 1.00 0.00 C
+ATOM 483 C ARG A 28 16.332 -0.232 -0.089 1.00 0.00 C
+ATOM 484 O ARG A 28 15.856 -0.958 0.784 1.00 0.00 O
+ATOM 485 CB ARG A 28 16.193 1.902 1.175 1.00 0.00 C
+ATOM 486 CG ARG A 28 16.896 3.084 1.822 1.00 0.00 C
+ATOM 487 CD ARG A 28 15.976 3.861 2.692 1.00 0.00 C
+ATOM 488 NE ARG A 28 15.559 3.099 3.858 1.00 0.00 N
+ATOM 489 CZ ARG A 28 14.644 3.514 4.756 1.00 0.00 C
+ATOM 490 NH1 ARG A 28 14.061 4.682 4.608 1.00 0.00 N
+ATOM 491 NH2 ARG A 28 14.333 2.745 5.785 1.00 0.00 N
+ATOM 492 H ARG A 28 16.856 2.508 -1.269 1.00 0.00 H
+ATOM 493 HA ARG A 28 17.976 0.776 0.831 1.00 0.00 H
+ATOM 494 1HB ARG A 28 15.357 2.291 0.597 1.00 0.00 H
+ATOM 495 2HB ARG A 28 15.780 1.286 1.974 1.00 0.00 H
+ATOM 496 1HG ARG A 28 17.725 2.726 2.433 1.00 0.00 H
+ATOM 497 2HG ARG A 28 17.279 3.749 1.047 1.00 0.00 H
+ATOM 498 1HD ARG A 28 16.478 4.765 3.037 1.00 0.00 H
+ATOM 499 2HD ARG A 28 15.086 4.135 2.127 1.00 0.00 H
+ATOM 500 HE ARG A 28 15.986 2.194 4.006 1.00 0.00 H
+ATOM 501 1HH1 ARG A 28 14.299 5.270 3.821 1.00 0.00 H
+ATOM 502 2HH1 ARG A 28 13.375 4.993 5.281 1.00 0.00 H
+ATOM 503 1HH2 ARG A 28 14.782 1.847 5.899 1.00 0.00 H
+ATOM 504 2HH2 ARG A 28 13.648 3.056 6.457 1.00 0.00 H
+ATOM 505 N ASN A 29 16.235 -0.503 -1.386 1.00 0.00 N
+ATOM 506 CA ASN A 29 15.569 -1.706 -1.871 1.00 0.00 C
+ATOM 507 C ASN A 29 14.153 -1.811 -1.319 1.00 0.00 C
+ATOM 508 O ASN A 29 13.719 -2.884 -0.897 1.00 0.00 O
+ATOM 509 CB ASN A 29 16.374 -2.942 -1.515 1.00 0.00 C
+ATOM 510 CG ASN A 29 17.721 -2.965 -2.183 1.00 0.00 C
+ATOM 511 OD1 ASN A 29 17.846 -2.640 -3.369 1.00 0.00 O
+ATOM 512 ND2 ASN A 29 18.733 -3.344 -1.444 1.00 0.00 N
+ATOM 513 H ASN A 29 16.633 0.142 -2.054 1.00 0.00 H
+ATOM 514 HA ASN A 29 15.488 -1.643 -2.957 1.00 0.00 H
+ATOM 515 1HB ASN A 29 16.516 -2.986 -0.435 1.00 0.00 H
+ATOM 516 2HB ASN A 29 15.821 -3.834 -1.809 1.00 0.00 H
+ATOM 517 1HD2 ASN A 29 19.653 -3.379 -1.835 1.00 0.00 H
+ATOM 518 2HD2 ASN A 29 18.586 -3.599 -0.488 1.00 0.00 H
+ATOM 519 N LEU A 30 13.436 -0.693 -1.323 1.00 0.00 N
+ATOM 520 CA LEU A 30 12.049 -0.670 -0.876 1.00 0.00 C
+ATOM 521 C LEU A 30 11.088 -0.721 -2.057 1.00 0.00 C
+ATOM 522 O LEU A 30 10.015 -1.317 -1.971 1.00 0.00 O
+ATOM 523 CB LEU A 30 11.781 0.592 -0.045 1.00 0.00 C
+ATOM 524 CG LEU A 30 12.618 0.737 1.232 1.00 0.00 C
+ATOM 525 CD1 LEU A 30 12.364 2.104 1.853 1.00 0.00 C
+ATOM 526 CD2 LEU A 30 12.261 -0.379 2.203 1.00 0.00 C
+ATOM 527 H LEU A 30 13.864 0.164 -1.645 1.00 0.00 H
+ATOM 528 HA LEU A 30 11.872 -1.545 -0.252 1.00 0.00 H
+ATOM 529 1HB LEU A 30 11.972 1.464 -0.667 1.00 0.00 H
+ATOM 530 2HB LEU A 30 10.730 0.601 0.244 1.00 0.00 H
+ATOM 531 HG LEU A 30 13.677 0.675 0.983 1.00 0.00 H
+ATOM 532 1HD1 LEU A 30 12.959 2.207 2.761 1.00 0.00 H
+ATOM 533 2HD1 LEU A 30 12.646 2.883 1.145 1.00 0.00 H
+ATOM 534 3HD1 LEU A 30 11.307 2.201 2.099 1.00 0.00 H
+ATOM 535 1HD2 LEU A 30 12.856 -0.276 3.111 1.00 0.00 H
+ATOM 536 2HD2 LEU A 30 11.202 -0.318 2.455 1.00 0.00 H
+ATOM 537 3HD2 LEU A 30 12.468 -1.344 1.740 1.00 0.00 H
+ATOM 538 N ALA A 31 11.481 -0.092 -3.160 1.00 0.00 N
+ATOM 539 CA ALA A 31 10.686 -0.120 -4.382 1.00 0.00 C
+ATOM 540 C ALA A 31 11.294 -1.062 -5.413 1.00 0.00 C
+ATOM 541 O ALA A 31 10.602 -1.549 -6.307 1.00 0.00 O
+ATOM 542 CB ALA A 31 10.552 1.282 -4.959 1.00 0.00 C
+ATOM 543 H ALA A 31 12.352 0.419 -3.151 1.00 0.00 H
+ATOM 544 HA ALA A 31 9.684 -0.472 -4.135 1.00 0.00 H
+ATOM 545 1HB ALA A 31 9.956 1.244 -5.871 1.00 0.00 H
+ATOM 546 2HB ALA A 31 10.063 1.930 -4.232 1.00 0.00 H
+ATOM 547 3HB ALA A 31 11.541 1.676 -5.189 1.00 0.00 H
+ATOM 548 N ASN A 32 12.592 -1.314 -5.283 1.00 0.00 N
+ATOM 549 CA ASN A 32 13.308 -2.154 -6.236 1.00 0.00 C
+ATOM 550 C ASN A 32 13.050 -1.706 -7.669 1.00 0.00 C
+ATOM 551 O ASN A 32 13.291 -0.551 -8.021 1.00 0.00 O
+ATOM 552 CB ASN A 32 12.926 -3.612 -6.055 1.00 0.00 C
+ATOM 553 CG ASN A 32 13.282 -4.138 -4.693 1.00 0.00 C
+ATOM 554 OD1 ASN A 32 14.263 -3.699 -4.081 1.00 0.00 O
+ATOM 555 ND2 ASN A 32 12.505 -5.071 -4.206 1.00 0.00 N
+ATOM 556 H ASN A 32 13.096 -0.914 -4.505 1.00 0.00 H
+ATOM 557 HA ASN A 32 14.379 -2.050 -6.053 1.00 0.00 H
+ATOM 558 1HB ASN A 32 11.852 -3.728 -6.208 1.00 0.00 H
+ATOM 559 2HB ASN A 32 13.431 -4.216 -6.809 1.00 0.00 H
+ATOM 560 1HD2 ASN A 32 12.694 -5.459 -3.303 1.00 0.00 H
+ATOM 561 2HD2 ASN A 32 11.723 -5.397 -4.735 1.00 0.00 H
+ATOM 562 N GLU A 33 12.558 -2.625 -8.491 1.00 0.00 N
+ATOM 563 CA GLU A 33 12.440 -2.387 -9.925 1.00 0.00 C
+ATOM 564 C GLU A 33 11.387 -1.328 -10.223 1.00 0.00 C
+ATOM 565 O GLU A 33 11.405 -0.700 -11.281 1.00 0.00 O
+ATOM 566 CB GLU A 33 12.092 -3.686 -10.655 1.00 0.00 C
+ATOM 567 CG GLU A 33 13.131 -4.788 -10.508 1.00 0.00 C
+ATOM 568 CD GLU A 33 12.931 -5.619 -9.271 1.00 0.00 C
+ATOM 569 OE1 GLU A 33 12.027 -5.330 -8.524 1.00 0.00 O
+ATOM 570 OE2 GLU A 33 13.683 -6.544 -9.073 1.00 0.00 O
+ATOM 571 H GLU A 33 12.257 -3.513 -8.114 1.00 0.00 H
+ATOM 572 HA GLU A 33 13.403 -2.036 -10.298 1.00 0.00 H
+ATOM 573 1HB GLU A 33 11.142 -4.069 -10.282 1.00 0.00 H
+ATOM 574 2HB GLU A 33 11.968 -3.483 -11.719 1.00 0.00 H
+ATOM 575 1HG GLU A 33 13.081 -5.439 -11.380 1.00 0.00 H
+ATOM 576 2HG GLU A 33 14.122 -4.337 -10.481 1.00 0.00 H
+ATOM 577 N LEU A 34 10.468 -1.133 -9.282 1.00 0.00 N
+ATOM 578 CA LEU A 34 9.326 -0.253 -9.497 1.00 0.00 C
+ATOM 579 C LEU A 34 9.766 1.200 -9.623 1.00 0.00 C
+ATOM 580 O LEU A 34 9.408 1.886 -10.580 1.00 0.00 O
+ATOM 581 CB LEU A 34 8.325 -0.392 -8.343 1.00 0.00 C
+ATOM 582 CG LEU A 34 7.081 0.501 -8.430 1.00 0.00 C
+ATOM 583 CD1 LEU A 34 6.281 0.139 -9.674 1.00 0.00 C
+ATOM 584 CD2 LEU A 34 6.244 0.330 -7.171 1.00 0.00 C
+ATOM 585 H LEU A 34 10.564 -1.607 -8.395 1.00 0.00 H
+ATOM 586 HA LEU A 34 8.830 -0.549 -10.422 1.00 0.00 H
+ATOM 587 1HB LEU A 34 7.987 -1.427 -8.300 1.00 0.00 H
+ATOM 588 2HB LEU A 34 8.836 -0.159 -7.409 1.00 0.00 H
+ATOM 589 HG LEU A 34 7.388 1.544 -8.523 1.00 0.00 H
+ATOM 590 1HD1 LEU A 34 5.397 0.774 -9.735 1.00 0.00 H
+ATOM 591 2HD1 LEU A 34 6.897 0.289 -10.560 1.00 0.00 H
+ATOM 592 3HD1 LEU A 34 5.974 -0.905 -9.617 1.00 0.00 H
+ATOM 593 1HD2 LEU A 34 5.360 0.966 -7.233 1.00 0.00 H
+ATOM 594 2HD2 LEU A 34 5.936 -0.712 -7.079 1.00 0.00 H
+ATOM 595 3HD2 LEU A 34 6.834 0.612 -6.300 1.00 0.00 H
+ATOM 596 N ALA A 35 10.544 1.664 -8.650 1.00 0.00 N
+ATOM 597 CA ALA A 35 11.061 3.027 -8.667 1.00 0.00 C
+ATOM 598 C ALA A 35 12.044 3.229 -9.813 1.00 0.00 C
+ATOM 599 O ALA A 35 12.098 4.301 -10.415 1.00 0.00 O
+ATOM 600 CB ALA A 35 11.723 3.359 -7.338 1.00 0.00 C
+ATOM 601 H ALA A 35 10.783 1.056 -7.880 1.00 0.00 H
+ATOM 602 HA ALA A 35 10.224 3.713 -8.800 1.00 0.00 H
+ATOM 603 1HB ALA A 35 12.104 4.380 -7.366 1.00 0.00 H
+ATOM 604 2HB ALA A 35 10.992 3.266 -6.534 1.00 0.00 H
+ATOM 605 3HB ALA A 35 12.547 2.669 -7.160 1.00 0.00 H
+ATOM 606 N LYS A 36 12.820 2.192 -10.110 1.00 0.00 N
+ATOM 607 CA LYS A 36 13.803 2.254 -11.185 1.00 0.00 C
+ATOM 608 C LYS A 36 13.134 2.508 -12.530 1.00 0.00 C
+ATOM 609 O LYS A 36 13.562 3.374 -13.293 1.00 0.00 O
+ATOM 610 CB LYS A 36 14.619 0.962 -11.240 1.00 0.00 C
+ATOM 611 CG LYS A 36 15.587 0.779 -10.079 1.00 0.00 C
+ATOM 612 CD LYS A 36 16.349 -0.532 -10.196 1.00 0.00 C
+ATOM 613 CE LYS A 36 17.249 -0.760 -8.990 1.00 0.00 C
+ATOM 614 NZ LYS A 36 17.985 -2.050 -9.080 1.00 0.00 N
+ATOM 615 H LYS A 36 12.726 1.339 -9.578 1.00 0.00 H
+ATOM 616 HA LYS A 36 14.492 3.073 -10.977 1.00 0.00 H
+ATOM 617 1HB LYS A 36 13.944 0.105 -11.250 1.00 0.00 H
+ATOM 618 2HB LYS A 36 15.196 0.934 -12.165 1.00 0.00 H
+ATOM 619 1HG LYS A 36 16.301 1.604 -10.067 1.00 0.00 H
+ATOM 620 2HG LYS A 36 15.035 0.787 -9.140 1.00 0.00 H
+ATOM 621 1HD LYS A 36 15.642 -1.359 -10.272 1.00 0.00 H
+ATOM 622 2HD LYS A 36 16.963 -0.518 -11.097 1.00 0.00 H
+ATOM 623 1HE LYS A 36 17.971 0.052 -8.917 1.00 0.00 H
+ATOM 624 2HE LYS A 36 16.646 -0.763 -8.082 1.00 0.00 H
+ATOM 625 1HZ LYS A 36 18.568 -2.163 -8.263 1.00 0.00 H
+ATOM 626 2HZ LYS A 36 17.323 -2.813 -9.129 1.00 0.00 H
+ATOM 627 3HZ LYS A 36 18.562 -2.052 -9.908 1.00 0.00 H
+ATOM 628 N GLN A 37 12.081 1.749 -12.814 1.00 0.00 N
+ATOM 629 CA GLN A 37 11.384 1.853 -14.091 1.00 0.00 C
+ATOM 630 C GLN A 37 10.690 3.202 -14.231 1.00 0.00 C
+ATOM 631 O GLN A 37 10.726 3.821 -15.294 1.00 0.00 O
+ATOM 632 CB GLN A 37 10.362 0.722 -14.237 1.00 0.00 C
+ATOM 633 CG GLN A 37 9.629 0.714 -15.567 1.00 0.00 C
+ATOM 634 CD GLN A 37 10.565 0.498 -16.742 1.00 0.00 C
+ATOM 635 OE1 GLN A 37 11.543 -0.247 -16.646 1.00 0.00 O
+ATOM 636 NE2 GLN A 37 10.269 1.151 -17.860 1.00 0.00 N
+ATOM 637 H GLN A 37 11.755 1.083 -12.128 1.00 0.00 H
+ATOM 638 HA GLN A 37 12.115 1.750 -14.893 1.00 0.00 H
+ATOM 639 1HB GLN A 37 10.865 -0.239 -14.123 1.00 0.00 H
+ATOM 640 2HB GLN A 37 9.619 0.798 -13.444 1.00 0.00 H
+ATOM 641 1HG GLN A 37 8.896 -0.093 -15.562 1.00 0.00 H
+ATOM 642 2HG GLN A 37 9.128 1.672 -15.701 1.00 0.00 H
+ATOM 643 1HE2 GLN A 37 10.850 1.048 -18.669 1.00 0.00 H
+ATOM 644 2HE2 GLN A 37 9.466 1.746 -17.895 1.00 0.00 H
+ATOM 645 N ILE A 38 10.058 3.652 -13.152 1.00 0.00 N
+ATOM 646 CA ILE A 38 9.308 4.902 -13.170 1.00 0.00 C
+ATOM 647 C ILE A 38 10.233 6.096 -13.369 1.00 0.00 C
+ATOM 648 O ILE A 38 9.946 6.990 -14.166 1.00 0.00 O
+ATOM 649 CB ILE A 38 8.511 5.082 -11.865 1.00 0.00 C
+ATOM 650 CG1 ILE A 38 7.413 4.020 -11.759 1.00 0.00 C
+ATOM 651 CG2 ILE A 38 7.913 6.479 -11.795 1.00 0.00 C
+ATOM 652 CD1 ILE A 38 6.797 3.915 -10.383 1.00 0.00 C
+ATOM 653 H ILE A 38 10.098 3.114 -12.299 1.00 0.00 H
+ATOM 654 HA ILE A 38 8.597 4.868 -13.996 1.00 0.00 H
+ATOM 655 HB ILE A 38 9.173 4.938 -11.011 1.00 0.00 H
+ATOM 656 1HG1 ILE A 38 6.621 4.244 -12.472 1.00 0.00 H
+ATOM 657 2HG1 ILE A 38 7.824 3.045 -12.023 1.00 0.00 H
+ATOM 658 1HG2 ILE A 38 7.353 6.589 -10.868 1.00 0.00 H
+ATOM 659 2HG2 ILE A 38 8.712 7.219 -11.826 1.00 0.00 H
+ATOM 660 3HG2 ILE A 38 7.245 6.632 -12.643 1.00 0.00 H
+ATOM 661 1HD1 ILE A 38 6.028 3.141 -10.387 1.00 0.00 H
+ATOM 662 2HD1 ILE A 38 7.569 3.656 -9.657 1.00 0.00 H
+ATOM 663 3HD1 ILE A 38 6.348 4.869 -10.111 1.00 0.00 H
+ATOM 664 N LEU A 39 11.344 6.106 -12.641 1.00 0.00 N
+ATOM 665 CA LEU A 39 12.289 7.215 -12.700 1.00 0.00 C
+ATOM 666 C LEU A 39 12.880 7.363 -14.096 1.00 0.00 C
+ATOM 667 O LEU A 39 13.030 8.474 -14.603 1.00 0.00 O
+ATOM 668 CB LEU A 39 13.415 7.006 -11.680 1.00 0.00 C
+ATOM 669 CG LEU A 39 14.465 8.123 -11.610 1.00 0.00 C
+ATOM 670 CD1 LEU A 39 13.793 9.427 -11.204 1.00 0.00 C
+ATOM 671 CD2 LEU A 39 15.553 7.736 -10.619 1.00 0.00 C
+ATOM 672 H LEU A 39 11.540 5.324 -12.032 1.00 0.00 H
+ATOM 673 HA LEU A 39 11.759 8.134 -12.445 1.00 0.00 H
+ATOM 674 1HB LEU A 39 12.973 6.905 -10.690 1.00 0.00 H
+ATOM 675 2HB LEU A 39 13.934 6.078 -11.920 1.00 0.00 H
+ATOM 676 HG LEU A 39 14.908 8.268 -12.596 1.00 0.00 H
+ATOM 677 1HD1 LEU A 39 14.539 10.221 -11.155 1.00 0.00 H
+ATOM 678 2HD1 LEU A 39 13.034 9.690 -11.940 1.00 0.00 H
+ATOM 679 3HD1 LEU A 39 13.326 9.307 -10.227 1.00 0.00 H
+ATOM 680 1HD2 LEU A 39 16.299 8.529 -10.570 1.00 0.00 H
+ATOM 681 2HD2 LEU A 39 15.111 7.592 -9.632 1.00 0.00 H
+ATOM 682 3HD2 LEU A 39 16.028 6.810 -10.943 1.00 0.00 H
+ATOM 683 N LYS A 40 13.215 6.235 -14.713 1.00 0.00 N
+ATOM 684 CA LYS A 40 13.768 6.235 -16.062 1.00 0.00 C
+ATOM 685 C LYS A 40 12.770 6.795 -17.067 1.00 0.00 C
+ATOM 686 O LYS A 40 13.140 7.536 -17.977 1.00 0.00 O
+ATOM 687 CB LYS A 40 14.187 4.821 -16.469 1.00 0.00 C
+ATOM 688 CG LYS A 40 15.440 4.310 -15.770 1.00 0.00 C
+ATOM 689 CD LYS A 40 15.769 2.887 -16.196 1.00 0.00 C
+ATOM 690 CE LYS A 40 17.010 2.369 -15.484 1.00 0.00 C
+ATOM 691 NZ LYS A 40 17.343 0.976 -15.889 1.00 0.00 N
+ATOM 692 H LYS A 40 13.083 5.355 -14.235 1.00 0.00 H
+ATOM 693 HA LYS A 40 14.661 6.861 -16.070 1.00 0.00 H
+ATOM 694 1HB LYS A 40 13.376 4.125 -16.253 1.00 0.00 H
+ATOM 695 2HB LYS A 40 14.367 4.790 -17.544 1.00 0.00 H
+ATOM 696 1HG LYS A 40 16.283 4.958 -16.015 1.00 0.00 H
+ATOM 697 2HG LYS A 40 15.290 4.332 -14.692 1.00 0.00 H
+ATOM 698 1HD LYS A 40 14.927 2.234 -15.963 1.00 0.00 H
+ATOM 699 2HD LYS A 40 15.941 2.860 -17.272 1.00 0.00 H
+ATOM 700 1HE LYS A 40 17.857 3.013 -15.715 1.00 0.00 H
+ATOM 701 2HE LYS A 40 16.848 2.391 -14.407 1.00 0.00 H
+ATOM 702 1HZ LYS A 40 18.169 0.670 -15.396 1.00 0.00 H
+ATOM 703 2HZ LYS A 40 16.570 0.365 -15.662 1.00 0.00 H
+ATOM 704 3HZ LYS A 40 17.514 0.946 -16.884 1.00 0.00 H
+ATOM 705 N GLU A 41 11.502 6.436 -16.896 1.00 0.00 N
+ATOM 706 CA GLU A 41 10.443 6.924 -17.771 1.00 0.00 C
+ATOM 707 C GLU A 41 10.241 8.425 -17.608 1.00 0.00 C
+ATOM 708 O GLU A 41 9.999 9.139 -18.581 1.00 0.00 O
+ATOM 709 CB GLU A 41 9.132 6.189 -17.484 1.00 0.00 C
+ATOM 710 CG GLU A 41 9.114 4.736 -17.936 1.00 0.00 C
+ATOM 711 CD GLU A 41 7.863 4.011 -17.525 1.00 0.00 C
+ATOM 712 OE1 GLU A 41 6.991 4.637 -16.972 1.00 0.00 O
+ATOM 713 OE2 GLU A 41 7.778 2.830 -17.766 1.00 0.00 O
+ATOM 714 H GLU A 41 11.265 5.810 -16.140 1.00 0.00 H
+ATOM 715 HA GLU A 41 10.727 6.720 -18.804 1.00 0.00 H
+ATOM 716 1HB GLU A 41 8.931 6.209 -16.413 1.00 0.00 H
+ATOM 717 2HB GLU A 41 8.309 6.704 -17.980 1.00 0.00 H
+ATOM 718 1HG GLU A 41 9.199 4.703 -19.022 1.00 0.00 H
+ATOM 719 2HG GLU A 41 9.979 4.225 -17.516 1.00 0.00 H
+ATOM 720 N LEU A 42 10.341 8.899 -16.370 1.00 0.00 N
+ATOM 721 CA LEU A 42 10.201 10.321 -16.081 1.00 0.00 C
+ATOM 722 C LEU A 42 11.317 11.129 -16.732 1.00 0.00 C
+ATOM 723 O LEU A 42 11.080 12.211 -17.270 1.00 0.00 O
+ATOM 724 CB LEU A 42 10.208 10.557 -14.566 1.00 0.00 C
+ATOM 725 CG LEU A 42 8.981 10.037 -13.806 1.00 0.00 C
+ATOM 726 CD1 LEU A 42 9.268 10.046 -12.310 1.00 0.00 C
+ATOM 727 CD2 LEU A 42 7.774 10.902 -14.137 1.00 0.00 C
+ATOM 728 H LEU A 42 10.520 8.258 -15.611 1.00 0.00 H
+ATOM 729 HA LEU A 42 9.244 10.663 -16.479 1.00 0.00 H
+ATOM 730 1HB LEU A 42 11.088 10.075 -14.143 1.00 0.00 H
+ATOM 731 2HB LEU A 42 10.282 11.629 -14.381 1.00 0.00 H
+ATOM 732 HG LEU A 42 8.781 9.006 -14.100 1.00 0.00 H
+ATOM 733 1HD1 LEU A 42 8.396 9.676 -11.770 1.00 0.00 H
+ATOM 734 2HD1 LEU A 42 10.123 9.405 -12.100 1.00 0.00 H
+ATOM 735 3HD1 LEU A 42 9.488 11.064 -11.989 1.00 0.00 H
+ATOM 736 1HD2 LEU A 42 6.902 10.531 -13.597 1.00 0.00 H
+ATOM 737 2HD2 LEU A 42 7.973 11.932 -13.841 1.00 0.00 H
+ATOM 738 3HD2 LEU A 42 7.581 10.862 -15.209 1.00 0.00 H
+ATOM 739 N GLY A 43 12.533 10.597 -16.680 1.00 0.00 N
+ATOM 740 CA GLY A 43 13.669 11.216 -17.351 1.00 0.00 C
+ATOM 741 C GLY A 43 14.581 11.920 -16.354 1.00 0.00 C
+ATOM 742 O GLY A 43 14.127 12.404 -15.318 1.00 0.00 O
+ATOM 743 OXT GLY A 43 15.757 12.008 -16.575 1.00 0.00 O
+ATOM 744 H GLY A 43 12.674 9.741 -16.163 1.00 0.00 H
+ATOM 745 1HA GLY A 43 14.233 10.454 -17.890 1.00 0.00 H
+ATOM 746 2HA GLY A 43 13.310 11.932 -18.089 1.00 0.00 H
+TER
+##Begin comments##
+BINARY SILENTFILE
+DSSP LHHHHHHHHHHHLLLHHHHHHHHHHHHLLLLLHHHHHHHHHHL
+PHI 0,-61.816,-60.8787,-64.5102,-63.1039,-64.2348,-64.6809,-60.6696,-71.6446,-63.2411,-68.5134,-87.4087,52.8555,-66.3714,-159.282,-72.049,-91.2336,-59.1987,-70.4062,-69.4147,-64.3587,-63.0292,-61.2447,-60.5657,-66.4376,-72.2586,-66.284,-87.0805,54.3696,-99.0458,-104.379,50.5953,-68.2154,-67.1248,-66.4799,-61.4284,-66.5917,-66.2299,-62.4697,-62.92,-66.5536,-64.342,104.467
+PSI 115.998,-37.5448,-43.7903,-42.334,-39.6351,-46.1359,-39.6259,-40.0212,-43.5976,-31.5087,-13.494,-4.81317,58.9703,-22.2768,177.997,-10.4773,1.26573,-27.1412,-30.681,-32.6118,-46.8377,-42.6836,-46.1872,-47.0605,-30.6709,-51.412,-34.635,3.91492,43.5002,-34.6966,-22.9453,-123.521,-21.9477,-51.9533,-35.6708,-47.9277,-42.2737,-45.1473,-41.7849,-40.0291,-38.5491,-41.0543,0
+##End comments##
+
+AlaCount 4
+AverageDegree 14.628
+BuriedUnsatHbond 1
+Buried_non_polar_SASA_per_res 55.351
+CavityVolume 0.645
+CoreAverageDegree 21.364
+CoreResidueCount 11
+ExposeCoreHydrophobicsPerCoreResidue 18.243
+ExposeCoreHydrophobicsSASA 200.672
+ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent 10.942
+ExposedHydrophobics_on_TotalSASAPercent 5.86
+HasCoreResidueNum 8
+MaxDistanceToToMassCenter 6.882
+PackStat 0.632
+Rg 9.818
+SSShapeComplementarity 0.794
+ScorePerResFilter -1.782
+driftRMSD 0.782
+frac_helix 76.744
+frac_loop 23.256
+frac_sheet 0
+n_hydrophobic 17
+nres_helix 33
+nres_loop 10
+nres_sheet 0
+nres_total 43
+percent_core 0.186
+score -111.605
+ss_mismatch_probability 0.335
+
diff --git a/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb
new file mode 100644
index 0000000..98e041b
--- /dev/null
+++ b/10_Analysis/data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb
@@ -0,0 +1,786 @@
+HEADER 31-AUG-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 31-AUG-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.31+release.c7009b3115c
+ATOM 1 N SER A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA SER A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C SER A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O SER A 1 1.251 2.390 -0.000 1.00 0.00 O
+ATOM 5 CB SER A 1 1.980 -0.754 -1.207 1.00 0.00 C
+ATOM 6 OG SER A 1 1.807 -0.007 -2.380 1.00 0.00 O
+ATOM 7 1H SER A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 8 2H SER A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 9 3H SER A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 10 HA SER A 1 1.804 -0.502 0.905 1.00 0.00 H
+ATOM 11 1HB SER A 1 3.037 -0.977 -1.068 1.00 0.00 H
+ATOM 12 2HB SER A 1 1.455 -1.704 -1.297 1.00 0.00 H
+ATOM 13 HG SER A 1 1.881 -0.632 -3.105 1.00 0.00 H
+ATOM 14 N GLU A 2 3.332 1.536 0.000 1.00 0.00 N
+ATOM 15 CA GLU A 2 3.988 2.831 0.138 1.00 0.00 C
+ATOM 16 C GLU A 2 3.669 3.739 -1.043 1.00 0.00 C
+ATOM 17 O GLU A 2 3.504 4.948 -0.882 1.00 0.00 O
+ATOM 18 CB GLU A 2 5.503 2.651 0.260 1.00 0.00 C
+ATOM 19 CG GLU A 2 5.947 1.884 1.497 1.00 0.00 C
+ATOM 20 CD GLU A 2 5.803 0.395 1.345 1.00 0.00 C
+ATOM 21 OE1 GLU A 2 5.374 -0.038 0.302 1.00 0.00 O
+ATOM 22 OE2 GLU A 2 6.122 -0.310 2.273 1.00 0.00 O
+ATOM 23 H GLU A 2 3.899 0.706 -0.098 1.00 0.00 H
+ATOM 24 HA GLU A 2 3.628 3.306 1.051 1.00 0.00 H
+ATOM 25 1HB GLU A 2 5.879 2.121 -0.615 1.00 0.00 H
+ATOM 26 2HB GLU A 2 5.985 3.629 0.282 1.00 0.00 H
+ATOM 27 1HG GLU A 2 6.992 2.117 1.701 1.00 0.00 H
+ATOM 28 2HG GLU A 2 5.357 2.216 2.350 1.00 0.00 H
+ATOM 29 N ILE A 3 3.582 3.148 -2.230 1.00 0.00 N
+ATOM 30 CA ILE A 3 3.423 3.917 -3.459 1.00 0.00 C
+ATOM 31 C ILE A 3 2.044 4.559 -3.532 1.00 0.00 C
+ATOM 32 O ILE A 3 1.906 5.713 -3.939 1.00 0.00 O
+ATOM 33 CB ILE A 3 3.643 3.028 -4.696 1.00 0.00 C
+ATOM 34 CG1 ILE A 3 5.018 2.359 -4.635 1.00 0.00 C
+ATOM 35 CG2 ILE A 3 3.500 3.845 -5.971 1.00 0.00 C
+ATOM 36 CD1 ILE A 3 6.160 3.328 -4.429 1.00 0.00 C
+ATOM 37 H ILE A 3 3.628 2.141 -2.283 1.00 0.00 H
+ATOM 38 HA ILE A 3 4.177 4.705 -3.473 1.00 0.00 H
+ATOM 39 HB ILE A 3 2.903 2.228 -4.704 1.00 0.00 H
+ATOM 40 1HG1 ILE A 3 5.035 1.634 -3.822 1.00 0.00 H
+ATOM 41 2HG1 ILE A 3 5.199 1.813 -5.562 1.00 0.00 H
+ATOM 42 1HG2 ILE A 3 3.659 3.201 -6.835 1.00 0.00 H
+ATOM 43 2HG2 ILE A 3 2.501 4.275 -6.017 1.00 0.00 H
+ATOM 44 3HG2 ILE A 3 4.240 4.646 -5.974 1.00 0.00 H
+ATOM 45 1HD1 ILE A 3 7.102 2.779 -4.397 1.00 0.00 H
+ATOM 46 2HD1 ILE A 3 6.184 4.043 -5.252 1.00 0.00 H
+ATOM 47 3HD1 ILE A 3 6.020 3.860 -3.490 1.00 0.00 H
+ATOM 48 N GLU A 4 1.024 3.806 -3.136 1.00 0.00 N
+ATOM 49 CA GLU A 4 -0.333 4.332 -3.059 1.00 0.00 C
+ATOM 50 C GLU A 4 -0.422 5.485 -2.068 1.00 0.00 C
+ATOM 51 O GLU A 4 -1.107 6.478 -2.316 1.00 0.00 O
+ATOM 52 CB GLU A 4 -1.312 3.226 -2.659 1.00 0.00 C
+ATOM 53 CG GLU A 4 -2.774 3.652 -2.651 1.00 0.00 C
+ATOM 54 CD GLU A 4 -3.710 2.525 -2.318 1.00 0.00 C
+ATOM 55 OE1 GLU A 4 -3.244 1.429 -2.120 1.00 0.00 O
+ATOM 56 OE2 GLU A 4 -4.895 2.759 -2.263 1.00 0.00 O
+ATOM 57 H GLU A 4 1.194 2.843 -2.880 1.00 0.00 H
+ATOM 58 HA GLU A 4 -0.619 4.696 -4.047 1.00 0.00 H
+ATOM 59 1HB GLU A 4 -1.213 2.386 -3.346 1.00 0.00 H
+ATOM 60 2HB GLU A 4 -1.064 2.864 -1.661 1.00 0.00 H
+ATOM 61 1HG GLU A 4 -2.905 4.447 -1.916 1.00 0.00 H
+ATOM 62 2HG GLU A 4 -3.029 4.055 -3.630 1.00 0.00 H
+ATOM 63 N GLU A 5 0.274 5.348 -0.945 1.00 0.00 N
+ATOM 64 CA GLU A 5 0.314 6.399 0.065 1.00 0.00 C
+ATOM 65 C GLU A 5 0.940 7.672 -0.489 1.00 0.00 C
+ATOM 66 O GLU A 5 0.485 8.778 -0.196 1.00 0.00 O
+ATOM 67 CB GLU A 5 1.094 5.929 1.294 1.00 0.00 C
+ATOM 68 CG GLU A 5 0.378 4.877 2.129 1.00 0.00 C
+ATOM 69 CD GLU A 5 1.197 4.400 3.297 1.00 0.00 C
+ATOM 70 OE1 GLU A 5 2.327 4.809 3.412 1.00 0.00 O
+ATOM 71 OE2 GLU A 5 0.691 3.625 4.074 1.00 0.00 O
+ATOM 72 H GLU A 5 0.789 4.494 -0.786 1.00 0.00 H
+ATOM 73 HA GLU A 5 -0.708 6.619 0.376 1.00 0.00 H
+ATOM 74 1HB GLU A 5 2.051 5.512 0.980 1.00 0.00 H
+ATOM 75 2HB GLU A 5 1.305 6.781 1.940 1.00 0.00 H
+ATOM 76 1HG GLU A 5 -0.555 5.297 2.502 1.00 0.00 H
+ATOM 77 2HG GLU A 5 0.133 4.028 1.492 1.00 0.00 H
+ATOM 78 N ARG A 6 1.986 7.510 -1.293 1.00 0.00 N
+ATOM 79 CA ARG A 6 2.635 8.642 -1.942 1.00 0.00 C
+ATOM 80 C ARG A 6 1.668 9.381 -2.859 1.00 0.00 C
+ATOM 81 O ARG A 6 1.629 10.611 -2.874 1.00 0.00 O
+ATOM 82 CB ARG A 6 3.839 8.178 -2.749 1.00 0.00 C
+ATOM 83 CG ARG A 6 5.034 7.737 -1.918 1.00 0.00 C
+ATOM 84 CD ARG A 6 6.144 7.242 -2.772 1.00 0.00 C
+ATOM 85 NE ARG A 6 7.260 6.752 -1.980 1.00 0.00 N
+ATOM 86 CZ ARG A 6 8.351 6.146 -2.488 1.00 0.00 C
+ATOM 87 NH1 ARG A 6 8.457 5.963 -3.786 1.00 0.00 N
+ATOM 88 NH2 ARG A 6 9.314 5.734 -1.682 1.00 0.00 N
+ATOM 89 H ARG A 6 2.340 6.579 -1.457 1.00 0.00 H
+ATOM 90 HA ARG A 6 2.982 9.331 -1.172 1.00 0.00 H
+ATOM 91 1HB ARG A 6 3.551 7.340 -3.382 1.00 0.00 H
+ATOM 92 2HB ARG A 6 4.171 8.983 -3.404 1.00 0.00 H
+ATOM 93 1HG ARG A 6 5.402 8.581 -1.334 1.00 0.00 H
+ATOM 94 2HG ARG A 6 4.734 6.933 -1.246 1.00 0.00 H
+ATOM 95 1HD ARG A 6 5.785 6.426 -3.398 1.00 0.00 H
+ATOM 96 2HD ARG A 6 6.505 8.052 -3.405 1.00 0.00 H
+ATOM 97 HE ARG A 6 7.215 6.874 -0.977 1.00 0.00 H
+ATOM 98 1HH1 ARG A 6 7.721 6.277 -4.402 1.00 0.00 H
+ATOM 99 2HH1 ARG A 6 9.274 5.509 -4.167 1.00 0.00 H
+ATOM 100 1HH2 ARG A 6 9.233 5.875 -0.684 1.00 0.00 H
+ATOM 101 2HH2 ARG A 6 10.131 5.280 -2.063 1.00 0.00 H
+ATOM 102 N LEU A 7 0.889 8.622 -3.622 1.00 0.00 N
+ATOM 103 CA LEU A 7 -0.099 9.203 -4.524 1.00 0.00 C
+ATOM 104 C LEU A 7 -1.165 9.971 -3.752 1.00 0.00 C
+ATOM 105 O LEU A 7 -1.587 11.051 -4.166 1.00 0.00 O
+ATOM 106 CB LEU A 7 -0.760 8.104 -5.365 1.00 0.00 C
+ATOM 107 CG LEU A 7 -0.133 7.852 -6.742 1.00 0.00 C
+ATOM 108 CD1 LEU A 7 1.174 7.089 -6.573 1.00 0.00 C
+ATOM 109 CD2 LEU A 7 -1.111 7.077 -7.612 1.00 0.00 C
+ATOM 110 H LEU A 7 0.983 7.618 -3.577 1.00 0.00 H
+ATOM 111 HA LEU A 7 0.411 9.894 -5.197 1.00 0.00 H
+ATOM 112 1HB LEU A 7 -0.721 7.170 -4.808 1.00 0.00 H
+ATOM 113 2HB LEU A 7 -1.806 8.367 -5.520 1.00 0.00 H
+ATOM 114 HG LEU A 7 0.098 8.806 -7.217 1.00 0.00 H
+ATOM 115 1HD1 LEU A 7 1.620 6.910 -7.552 1.00 0.00 H
+ATOM 116 2HD1 LEU A 7 1.862 7.675 -5.964 1.00 0.00 H
+ATOM 117 3HD1 LEU A 7 0.977 6.135 -6.085 1.00 0.00 H
+ATOM 118 1HD2 LEU A 7 -0.665 6.898 -8.591 1.00 0.00 H
+ATOM 119 2HD2 LEU A 7 -1.341 6.122 -7.138 1.00 0.00 H
+ATOM 120 3HD2 LEU A 7 -2.029 7.653 -7.730 1.00 0.00 H
+ATOM 121 N GLU A 8 -1.595 9.408 -2.629 1.00 0.00 N
+ATOM 122 CA GLU A 8 -2.573 10.064 -1.769 1.00 0.00 C
+ATOM 123 C GLU A 8 -2.035 11.382 -1.228 1.00 0.00 C
+ATOM 124 O GLU A 8 -2.738 12.392 -1.214 1.00 0.00 O
+ATOM 125 CB GLU A 8 -2.964 9.146 -0.608 1.00 0.00 C
+ATOM 126 CG GLU A 8 -4.011 9.729 0.329 1.00 0.00 C
+ATOM 127 CD GLU A 8 -4.418 8.775 1.418 1.00 0.00 C
+ATOM 128 OE1 GLU A 8 -3.959 7.658 1.405 1.00 0.00 O
+ATOM 129 OE2 GLU A 8 -5.188 9.164 2.264 1.00 0.00 O
+ATOM 130 H GLU A 8 -1.236 8.502 -2.363 1.00 0.00 H
+ATOM 131 HA GLU A 8 -3.470 10.267 -2.356 1.00 0.00 H
+ATOM 132 1HB GLU A 8 -3.353 8.207 -1.002 1.00 0.00 H
+ATOM 133 2HB GLU A 8 -2.079 8.911 -0.017 1.00 0.00 H
+ATOM 134 1HG GLU A 8 -3.612 10.634 0.786 1.00 0.00 H
+ATOM 135 2HG GLU A 8 -4.890 10.005 -0.252 1.00 0.00 H
+ATOM 136 N LYS A 9 -0.783 11.365 -0.783 1.00 0.00 N
+ATOM 137 CA LYS A 9 -0.137 12.567 -0.268 1.00 0.00 C
+ATOM 138 C LYS A 9 -0.030 13.639 -1.345 1.00 0.00 C
+ATOM 139 O LYS A 9 -0.240 14.823 -1.079 1.00 0.00 O
+ATOM 140 CB LYS A 9 1.251 12.235 0.283 1.00 0.00 C
+ATOM 141 CG LYS A 9 1.238 11.451 1.588 1.00 0.00 C
+ATOM 142 CD LYS A 9 2.647 11.077 2.022 1.00 0.00 C
+ATOM 143 CE LYS A 9 2.633 10.245 3.296 1.00 0.00 C
+ATOM 144 NZ LYS A 9 4.001 9.818 3.697 1.00 0.00 N
+ATOM 145 H LYS A 9 -0.266 10.498 -0.801 1.00 0.00 H
+ATOM 146 HA LYS A 9 -0.737 12.957 0.555 1.00 0.00 H
+ATOM 147 1HB LYS A 9 1.804 11.651 -0.453 1.00 0.00 H
+ATOM 148 2HB LYS A 9 1.805 13.158 0.453 1.00 0.00 H
+ATOM 149 1HG LYS A 9 0.774 12.052 2.370 1.00 0.00 H
+ATOM 150 2HG LYS A 9 0.653 10.540 1.460 1.00 0.00 H
+ATOM 151 1HD LYS A 9 3.133 10.505 1.230 1.00 0.00 H
+ATOM 152 2HD LYS A 9 3.226 11.983 2.198 1.00 0.00 H
+ATOM 153 1HE LYS A 9 2.196 10.828 4.106 1.00 0.00 H
+ATOM 154 2HE LYS A 9 2.019 9.358 3.144 1.00 0.00 H
+ATOM 155 1HZ LYS A 9 3.948 9.270 4.544 1.00 0.00 H
+ATOM 156 2HZ LYS A 9 4.410 9.260 2.960 1.00 0.00 H
+ATOM 157 3HZ LYS A 9 4.575 10.633 3.859 1.00 0.00 H
+ATOM 158 N LEU A 10 0.296 13.218 -2.562 1.00 0.00 N
+ATOM 159 CA LEU A 10 0.385 14.135 -3.692 1.00 0.00 C
+ATOM 160 C LEU A 10 -0.986 14.681 -4.067 1.00 0.00 C
+ATOM 161 O LEU A 10 -1.131 15.865 -4.372 1.00 0.00 O
+ATOM 162 CB LEU A 10 1.009 13.426 -4.901 1.00 0.00 C
+ATOM 163 CG LEU A 10 2.497 13.078 -4.774 1.00 0.00 C
+ATOM 164 CD1 LEU A 10 2.887 12.103 -5.877 1.00 0.00 C
+ATOM 165 CD2 LEU A 10 3.325 14.352 -4.852 1.00 0.00 C
+ATOM 166 H LEU A 10 0.488 12.237 -2.708 1.00 0.00 H
+ATOM 167 HA LEU A 10 1.030 14.969 -3.411 1.00 0.00 H
+ATOM 168 1HB LEU A 10 0.466 12.499 -5.079 1.00 0.00 H
+ATOM 169 2HB LEU A 10 0.891 14.065 -5.777 1.00 0.00 H
+ATOM 170 HG LEU A 10 2.676 12.587 -3.817 1.00 0.00 H
+ATOM 171 1HD1 LEU A 10 3.945 11.855 -5.786 1.00 0.00 H
+ATOM 172 2HD1 LEU A 10 2.293 11.193 -5.785 1.00 0.00 H
+ATOM 173 3HD1 LEU A 10 2.704 12.560 -6.848 1.00 0.00 H
+ATOM 174 1HD2 LEU A 10 4.383 14.104 -4.761 1.00 0.00 H
+ATOM 175 2HD2 LEU A 10 3.149 14.842 -5.810 1.00 0.00 H
+ATOM 176 3HD2 LEU A 10 3.038 15.023 -4.043 1.00 0.00 H
+ATOM 177 N ALA A 11 -1.991 13.812 -4.043 1.00 0.00 N
+ATOM 178 CA ALA A 11 -3.361 14.216 -4.336 1.00 0.00 C
+ATOM 179 C ALA A 11 -3.904 15.145 -3.257 1.00 0.00 C
+ATOM 180 O ALA A 11 -4.638 16.089 -3.550 1.00 0.00 O
+ATOM 181 CB ALA A 11 -4.254 12.993 -4.480 1.00 0.00 C
+ATOM 182 H ALA A 11 -1.801 12.847 -3.815 1.00 0.00 H
+ATOM 183 HA ALA A 11 -3.369 14.746 -5.289 1.00 0.00 H
+ATOM 184 1HB ALA A 11 -5.274 13.311 -4.699 1.00 0.00 H
+ATOM 185 2HB ALA A 11 -3.887 12.368 -5.294 1.00 0.00 H
+ATOM 186 3HB ALA A 11 -4.244 12.424 -3.552 1.00 0.00 H
+ATOM 187 N ARG A 12 -3.539 14.871 -2.009 1.00 0.00 N
+ATOM 188 CA ARG A 12 -4.046 15.637 -0.877 1.00 0.00 C
+ATOM 189 C ARG A 12 -3.371 17.000 -0.788 1.00 0.00 C
+ATOM 190 O ARG A 12 -4.029 18.016 -0.563 1.00 0.00 O
+ATOM 191 CB ARG A 12 -3.826 14.879 0.424 1.00 0.00 C
+ATOM 192 CG ARG A 12 -4.487 15.499 1.644 1.00 0.00 C
+ATOM 193 CD ARG A 12 -4.269 14.679 2.863 1.00 0.00 C
+ATOM 194 NE ARG A 12 -4.851 13.353 2.736 1.00 0.00 N
+ATOM 195 CZ ARG A 12 -6.151 13.065 2.944 1.00 0.00 C
+ATOM 196 NH1 ARG A 12 -6.989 14.019 3.287 1.00 0.00 N
+ATOM 197 NH2 ARG A 12 -6.584 11.825 2.803 1.00 0.00 N
+ATOM 198 H ARG A 12 -2.894 14.113 -1.841 1.00 0.00 H
+ATOM 199 HA ARG A 12 -5.118 15.786 -1.013 1.00 0.00 H
+ATOM 200 1HB ARG A 12 -4.208 13.864 0.322 1.00 0.00 H
+ATOM 201 2HB ARG A 12 -2.758 14.808 0.627 1.00 0.00 H
+ATOM 202 1HG ARG A 12 -4.071 16.491 1.819 1.00 0.00 H
+ATOM 203 2HG ARG A 12 -5.562 15.581 1.474 1.00 0.00 H
+ATOM 204 1HD ARG A 12 -3.199 14.566 3.039 1.00 0.00 H
+ATOM 205 2HD ARG A 12 -4.726 15.172 3.720 1.00 0.00 H
+ATOM 206 HE ARG A 12 -4.238 12.593 2.474 1.00 0.00 H
+ATOM 207 1HH1 ARG A 12 -6.658 14.967 3.395 1.00 0.00 H
+ATOM 208 2HH1 ARG A 12 -7.963 13.803 3.443 1.00 0.00 H
+ATOM 209 1HH2 ARG A 12 -5.940 11.091 2.539 1.00 0.00 H
+ATOM 210 2HH2 ARG A 12 -7.558 11.609 2.958 1.00 0.00 H
+ATOM 211 N SER A 13 -2.054 17.015 -0.965 1.00 0.00 N
+ATOM 212 CA SER A 13 -1.278 18.242 -0.836 1.00 0.00 C
+ATOM 213 C SER A 13 -1.565 19.200 -1.985 1.00 0.00 C
+ATOM 214 O SER A 13 -1.686 18.783 -3.137 1.00 0.00 O
+ATOM 215 CB SER A 13 0.203 17.921 -0.792 1.00 0.00 C
+ATOM 216 OG SER A 13 0.972 19.092 -0.806 1.00 0.00 O
+ATOM 217 H SER A 13 -1.579 16.154 -1.196 1.00 0.00 H
+ATOM 218 HA SER A 13 -1.564 18.736 0.093 1.00 0.00 H
+ATOM 219 1HB SER A 13 0.425 17.349 0.109 1.00 0.00 H
+ATOM 220 2HB SER A 13 0.466 17.300 -1.647 1.00 0.00 H
+ATOM 221 HG SER A 13 1.888 18.807 -0.840 1.00 0.00 H
+ATOM 222 N GLU A 14 -1.674 20.485 -1.665 1.00 0.00 N
+ATOM 223 CA GLU A 14 -1.939 21.505 -2.672 1.00 0.00 C
+ATOM 224 C GLU A 14 -0.716 21.748 -3.547 1.00 0.00 C
+ATOM 225 O GLU A 14 -0.796 22.431 -4.567 1.00 0.00 O
+ATOM 226 CB GLU A 14 -2.368 22.814 -2.005 1.00 0.00 C
+ATOM 227 CG GLU A 14 -1.251 23.542 -1.272 1.00 0.00 C
+ATOM 228 CD GLU A 14 -1.068 23.063 0.141 1.00 0.00 C
+ATOM 229 OE1 GLU A 14 -1.550 22.002 0.456 1.00 0.00 O
+ATOM 230 OE2 GLU A 14 -0.445 23.760 0.907 1.00 0.00 O
+ATOM 231 H GLU A 14 -1.570 20.762 -0.699 1.00 0.00 H
+ATOM 232 HA GLU A 14 -2.753 21.159 -3.310 1.00 0.00 H
+ATOM 233 1HB GLU A 14 -2.772 23.491 -2.758 1.00 0.00 H
+ATOM 234 2HB GLU A 14 -3.163 22.613 -1.286 1.00 0.00 H
+ATOM 235 1HG GLU A 14 -0.318 23.396 -1.817 1.00 0.00 H
+ATOM 236 2HG GLU A 14 -1.471 24.609 -1.264 1.00 0.00 H
+ATOM 237 N THR A 15 0.416 21.184 -3.140 1.00 0.00 N
+ATOM 238 CA THR A 15 1.667 21.367 -3.867 1.00 0.00 C
+ATOM 239 C THR A 15 1.927 20.206 -4.818 1.00 0.00 C
+ATOM 240 O THR A 15 2.891 20.222 -5.584 1.00 0.00 O
+ATOM 241 CB THR A 15 2.854 21.517 -2.898 1.00 0.00 C
+ATOM 242 OG1 THR A 15 3.006 20.314 -2.134 1.00 0.00 O
+ATOM 243 CG2 THR A 15 2.627 22.687 -1.953 1.00 0.00 C
+ATOM 244 H THR A 15 0.411 20.613 -2.307 1.00 0.00 H
+ATOM 245 HA THR A 15 1.594 22.283 -4.456 1.00 0.00 H
+ATOM 246 HB THR A 15 3.769 21.688 -3.466 1.00 0.00 H
+ATOM 247 HG1 THR A 15 3.895 20.274 -1.772 1.00 0.00 H
+ATOM 248 1HG2 THR A 15 3.476 22.778 -1.276 1.00 0.00 H
+ATOM 249 2HG2 THR A 15 2.523 23.606 -2.530 1.00 0.00 H
+ATOM 250 3HG2 THR A 15 1.720 22.518 -1.375 1.00 0.00 H
+ATOM 251 N GLY A 16 1.062 19.200 -4.765 1.00 0.00 N
+ATOM 252 CA GLY A 16 1.232 17.999 -5.575 1.00 0.00 C
+ATOM 253 C GLY A 16 0.574 18.158 -6.940 1.00 0.00 C
+ATOM 254 O GLY A 16 -0.343 18.961 -7.108 1.00 0.00 O
+ATOM 255 H GLY A 16 0.265 19.267 -4.148 1.00 0.00 H
+ATOM 256 1HA GLY A 16 2.295 17.793 -5.701 1.00 0.00 H
+ATOM 257 2HA GLY A 16 0.799 17.145 -5.056 1.00 0.00 H
+ATOM 258 N THR A 17 1.049 17.387 -7.913 1.00 0.00 N
+ATOM 259 CA THR A 17 0.449 17.375 -9.242 1.00 0.00 C
+ATOM 260 C THR A 17 0.127 15.955 -9.688 1.00 0.00 C
+ATOM 261 O THR A 17 0.687 14.989 -9.170 1.00 0.00 O
+ATOM 262 CB THR A 17 1.376 18.044 -10.274 1.00 0.00 C
+ATOM 263 OG1 THR A 17 2.552 17.244 -10.453 1.00 0.00 O
+ATOM 264 CG2 THR A 17 1.780 19.434 -9.807 1.00 0.00 C
+ATOM 265 H THR A 17 1.845 16.794 -7.727 1.00 0.00 H
+ATOM 266 HA THR A 17 -0.485 17.936 -9.206 1.00 0.00 H
+ATOM 267 HB THR A 17 0.859 18.124 -11.230 1.00 0.00 H
+ATOM 268 HG1 THR A 17 3.075 17.601 -11.176 1.00 0.00 H
+ATOM 269 1HG2 THR A 17 2.434 19.891 -10.549 1.00 0.00 H
+ATOM 270 2HG2 THR A 17 0.888 20.048 -9.681 1.00 0.00 H
+ATOM 271 3HG2 THR A 17 2.306 19.359 -8.856 1.00 0.00 H
+ATOM 272 N GLU A 18 -0.779 15.834 -10.653 1.00 0.00 N
+ATOM 273 CA GLU A 18 -1.112 14.539 -11.233 1.00 0.00 C
+ATOM 274 C GLU A 18 0.085 13.934 -11.955 1.00 0.00 C
+ATOM 275 O GLU A 18 0.236 12.714 -12.013 1.00 0.00 O
+ATOM 276 CB GLU A 18 -2.288 14.675 -12.203 1.00 0.00 C
+ATOM 277 CG GLU A 18 -3.613 15.022 -11.539 1.00 0.00 C
+ATOM 278 CD GLU A 18 -3.731 16.481 -11.195 1.00 0.00 C
+ATOM 279 OE1 GLU A 18 -2.828 17.220 -11.506 1.00 0.00 O
+ATOM 280 OE2 GLU A 18 -4.726 16.857 -10.621 1.00 0.00 O
+ATOM 281 H GLU A 18 -1.249 16.661 -10.992 1.00 0.00 H
+ATOM 282 HA GLU A 18 -1.412 13.866 -10.429 1.00 0.00 H
+ATOM 283 1HB GLU A 18 -2.068 15.452 -12.935 1.00 0.00 H
+ATOM 284 2HB GLU A 18 -2.422 13.740 -12.747 1.00 0.00 H
+ATOM 285 1HG GLU A 18 -4.427 14.752 -12.211 1.00 0.00 H
+ATOM 286 2HG GLU A 18 -3.718 14.430 -10.630 1.00 0.00 H
+ATOM 287 N GLU A 19 0.935 14.795 -12.504 1.00 0.00 N
+ATOM 288 CA GLU A 19 2.145 14.349 -13.184 1.00 0.00 C
+ATOM 289 C GLU A 19 3.036 13.540 -12.250 1.00 0.00 C
+ATOM 290 O GLU A 19 3.577 12.504 -12.635 1.00 0.00 O
+ATOM 291 CB GLU A 19 2.922 15.548 -13.733 1.00 0.00 C
+ATOM 292 CG GLU A 19 4.273 15.198 -14.340 1.00 0.00 C
+ATOM 293 CD GLU A 19 4.156 14.371 -15.590 1.00 0.00 C
+ATOM 294 OE1 GLU A 19 3.104 14.370 -16.183 1.00 0.00 O
+ATOM 295 OE2 GLU A 19 5.121 13.740 -15.953 1.00 0.00 O
+ATOM 296 H GLU A 19 0.738 15.784 -12.450 1.00 0.00 H
+ATOM 297 HA GLU A 19 1.857 13.718 -14.026 1.00 0.00 H
+ATOM 298 1HB GLU A 19 2.329 16.045 -14.502 1.00 0.00 H
+ATOM 299 2HB GLU A 19 3.091 16.269 -12.934 1.00 0.00 H
+ATOM 300 1HG GLU A 19 4.804 16.120 -14.576 1.00 0.00 H
+ATOM 301 2HG GLU A 19 4.860 14.652 -13.603 1.00 0.00 H
+ATOM 302 N GLN A 20 3.184 14.019 -11.020 1.00 0.00 N
+ATOM 303 CA GLN A 20 3.987 13.327 -10.019 1.00 0.00 C
+ATOM 304 C GLN A 20 3.382 11.975 -9.666 1.00 0.00 C
+ATOM 305 O GLN A 20 4.098 10.989 -9.495 1.00 0.00 O
+ATOM 306 CB GLN A 20 4.126 14.183 -8.757 1.00 0.00 C
+ATOM 307 CG GLN A 20 4.988 15.421 -8.937 1.00 0.00 C
+ATOM 308 CD GLN A 20 4.894 16.368 -7.755 1.00 0.00 C
+ATOM 309 OE1 GLN A 20 3.798 16.704 -7.297 1.00 0.00 O
+ATOM 310 NE2 GLN A 20 6.044 16.804 -7.254 1.00 0.00 N
+ATOM 311 H GLN A 20 2.728 14.886 -10.771 1.00 0.00 H
+ATOM 312 HA GLN A 20 4.986 13.167 -10.427 1.00 0.00 H
+ATOM 313 1HB GLN A 20 3.139 14.505 -8.426 1.00 0.00 H
+ATOM 314 2HB GLN A 20 4.560 13.584 -7.957 1.00 0.00 H
+ATOM 315 1HG GLN A 20 6.028 15.114 -9.047 1.00 0.00 H
+ATOM 316 2HG GLN A 20 4.659 15.954 -9.829 1.00 0.00 H
+ATOM 317 1HE2 GLN A 20 6.045 17.431 -6.474 1.00 0.00 H
+ATOM 318 2HE2 GLN A 20 6.910 16.506 -7.656 1.00 0.00 H
+ATOM 319 N MET A 21 2.058 11.935 -9.559 1.00 0.00 N
+ATOM 320 CA MET A 21 1.348 10.689 -9.295 1.00 0.00 C
+ATOM 321 C MET A 21 1.555 9.687 -10.424 1.00 0.00 C
+ATOM 322 O MET A 21 1.814 8.509 -10.181 1.00 0.00 O
+ATOM 323 CB MET A 21 -0.141 10.963 -9.091 1.00 0.00 C
+ATOM 324 CG MET A 21 -0.468 11.764 -7.839 1.00 0.00 C
+ATOM 325 SD MET A 21 -2.189 12.302 -7.788 1.00 0.00 S
+ATOM 326 CE MET A 21 -3.021 10.746 -7.485 1.00 0.00 C
+ATOM 327 H MET A 21 1.530 12.789 -9.664 1.00 0.00 H
+ATOM 328 HA MET A 21 1.736 10.259 -8.371 1.00 0.00 H
+ATOM 329 1HB MET A 21 -0.530 11.509 -9.949 1.00 0.00 H
+ATOM 330 2HB MET A 21 -0.680 10.017 -9.033 1.00 0.00 H
+ATOM 331 1HG MET A 21 -0.270 11.157 -6.957 1.00 0.00 H
+ATOM 332 2HG MET A 21 0.170 12.647 -7.795 1.00 0.00 H
+ATOM 333 1HE MET A 21 -4.097 10.913 -7.427 1.00 0.00 H
+ATOM 334 2HE MET A 21 -2.804 10.053 -8.299 1.00 0.00 H
+ATOM 335 3HE MET A 21 -2.669 10.322 -6.544 1.00 0.00 H
+ATOM 336 N ARG A 22 1.437 10.163 -11.659 1.00 0.00 N
+ATOM 337 CA ARG A 22 1.595 9.306 -12.828 1.00 0.00 C
+ATOM 338 C ARG A 22 2.999 8.718 -12.895 1.00 0.00 C
+ATOM 339 O ARG A 22 3.177 7.550 -13.239 1.00 0.00 O
+ATOM 340 CB ARG A 22 1.312 10.084 -14.104 1.00 0.00 C
+ATOM 341 CG ARG A 22 -0.159 10.364 -14.370 1.00 0.00 C
+ATOM 342 CD ARG A 22 -0.386 10.830 -15.762 1.00 0.00 C
+ATOM 343 NE ARG A 22 0.181 12.149 -15.992 1.00 0.00 N
+ATOM 344 CZ ARG A 22 -0.494 13.307 -15.853 1.00 0.00 C
+ATOM 345 NH1 ARG A 22 -1.756 13.292 -15.486 1.00 0.00 N
+ATOM 346 NH2 ARG A 22 0.113 14.457 -16.086 1.00 0.00 N
+ATOM 347 H ARG A 22 1.234 11.143 -11.791 1.00 0.00 H
+ATOM 348 HA ARG A 22 0.877 8.488 -12.757 1.00 0.00 H
+ATOM 349 1HB ARG A 22 1.829 11.042 -14.068 1.00 0.00 H
+ATOM 350 2HB ARG A 22 1.703 9.534 -14.960 1.00 0.00 H
+ATOM 351 1HG ARG A 22 -0.736 9.453 -14.215 1.00 0.00 H
+ATOM 352 2HG ARG A 22 -0.511 11.138 -13.687 1.00 0.00 H
+ATOM 353 1HD ARG A 22 0.078 10.133 -16.459 1.00 0.00 H
+ATOM 354 2HD ARG A 22 -1.456 10.880 -15.958 1.00 0.00 H
+ATOM 355 HE ARG A 22 1.151 12.201 -16.276 1.00 0.00 H
+ATOM 356 1HH1 ARG A 22 -2.220 12.412 -15.308 1.00 0.00 H
+ATOM 357 2HH1 ARG A 22 -2.261 14.160 -15.382 1.00 0.00 H
+ATOM 358 1HH2 ARG A 22 1.084 14.469 -16.369 1.00 0.00 H
+ATOM 359 2HH2 ARG A 22 -0.392 15.325 -15.983 1.00 0.00 H
+ATOM 360 N GLN A 23 3.993 9.536 -12.565 1.00 0.00 N
+ATOM 361 CA GLN A 23 5.386 9.107 -12.616 1.00 0.00 C
+ATOM 362 C GLN A 23 5.638 7.939 -11.672 1.00 0.00 C
+ATOM 363 O GLN A 23 6.366 7.005 -12.006 1.00 0.00 O
+ATOM 364 CB GLN A 23 6.317 10.271 -12.268 1.00 0.00 C
+ATOM 365 CG GLN A 23 6.438 11.320 -13.360 1.00 0.00 C
+ATOM 366 CD GLN A 23 7.230 12.534 -12.912 1.00 0.00 C
+ATOM 367 OE1 GLN A 23 7.777 12.562 -11.806 1.00 0.00 O
+ATOM 368 NE2 GLN A 23 7.296 13.546 -13.769 1.00 0.00 N
+ATOM 369 H GLN A 23 3.778 10.478 -12.272 1.00 0.00 H
+ATOM 370 HA GLN A 23 5.613 8.789 -13.635 1.00 0.00 H
+ATOM 371 1HB GLN A 23 5.960 10.766 -11.365 1.00 0.00 H
+ATOM 372 2HB GLN A 23 7.316 9.888 -12.058 1.00 0.00 H
+ATOM 373 1HG GLN A 23 6.945 10.879 -14.218 1.00 0.00 H
+ATOM 374 2HG GLN A 23 5.439 11.650 -13.645 1.00 0.00 H
+ATOM 375 1HE2 GLN A 23 7.804 14.374 -13.528 1.00 0.00 H
+ATOM 376 2HE2 GLN A 23 6.837 13.482 -14.656 1.00 0.00 H
+ATOM 377 N LEU A 24 5.031 7.998 -10.491 1.00 0.00 N
+ATOM 378 CA LEU A 24 5.103 6.897 -9.537 1.00 0.00 C
+ATOM 379 C LEU A 24 4.375 5.666 -10.060 1.00 0.00 C
+ATOM 380 O LEU A 24 4.839 4.539 -9.888 1.00 0.00 O
+ATOM 381 CB LEU A 24 4.501 7.322 -8.192 1.00 0.00 C
+ATOM 382 CG LEU A 24 5.326 8.331 -7.383 1.00 0.00 C
+ATOM 383 CD1 LEU A 24 4.475 8.892 -6.251 1.00 0.00 C
+ATOM 384 CD2 LEU A 24 6.574 7.649 -6.842 1.00 0.00 C
+ATOM 385 H LEU A 24 4.505 8.825 -10.249 1.00 0.00 H
+ATOM 386 HA LEU A 24 6.152 6.644 -9.381 1.00 0.00 H
+ATOM 387 1HB LEU A 24 3.523 7.764 -8.374 1.00 0.00 H
+ATOM 388 2HB LEU A 24 4.366 6.434 -7.576 1.00 0.00 H
+ATOM 389 HG LEU A 24 5.616 9.162 -8.025 1.00 0.00 H
+ATOM 390 1HD1 LEU A 24 5.061 9.609 -5.676 1.00 0.00 H
+ATOM 391 2HD1 LEU A 24 3.600 9.391 -6.667 1.00 0.00 H
+ATOM 392 3HD1 LEU A 24 4.155 8.079 -5.600 1.00 0.00 H
+ATOM 393 1HD2 LEU A 24 7.161 8.366 -6.267 1.00 0.00 H
+ATOM 394 2HD2 LEU A 24 6.284 6.818 -6.198 1.00 0.00 H
+ATOM 395 3HD2 LEU A 24 7.172 7.273 -7.673 1.00 0.00 H
+ATOM 396 N ALA A 25 3.232 5.888 -10.700 1.00 0.00 N
+ATOM 397 CA ALA A 25 2.442 4.796 -11.257 1.00 0.00 C
+ATOM 398 C ALA A 25 3.181 4.108 -12.397 1.00 0.00 C
+ATOM 399 O ALA A 25 3.074 2.894 -12.575 1.00 0.00 O
+ATOM 400 CB ALA A 25 1.092 5.311 -11.736 1.00 0.00 C
+ATOM 401 H ALA A 25 2.901 6.836 -10.802 1.00 0.00 H
+ATOM 402 HA ALA A 25 2.256 4.066 -10.469 1.00 0.00 H
+ATOM 403 1HB ALA A 25 0.513 4.484 -12.150 1.00 0.00 H
+ATOM 404 2HB ALA A 25 0.551 5.748 -10.897 1.00 0.00 H
+ATOM 405 3HB ALA A 25 1.243 6.067 -12.504 1.00 0.00 H
+ATOM 406 N LYS A 26 3.929 4.889 -13.168 1.00 0.00 N
+ATOM 407 CA LYS A 26 4.715 4.351 -14.272 1.00 0.00 C
+ATOM 408 C LYS A 26 6.006 3.716 -13.771 1.00 0.00 C
+ATOM 409 O LYS A 26 6.446 2.690 -14.289 1.00 0.00 O
+ATOM 410 CB LYS A 26 5.029 5.447 -15.291 1.00 0.00 C
+ATOM 411 CG LYS A 26 3.826 5.923 -16.094 1.00 0.00 C
+ATOM 412 CD LYS A 26 4.212 7.025 -17.069 1.00 0.00 C
+ATOM 413 CE LYS A 26 3.013 7.493 -17.880 1.00 0.00 C
+ATOM 414 NZ LYS A 26 3.376 8.576 -18.835 1.00 0.00 N
+ATOM 415 H LYS A 26 3.955 5.882 -12.984 1.00 0.00 H
+ATOM 416 HA LYS A 26 4.123 3.587 -14.777 1.00 0.00 H
+ATOM 417 1HB LYS A 26 5.451 6.312 -14.777 1.00 0.00 H
+ATOM 418 2HB LYS A 26 5.779 5.086 -15.994 1.00 0.00 H
+ATOM 419 1HG LYS A 26 3.407 5.085 -16.653 1.00 0.00 H
+ATOM 420 2HG LYS A 26 3.062 6.302 -15.415 1.00 0.00 H
+ATOM 421 1HD LYS A 26 4.621 7.873 -16.517 1.00 0.00 H
+ATOM 422 2HD LYS A 26 4.978 6.655 -17.751 1.00 0.00 H
+ATOM 423 1HE LYS A 26 2.604 6.654 -18.441 1.00 0.00 H
+ATOM 424 2HE LYS A 26 2.240 7.863 -17.207 1.00 0.00 H
+ATOM 425 1HZ LYS A 26 2.555 8.858 -19.352 1.00 0.00 H
+ATOM 426 2HZ LYS A 26 3.740 9.368 -18.324 1.00 0.00 H
+ATOM 427 3HZ LYS A 26 4.078 8.238 -19.477 1.00 0.00 H
+ATOM 428 N LYS A 27 6.609 4.333 -12.760 1.00 0.00 N
+ATOM 429 CA LYS A 27 7.900 3.886 -12.251 1.00 0.00 C
+ATOM 430 C LYS A 27 7.784 2.527 -11.573 1.00 0.00 C
+ATOM 431 O LYS A 27 8.612 1.642 -11.789 1.00 0.00 O
+ATOM 432 CB LYS A 27 8.475 4.913 -11.274 1.00 0.00 C
+ATOM 433 CG LYS A 27 9.824 4.530 -10.680 1.00 0.00 C
+ATOM 434 CD LYS A 27 10.397 5.658 -9.835 1.00 0.00 C
+ATOM 435 CE LYS A 27 11.700 5.244 -9.167 1.00 0.00 C
+ATOM 436 NZ LYS A 27 12.282 6.345 -8.353 1.00 0.00 N
+ATOM 437 H LYS A 27 6.162 5.132 -12.334 1.00 0.00 H
+ATOM 438 HA LYS A 27 8.593 3.801 -13.089 1.00 0.00 H
+ATOM 439 1HB LYS A 27 8.593 5.871 -11.781 1.00 0.00 H
+ATOM 440 2HB LYS A 27 7.777 5.062 -10.450 1.00 0.00 H
+ATOM 441 1HG LYS A 27 9.709 3.642 -10.056 1.00 0.00 H
+ATOM 442 2HG LYS A 27 10.523 4.298 -11.483 1.00 0.00 H
+ATOM 443 1HD LYS A 27 10.582 6.528 -10.466 1.00 0.00 H
+ATOM 444 2HD LYS A 27 9.678 5.936 -9.064 1.00 0.00 H
+ATOM 445 1HE LYS A 27 11.521 4.386 -8.521 1.00 0.00 H
+ATOM 446 2HE LYS A 27 12.423 4.952 -9.930 1.00 0.00 H
+ATOM 447 1HZ LYS A 27 13.144 6.031 -7.928 1.00 0.00 H
+ATOM 448 2HZ LYS A 27 12.470 7.141 -8.946 1.00 0.00 H
+ATOM 449 3HZ LYS A 27 11.629 6.611 -7.630 1.00 0.00 H
+ATOM 450 N TYR A 28 6.751 2.367 -10.752 1.00 0.00 N
+ATOM 451 CA TYR A 28 6.605 1.172 -9.930 1.00 0.00 C
+ATOM 452 C TYR A 28 5.587 0.211 -10.531 1.00 0.00 C
+ATOM 453 O TYR A 28 4.592 0.634 -11.120 1.00 0.00 O
+ATOM 454 CB TYR A 28 6.199 1.551 -8.503 1.00 0.00 C
+ATOM 455 CG TYR A 28 7.282 2.269 -7.731 1.00 0.00 C
+ATOM 456 CD1 TYR A 28 7.349 3.654 -7.754 1.00 0.00 C
+ATOM 457 CD2 TYR A 28 8.210 1.543 -6.998 1.00 0.00 C
+ATOM 458 CE1 TYR A 28 8.339 4.311 -7.048 1.00 0.00 C
+ATOM 459 CE2 TYR A 28 9.199 2.199 -6.293 1.00 0.00 C
+ATOM 460 CZ TYR A 28 9.266 3.577 -6.316 1.00 0.00 C
+ATOM 461 OH TYR A 28 10.251 4.230 -5.613 1.00 0.00 O
+ATOM 462 H TYR A 28 6.050 3.092 -10.697 1.00 0.00 H
+ATOM 463 HA TYR A 28 7.565 0.657 -9.894 1.00 0.00 H
+ATOM 464 1HB TYR A 28 5.318 2.194 -8.534 1.00 0.00 H
+ATOM 465 2HB TYR A 28 5.927 0.651 -7.952 1.00 0.00 H
+ATOM 466 HD1 TYR A 28 6.620 4.225 -8.330 1.00 0.00 H
+ATOM 467 HD2 TYR A 28 8.158 0.454 -6.981 1.00 0.00 H
+ATOM 468 HE1 TYR A 28 8.391 5.399 -7.067 1.00 0.00 H
+ATOM 469 HE2 TYR A 28 9.929 1.628 -5.718 1.00 0.00 H
+ATOM 470 HH TYR A 28 10.821 3.585 -5.188 1.00 0.00 H
+ATOM 471 N GLU A 29 5.842 -1.084 -10.379 1.00 0.00 N
+ATOM 472 CA GLU A 29 5.010 -2.107 -11.000 1.00 0.00 C
+ATOM 473 C GLU A 29 3.711 -2.303 -10.230 1.00 0.00 C
+ATOM 474 O GLU A 29 2.784 -2.955 -10.712 1.00 0.00 O
+ATOM 475 CB GLU A 29 5.769 -3.433 -11.086 1.00 0.00 C
+ATOM 476 CG GLU A 29 5.938 -4.148 -9.753 1.00 0.00 C
+ATOM 477 CD GLU A 29 7.132 -3.665 -8.977 1.00 0.00 C
+ATOM 478 OE1 GLU A 29 7.614 -2.597 -9.269 1.00 0.00 O
+ATOM 479 OE2 GLU A 29 7.562 -4.365 -8.091 1.00 0.00 O
+ATOM 480 H GLU A 29 6.633 -1.367 -9.818 1.00 0.00 H
+ATOM 481 HA GLU A 29 4.802 -1.820 -12.042 1.00 0.00 H
+ATOM 482 1HB GLU A 29 5.246 -4.108 -11.764 1.00 0.00 H
+ATOM 483 2HB GLU A 29 6.762 -3.258 -11.500 1.00 0.00 H
+ATOM 484 1HG GLU A 29 5.042 -3.992 -9.153 1.00 0.00 H
+ATOM 485 2HG GLU A 29 6.037 -5.217 -9.936 1.00 0.00 H
+ATOM 486 N ASP A 30 3.649 -1.736 -9.030 1.00 0.00 N
+ATOM 487 CA ASP A 30 2.525 -1.966 -8.130 1.00 0.00 C
+ATOM 488 C ASP A 30 1.230 -1.414 -8.713 1.00 0.00 C
+ATOM 489 O ASP A 30 1.076 -0.203 -8.869 1.00 0.00 O
+ATOM 490 CB ASP A 30 2.790 -1.327 -6.765 1.00 0.00 C
+ATOM 491 CG ASP A 30 1.725 -1.672 -5.732 1.00 0.00 C
+ATOM 492 OD1 ASP A 30 0.660 -2.087 -6.122 1.00 0.00 O
+ATOM 493 OD2 ASP A 30 1.988 -1.517 -4.564 1.00 0.00 O
+ATOM 494 H ASP A 30 4.400 -1.129 -8.733 1.00 0.00 H
+ATOM 495 HA ASP A 30 2.405 -3.042 -7.994 1.00 0.00 H
+ATOM 496 1HB ASP A 30 3.759 -1.658 -6.391 1.00 0.00 H
+ATOM 497 2HB ASP A 30 2.834 -0.243 -6.873 1.00 0.00 H
+ATOM 498 N PRO A 31 0.303 -2.309 -9.035 1.00 0.00 N
+ATOM 499 CA PRO A 31 -0.948 -1.920 -9.674 1.00 0.00 C
+ATOM 500 C PRO A 31 -1.704 -0.900 -8.832 1.00 0.00 C
+ATOM 501 O PRO A 31 -2.521 -0.138 -9.349 1.00 0.00 O
+ATOM 502 CB PRO A 31 -1.711 -3.245 -9.775 1.00 0.00 C
+ATOM 503 CG PRO A 31 -0.639 -4.276 -9.877 1.00 0.00 C
+ATOM 504 CD PRO A 31 0.438 -3.790 -8.944 1.00 0.00 C
+ATOM 505 HA PRO A 31 -0.733 -1.513 -10.673 1.00 0.00 H
+ATOM 506 1HB PRO A 31 -2.350 -3.379 -8.890 1.00 0.00 H
+ATOM 507 2HB PRO A 31 -2.375 -3.231 -10.652 1.00 0.00 H
+ATOM 508 1HG PRO A 31 -1.033 -5.263 -9.591 1.00 0.00 H
+ATOM 509 2HG PRO A 31 -0.292 -4.362 -10.917 1.00 0.00 H
+ATOM 510 1HD PRO A 31 0.235 -4.154 -7.926 1.00 0.00 H
+ATOM 511 2HD PRO A 31 1.417 -4.148 -9.296 1.00 0.00 H
+ATOM 512 N SER A 32 -1.426 -0.891 -7.533 1.00 0.00 N
+ATOM 513 CA SER A 32 -2.148 -0.033 -6.601 1.00 0.00 C
+ATOM 514 C SER A 32 -2.096 1.425 -7.040 1.00 0.00 C
+ATOM 515 O SER A 32 -3.046 2.180 -6.834 1.00 0.00 O
+ATOM 516 CB SER A 32 -1.568 -0.172 -5.207 1.00 0.00 C
+ATOM 517 OG SER A 32 -1.674 -1.491 -4.748 1.00 0.00 O
+ATOM 518 H SER A 32 -0.696 -1.494 -7.182 1.00 0.00 H
+ATOM 519 HA SER A 32 -3.191 -0.353 -6.573 1.00 0.00 H
+ATOM 520 1HB SER A 32 -0.521 0.130 -5.217 1.00 0.00 H
+ATOM 521 2HB SER A 32 -2.094 0.496 -4.526 1.00 0.00 H
+ATOM 522 HG SER A 32 -0.891 -1.946 -5.066 1.00 0.00 H
+ATOM 523 N ALA A 33 -0.980 1.815 -7.647 1.00 0.00 N
+ATOM 524 CA ALA A 33 -0.779 3.197 -8.066 1.00 0.00 C
+ATOM 525 C ALA A 33 -1.724 3.571 -9.200 1.00 0.00 C
+ATOM 526 O ALA A 33 -2.181 4.711 -9.290 1.00 0.00 O
+ATOM 527 CB ALA A 33 0.666 3.417 -8.488 1.00 0.00 C
+ATOM 528 H ALA A 33 -0.252 1.137 -7.822 1.00 0.00 H
+ATOM 529 HA ALA A 33 -0.978 3.849 -7.215 1.00 0.00 H
+ATOM 530 1HB ALA A 33 0.801 4.454 -8.798 1.00 0.00 H
+ATOM 531 2HB ALA A 33 1.327 3.201 -7.648 1.00 0.00 H
+ATOM 532 3HB ALA A 33 0.908 2.756 -9.318 1.00 0.00 H
+ATOM 533 N ARG A 34 -2.015 2.605 -10.065 1.00 0.00 N
+ATOM 534 CA ARG A 34 -2.850 2.850 -11.235 1.00 0.00 C
+ATOM 535 C ARG A 34 -4.330 2.776 -10.880 1.00 0.00 C
+ATOM 536 O ARG A 34 -5.154 3.477 -11.468 1.00 0.00 O
+ATOM 537 CB ARG A 34 -2.544 1.840 -12.332 1.00 0.00 C
+ATOM 538 CG ARG A 34 -1.469 2.272 -13.317 1.00 0.00 C
+ATOM 539 CD ARG A 34 -0.117 1.844 -12.876 1.00 0.00 C
+ATOM 540 NE ARG A 34 0.019 0.397 -12.870 1.00 0.00 N
+ATOM 541 CZ ARG A 34 1.114 -0.267 -12.451 1.00 0.00 C
+ATOM 542 NH1 ARG A 34 2.157 0.399 -12.007 1.00 0.00 N
+ATOM 543 NH2 ARG A 34 1.139 -1.588 -12.485 1.00 0.00 N
+ATOM 544 H ARG A 34 -1.647 1.678 -9.909 1.00 0.00 H
+ATOM 545 HA ARG A 34 -2.631 3.848 -11.614 1.00 0.00 H
+ATOM 546 1HB ARG A 34 -2.222 0.902 -11.883 1.00 0.00 H
+ATOM 547 2HB ARG A 34 -3.451 1.636 -12.901 1.00 0.00 H
+ATOM 548 1HG ARG A 34 -1.669 1.827 -14.291 1.00 0.00 H
+ATOM 549 2HG ARG A 34 -1.473 3.359 -13.406 1.00 0.00 H
+ATOM 550 1HD ARG A 34 0.632 2.254 -13.552 1.00 0.00 H
+ATOM 551 2HD ARG A 34 0.068 2.208 -11.866 1.00 0.00 H
+ATOM 552 HE ARG A 34 -0.763 -0.150 -13.204 1.00 0.00 H
+ATOM 553 1HH1 ARG A 34 2.137 1.408 -11.981 1.00 0.00 H
+ATOM 554 2HH1 ARG A 34 2.977 -0.099 -11.693 1.00 0.00 H
+ATOM 555 1HH2 ARG A 34 0.337 -2.100 -12.826 1.00 0.00 H
+ATOM 556 2HH2 ARG A 34 1.959 -2.086 -12.171 1.00 0.00 H
+ATOM 557 N GLU A 35 -4.660 1.925 -9.915 1.00 0.00 N
+ATOM 558 CA GLU A 35 -6.019 1.848 -9.393 1.00 0.00 C
+ATOM 559 C GLU A 35 -6.404 3.130 -8.667 1.00 0.00 C
+ATOM 560 O GLU A 35 -7.546 3.583 -8.748 1.00 0.00 O
+ATOM 561 CB GLU A 35 -6.161 0.652 -8.449 1.00 0.00 C
+ATOM 562 CG GLU A 35 -6.090 -0.704 -9.136 1.00 0.00 C
+ATOM 563 CD GLU A 35 -6.199 -1.854 -8.173 1.00 0.00 C
+ATOM 564 OE1 GLU A 35 -6.201 -1.615 -6.990 1.00 0.00 O
+ATOM 565 OE2 GLU A 35 -6.281 -2.973 -8.623 1.00 0.00 O
+ATOM 566 H GLU A 35 -3.951 1.315 -9.533 1.00 0.00 H
+ATOM 567 HA GLU A 35 -6.703 1.702 -10.230 1.00 0.00 H
+ATOM 568 1HB GLU A 35 -5.374 0.688 -7.696 1.00 0.00 H
+ATOM 569 2HB GLU A 35 -7.116 0.713 -7.927 1.00 0.00 H
+ATOM 570 1HG GLU A 35 -6.899 -0.775 -9.862 1.00 0.00 H
+ATOM 571 2HG GLU A 35 -5.146 -0.776 -9.675 1.00 0.00 H
+ATOM 572 N PHE A 36 -5.444 3.712 -7.956 1.00 0.00 N
+ATOM 573 CA PHE A 36 -5.658 4.984 -7.275 1.00 0.00 C
+ATOM 574 C PHE A 36 -5.939 6.101 -8.272 1.00 0.00 C
+ATOM 575 O PHE A 36 -6.855 6.901 -8.080 1.00 0.00 O
+ATOM 576 CB PHE A 36 -4.439 5.347 -6.425 1.00 0.00 C
+ATOM 577 CG PHE A 36 -4.677 6.493 -5.483 1.00 0.00 C
+ATOM 578 CD1 PHE A 36 -5.024 6.262 -4.161 1.00 0.00 C
+ATOM 579 CD2 PHE A 36 -4.555 7.804 -5.918 1.00 0.00 C
+ATOM 580 CE1 PHE A 36 -5.243 7.316 -3.293 1.00 0.00 C
+ATOM 581 CE2 PHE A 36 -4.772 8.859 -5.054 1.00 0.00 C
+ATOM 582 CZ PHE A 36 -5.117 8.614 -3.740 1.00 0.00 C
+ATOM 583 H PHE A 36 -4.543 3.261 -7.884 1.00 0.00 H
+ATOM 584 HA PHE A 36 -6.518 4.881 -6.613 1.00 0.00 H
+ATOM 585 1HB PHE A 36 -4.135 4.481 -5.838 1.00 0.00 H
+ATOM 586 2HB PHE A 36 -3.607 5.609 -7.076 1.00 0.00 H
+ATOM 587 HD1 PHE A 36 -5.122 5.235 -3.807 1.00 0.00 H
+ATOM 588 HD2 PHE A 36 -4.283 7.997 -6.957 1.00 0.00 H
+ATOM 589 HE1 PHE A 36 -5.515 7.120 -2.257 1.00 0.00 H
+ATOM 590 HE2 PHE A 36 -4.672 9.885 -5.408 1.00 0.00 H
+ATOM 591 HZ PHE A 36 -5.290 9.445 -3.057 1.00 0.00 H
+ATOM 592 N LEU A 37 -5.146 6.151 -9.337 1.00 0.00 N
+ATOM 593 CA LEU A 37 -5.325 7.154 -10.379 1.00 0.00 C
+ATOM 594 C LEU A 37 -6.700 7.039 -11.025 1.00 0.00 C
+ATOM 595 O LEU A 37 -7.349 8.045 -11.311 1.00 0.00 O
+ATOM 596 CB LEU A 37 -4.237 7.006 -11.449 1.00 0.00 C
+ATOM 597 CG LEU A 37 -2.846 7.523 -11.060 1.00 0.00 C
+ATOM 598 CD1 LEU A 37 -1.816 7.016 -12.060 1.00 0.00 C
+ATOM 599 CD2 LEU A 37 -2.863 9.044 -11.016 1.00 0.00 C
+ATOM 600 H LEU A 37 -4.400 5.476 -9.426 1.00 0.00 H
+ATOM 601 HA LEU A 37 -5.233 8.143 -9.927 1.00 0.00 H
+ATOM 602 1HB LEU A 37 -4.139 5.952 -11.702 1.00 0.00 H
+ATOM 603 2HB LEU A 37 -4.552 7.545 -12.343 1.00 0.00 H
+ATOM 604 HG LEU A 37 -2.575 7.135 -10.077 1.00 0.00 H
+ATOM 605 1HD1 LEU A 37 -0.828 7.383 -11.783 1.00 0.00 H
+ATOM 606 2HD1 LEU A 37 -1.812 5.926 -12.057 1.00 0.00 H
+ATOM 607 3HD1 LEU A 37 -2.070 7.376 -13.057 1.00 0.00 H
+ATOM 608 1HD2 LEU A 37 -1.875 9.411 -10.738 1.00 0.00 H
+ATOM 609 2HD2 LEU A 37 -3.132 9.433 -11.998 1.00 0.00 H
+ATOM 610 3HD2 LEU A 37 -3.595 9.379 -10.280 1.00 0.00 H
+ATOM 611 N LYS A 38 -7.140 5.805 -11.252 1.00 0.00 N
+ATOM 612 CA LYS A 38 -8.475 5.553 -11.780 1.00 0.00 C
+ATOM 613 C LYS A 38 -9.545 6.173 -10.891 1.00 0.00 C
+ATOM 614 O LYS A 38 -10.411 6.909 -11.365 1.00 0.00 O
+ATOM 615 CB LYS A 38 -8.718 4.050 -11.927 1.00 0.00 C
+ATOM 616 CG LYS A 38 -10.065 3.688 -12.537 1.00 0.00 C
+ATOM 617 CD LYS A 38 -10.214 2.181 -12.692 1.00 0.00 C
+ATOM 618 CE LYS A 38 -11.458 1.827 -13.494 1.00 0.00 C
+ATOM 619 NZ LYS A 38 -12.706 2.061 -12.717 1.00 0.00 N
+ATOM 620 H LYS A 38 -6.533 5.023 -11.054 1.00 0.00 H
+ATOM 621 HA LYS A 38 -8.544 5.999 -12.773 1.00 0.00 H
+ATOM 622 1HB LYS A 38 -7.939 3.615 -12.553 1.00 0.00 H
+ATOM 623 2HB LYS A 38 -8.656 3.574 -10.948 1.00 0.00 H
+ATOM 624 1HG LYS A 38 -10.867 4.060 -11.898 1.00 0.00 H
+ATOM 625 2HG LYS A 38 -10.158 4.156 -13.517 1.00 0.00 H
+ATOM 626 1HD LYS A 38 -9.337 1.779 -13.201 1.00 0.00 H
+ATOM 627 2HD LYS A 38 -10.285 1.720 -11.707 1.00 0.00 H
+ATOM 628 1HE LYS A 38 -11.490 2.429 -14.400 1.00 0.00 H
+ATOM 629 2HE LYS A 38 -11.417 0.777 -13.783 1.00 0.00 H
+ATOM 630 1HZ LYS A 38 -13.506 1.814 -13.283 1.00 0.00 H
+ATOM 631 2HZ LYS A 38 -12.696 1.493 -11.882 1.00 0.00 H
+ATOM 632 3HZ LYS A 38 -12.765 3.036 -12.460 1.00 0.00 H
+ATOM 633 N ARG A 39 -9.481 5.871 -9.598 1.00 0.00 N
+ATOM 634 CA ARG A 39 -10.434 6.412 -8.637 1.00 0.00 C
+ATOM 635 C ARG A 39 -10.295 7.924 -8.514 1.00 0.00 C
+ATOM 636 O ARG A 39 -11.287 8.638 -8.368 1.00 0.00 O
+ATOM 637 CB ARG A 39 -10.235 5.774 -7.269 1.00 0.00 C
+ATOM 638 CG ARG A 39 -10.648 4.314 -7.178 1.00 0.00 C
+ATOM 639 CD ARG A 39 -10.718 3.850 -5.769 1.00 0.00 C
+ATOM 640 NE ARG A 39 -9.425 3.930 -5.107 1.00 0.00 N
+ATOM 641 CZ ARG A 39 -8.480 2.971 -5.156 1.00 0.00 C
+ATOM 642 NH1 ARG A 39 -8.698 1.868 -5.837 1.00 0.00 N
+ATOM 643 NH2 ARG A 39 -7.335 3.139 -4.518 1.00 0.00 N
+ATOM 644 H ARG A 39 -8.753 5.251 -9.274 1.00 0.00 H
+ATOM 645 HA ARG A 39 -11.442 6.180 -8.981 1.00 0.00 H
+ATOM 646 1HB ARG A 39 -9.185 5.838 -6.988 1.00 0.00 H
+ATOM 647 2HB ARG A 39 -10.807 6.326 -6.524 1.00 0.00 H
+ATOM 648 1HG ARG A 39 -11.632 4.185 -7.630 1.00 0.00 H
+ATOM 649 2HG ARG A 39 -9.922 3.696 -7.707 1.00 0.00 H
+ATOM 650 1HD ARG A 39 -11.422 4.470 -5.216 1.00 0.00 H
+ATOM 651 2HD ARG A 39 -11.050 2.813 -5.743 1.00 0.00 H
+ATOM 652 HE ARG A 39 -9.221 4.764 -4.573 1.00 0.00 H
+ATOM 653 1HH1 ARG A 39 -9.573 1.739 -6.324 1.00 0.00 H
+ATOM 654 2HH1 ARG A 39 -7.989 1.149 -5.874 1.00 0.00 H
+ATOM 655 1HH2 ARG A 39 -7.167 3.987 -3.994 1.00 0.00 H
+ATOM 656 2HH2 ARG A 39 -6.627 2.421 -4.555 1.00 0.00 H
+ATOM 657 N TYR A 40 -9.058 8.406 -8.574 1.00 0.00 N
+ATOM 658 CA TYR A 40 -8.787 9.835 -8.473 1.00 0.00 C
+ATOM 659 C TYR A 40 -9.500 10.610 -9.573 1.00 0.00 C
+ATOM 660 O TYR A 40 -10.155 11.619 -9.310 1.00 0.00 O
+ATOM 661 CB TYR A 40 -7.281 10.099 -8.528 1.00 0.00 C
+ATOM 662 CG TYR A 40 -6.918 11.568 -8.524 1.00 0.00 C
+ATOM 663 CD1 TYR A 40 -6.887 12.271 -7.329 1.00 0.00 C
+ATOM 664 CD2 TYR A 40 -6.618 12.211 -9.715 1.00 0.00 C
+ATOM 665 CE1 TYR A 40 -6.556 13.612 -7.325 1.00 0.00 C
+ATOM 666 CE2 TYR A 40 -6.287 13.552 -9.711 1.00 0.00 C
+ATOM 667 CZ TYR A 40 -6.255 14.252 -8.522 1.00 0.00 C
+ATOM 668 OH TYR A 40 -5.926 15.588 -8.518 1.00 0.00 O
+ATOM 669 H TYR A 40 -8.286 7.766 -8.693 1.00 0.00 H
+ATOM 670 HA TYR A 40 -9.148 10.188 -7.506 1.00 0.00 H
+ATOM 671 1HB TYR A 40 -6.796 9.627 -7.672 1.00 0.00 H
+ATOM 672 2HB TYR A 40 -6.865 9.649 -9.429 1.00 0.00 H
+ATOM 673 HD1 TYR A 40 -7.123 11.765 -6.392 1.00 0.00 H
+ATOM 674 HD2 TYR A 40 -6.643 11.659 -10.654 1.00 0.00 H
+ATOM 675 HE1 TYR A 40 -6.531 14.165 -6.386 1.00 0.00 H
+ATOM 676 HE2 TYR A 40 -6.051 14.058 -10.648 1.00 0.00 H
+ATOM 677 HH TYR A 40 -5.647 15.850 -9.399 1.00 0.00 H
+ATOM 678 N ARG A 41 -9.369 10.133 -10.806 1.00 0.00 N
+ATOM 679 CA ARG A 41 -9.991 10.788 -11.951 1.00 0.00 C
+ATOM 680 C ARG A 41 -11.511 10.740 -11.854 1.00 0.00 C
+ATOM 681 O ARG A 41 -12.195 11.704 -12.199 1.00 0.00 O
+ATOM 682 CB ARG A 41 -9.548 10.130 -13.250 1.00 0.00 C
+ATOM 683 CG ARG A 41 -8.104 10.402 -13.643 1.00 0.00 C
+ATOM 684 CD ARG A 41 -7.841 10.027 -15.056 1.00 0.00 C
+ATOM 685 NE ARG A 41 -8.064 8.610 -15.293 1.00 0.00 N
+ATOM 686 CZ ARG A 41 -7.125 7.654 -15.154 1.00 0.00 C
+ATOM 687 NH1 ARG A 41 -5.907 7.978 -14.781 1.00 0.00 N
+ATOM 688 NH2 ARG A 41 -7.429 6.390 -15.393 1.00 0.00 N
+ATOM 689 H ARG A 41 -8.825 9.295 -10.954 1.00 0.00 H
+ATOM 690 HA ARG A 41 -9.674 11.831 -11.967 1.00 0.00 H
+ATOM 691 1HB ARG A 41 -9.670 9.051 -13.171 1.00 0.00 H
+ATOM 692 2HB ARG A 41 -10.182 10.474 -14.066 1.00 0.00 H
+ATOM 693 1HG ARG A 41 -7.888 11.464 -13.524 1.00 0.00 H
+ATOM 694 2HG ARG A 41 -7.437 9.821 -13.004 1.00 0.00 H
+ATOM 695 1HD ARG A 41 -8.504 10.591 -15.712 1.00 0.00 H
+ATOM 696 2HD ARG A 41 -6.805 10.255 -15.306 1.00 0.00 H
+ATOM 697 HE ARG A 41 -8.990 8.322 -15.581 1.00 0.00 H
+ATOM 698 1HH1 ARG A 41 -5.675 8.944 -14.598 1.00 0.00 H
+ATOM 699 2HH1 ARG A 41 -5.204 7.261 -14.677 1.00 0.00 H
+ATOM 700 1HH2 ARG A 41 -8.366 6.141 -15.680 1.00 0.00 H
+ATOM 701 2HH2 ARG A 41 -6.726 5.674 -15.289 1.00 0.00 H
+ATOM 702 N GLU A 42 -12.034 9.613 -11.383 1.00 0.00 N
+ATOM 703 CA GLU A 42 -13.475 9.428 -11.264 1.00 0.00 C
+ATOM 704 C GLU A 42 -14.061 10.344 -10.197 1.00 0.00 C
+ATOM 705 O GLU A 42 -15.165 10.866 -10.352 1.00 0.00 O
+ATOM 706 CB GLU A 42 -13.800 7.970 -10.933 1.00 0.00 C
+ATOM 707 CG GLU A 42 -13.550 6.995 -12.075 1.00 0.00 C
+ATOM 708 CD GLU A 42 -13.607 5.557 -11.640 1.00 0.00 C
+ATOM 709 OE1 GLU A 42 -13.764 5.317 -10.468 1.00 0.00 O
+ATOM 710 OE2 GLU A 42 -13.492 4.698 -12.482 1.00 0.00 O
+ATOM 711 H GLU A 42 -11.417 8.865 -11.101 1.00 0.00 H
+ATOM 712 HA GLU A 42 -13.935 9.669 -12.223 1.00 0.00 H
+ATOM 713 1HB GLU A 42 -13.201 7.648 -10.081 1.00 0.00 H
+ATOM 714 2HB GLU A 42 -14.849 7.887 -10.647 1.00 0.00 H
+ATOM 715 1HG GLU A 42 -14.299 7.158 -12.850 1.00 0.00 H
+ATOM 716 2HG GLU A 42 -12.571 7.201 -12.507 1.00 0.00 H
+ATOM 717 N LYS A 43 -13.316 10.535 -9.114 1.00 0.00 N
+ATOM 718 CA LYS A 43 -13.781 11.349 -7.998 1.00 0.00 C
+ATOM 719 C LYS A 43 -14.226 12.727 -8.469 1.00 0.00 C
+ATOM 720 O LYS A 43 -13.710 13.253 -9.455 1.00 0.00 O
+ATOM 721 OXT LYS A 43 -15.090 13.314 -7.878 1.00 0.00 O
+ATOM 722 CB LYS A 43 -12.685 11.484 -6.939 1.00 0.00 C
+ATOM 723 CG LYS A 43 -13.103 12.257 -5.696 1.00 0.00 C
+ATOM 724 CD LYS A 43 -11.991 12.277 -4.658 1.00 0.00 C
+ATOM 725 CE LYS A 43 -12.413 13.035 -3.408 1.00 0.00 C
+ATOM 726 NZ LYS A 43 -11.334 13.062 -2.383 1.00 0.00 N
+ATOM 727 H LYS A 43 -12.403 10.105 -9.063 1.00 0.00 H
+ATOM 728 HA LYS A 43 -14.633 10.849 -7.536 1.00 0.00 H
+ATOM 729 1HB LYS A 43 -12.361 10.492 -6.623 1.00 0.00 H
+ATOM 730 2HB LYS A 43 -11.821 11.988 -7.372 1.00 0.00 H
+ATOM 731 1HG LYS A 43 -13.350 13.283 -5.971 1.00 0.00 H
+ATOM 732 2HG LYS A 43 -13.988 11.794 -5.260 1.00 0.00 H
+ATOM 733 1HD LYS A 43 -11.732 11.253 -4.382 1.00 0.00 H
+ATOM 734 2HD LYS A 43 -11.108 12.755 -5.080 1.00 0.00 H
+ATOM 735 1HE LYS A 43 -12.671 14.059 -3.673 1.00 0.00 H
+ATOM 736 2HE LYS A 43 -13.295 12.562 -2.976 1.00 0.00 H
+ATOM 737 1HZ LYS A 43 -11.653 13.573 -1.571 1.00 0.00 H
+ATOM 738 2HZ LYS A 43 -11.100 12.117 -2.115 1.00 0.00 H
+ATOM 739 3HZ LYS A 43 -10.517 13.516 -2.766 1.00 0.00 H
+TER
+##Begin comments##
+BINARY SILENTFILE
+DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLHHHHHHHHHHHHL
+PHI 0,-64.0487,-69.691,-61.3238,-62.3162,-60.9426,-63.1494,-62.1075,-62.2364,-67.7939,-67.3026,-75.5832,-70.1763,-72.3767,-96.3582,-88.3245,-128.15,-64.1179,-58.5515,-64.5999,-62.6042,-62.3519,-61.0325,-66.8147,-65.9886,-79.2453,-67.7229,-101.724,-77.6143,-64.5308,-57.3048,-54.7175,-67.8511,-83.1476,-66.1878,-63.6253,-60.3942,-56.7527,-65.1904,-59.0264,-64.9602,-67.7655,-53.1034
+PSI 179.999,-37.0165,-41.4763,-40.0303,-39.5629,-43.3861,-40.9637,-44.2187,-40.589,-40.9913,-37.5128,-43.9824,139.105,-10.3236,-4.79944,156.379,159.379,-31.0293,-43.2496,-40.1975,-45.0536,-40.1419,-40.0845,-39.7382,-35.1838,-37.6684,-44.6927,144.889,-12.1512,113.686,-23.6321,-33.845,-34.2379,-32.2902,-37.3636,-45.2855,-40.5554,-51.8235,-37.5269,-48.1644,-38.8972,-37.2745,0
+##End comments##
+
+AlaCount 3
+AverageDegree 14.674
+BuriedUnsatHbond 3
+Buried_non_polar_SASA_per_res 42.243
+CavityVolume 6.16
+CoreAverageDegree 19.8
+CoreResidueCount 10
+ExposeCoreHydrophobicsPerCoreResidue 18.416
+ExposeCoreHydrophobicsSASA 184.159
+ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent 10.126
+ExposedHydrophobics_on_TotalSASAPercent 5.324
+HasCoreResidueNum 12
+MaxDistanceToToMassCenter 6.672
+PackStat 0.661
+Rg 9.831
+SSShapeComplementarity 0.798
+ScorePerResFilter -1.452
+driftRMSD 0.622
+frac_helix 76.744
+frac_loop 23.256
+frac_sheet 0
+n_hydrophobic 12
+nres_helix 33
+nres_loop 10
+nres_sheet 0
+nres_total 43
+percent_core 0.279
+score -99.049
+ss_mismatch_probability 0.275
+
diff --git a/10_Analysis/data/design_decoy.fasta b/10_Analysis/data/design_decoy.fasta
new file mode 100644
index 0000000..e476645
--- /dev/null
+++ b/10_Analysis/data/design_decoy.fasta
@@ -0,0 +1,10 @@
+>EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb:A
+TEVEEILKRAAKKPDHKFREIFRELIERNLANELAKQILKELG
+>EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb:A
+SVEEIVKKMIKKASGASREQIKKLAEKIPGVDERVIKMAERLI
+>EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb:A
+SEEEKEFLKRVKDKDPELAKKMQKLLENGYASIEQLQKQLEKR
+>EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb:A
+DPKTEELIKQYQRKERSEEMMEELRKKANNRNKEMIKKARKDG
+>EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb:A
+SEIEERLEKLARSETGTEEQMRQLAKKYEDPSAREFLKRYREK
diff --git a/10_Analysis/data/design_result.silent b/10_Analysis/data/design_result.silent
new file mode 100644
index 0000000..6ffcb2c
--- /dev/null
+++ b/10_Analysis/data/design_result.silent
@@ -0,0 +1,510 @@
+SEQUENCE: SHIEEIFKELQRQNASNLREFVEEAWRRGEMSEELYKKMKKIV
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -115.348 -248.220 23.856 204.601 -19.273 8.070 17.321 99.223 -105.788 -0.548 -3.107 -79.384 -21.300 0.000 -29.475 -3.098 -1.920 -9.662 0.000 1.903 3.391 25.605 52.537 -10.626 2.028 -18.975 -2.507 2.000 13.837 1.000 57.472 0.000 20.333 9.000 10.741 96.673 5.426 2.851 11.000 7.553 0.616 9.780 0.817 -1.749 1.032 74.419 25.581 0.000 16.000 0.000 32.000 11.000 0.000 43.000 0.256 0.302 0.0,-66.61703742125313,-66.66204304586961,-64.2627475879439,-66.44318693590479,-65.27866717342658,-55.47564223945256,-60.55650264141377,-64.22576792577901,-64.02494083109615,-66.58947909877377,-63.445941933853376,-82.68156985834482,57.87345390963645,-67.16285450680006,-89.02662257634594,-89.709039177475,-77.08106174109108,-69.61483090932575,-65.15474559676444,-57.74476095018723,-63.16713300307241,-70.47268396961864,-68.51553046099137,-64.51032489503767,-63.496345967103316,-64.2865806993615,-68.00154858290396,101.8111743976923,-94.05687803119253,-83.05266794048505,-79.29649799606862,-63.645260272174184,-68.98036302624823,-70.56949099309887,-60.852820372348376,-65.40300963386642,-60.40027121280268,-69.43870153142986,-60.722972493878466,-72.37369148915171,-66.88119749195621,-158.01695932191876 -15.270410929420306,-27.453350620107514,-43.343499065683496,-41.50737623458657,-38.729269075765906,-43.740823999394834,-47.811348775724895,-39.95352552646714,-40.32243118212867,-35.90586187723031,-43.04035388824186,-33.76244729550682,1.3499443829536215,43.743951291249864,141.23579948572367,-28.018696371231332,49.3329196277017,-32.92968480556337,-37.82091957363441,-39.94325194788841,-49.386346222146415,-45.9522658156121,-37.233887342561125,-44.33228429648577,-33.859499865924036,-48.468920043307065,-39.5520664499651,-34.27235262288263,19.10615110194125,-26.542008131567737,130.03494579330095,166.1985356807009,-40.07836591289924,-44.039394152274824,-36.271535277646635,-51.21028563456098,-41.640579618357776,-51.18460949128726,-33.73971300615915,-36.61614548071734,-36.54068430712844,-45.00943197786171,0.0 LHHHHHHHHHHHLLLLLHHHHHHHHHHHLLLLHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032157.pdb
+REMARK DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHHLLLLHHHHHHHHHHL
+REMARK PHI 0,-66.617,-66.662,-64.2627,-66.4432,-65.2787,-55.4756,-60.5565,-64.2258,-64.0249,-66.5895,-63.4459,-82.6816,57.8735,-67.1629,-89.0266,-89.709,-77.0811,-69.6148,-65.1547,-57.7448,-63.1671,-70.4727,-68.5155,-64.5103,-63.4963,-64.2866,-68.0015,101.811,-94.0569,-83.0527,-79.2965,-63.6453,-68.9804,-70.5695,-60.8528,-65.403,-60.4003,-69.4387,-60.723,-72.3737,-66.8812,-158.017
+REMARK PSI -15.2704,-27.4534,-43.3435,-41.5074,-38.7293,-43.7408,-47.8113,-39.9535,-40.3224,-35.9059,-43.0404,-33.7624,1.34994,43.744,141.236,-28.0187,49.3329,-32.9297,-37.8209,-39.9433,-49.3863,-45.9523,-37.2339,-44.3323,-33.8595,-48.4689,-39.5521,-34.2724,19.1062,-26.542,130.035,166.199,-40.0784,-44.0394,-36.2715,-51.2103,-41.6406,-51.1846,-33.7397,-36.6161,-36.5407,-45.0094,0
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+SEQUENCE: SVEEIVKKMIKKASGASREQIKKLAEKIPGVDERVIKMAERLI
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -111.579 -239.381 25.203 188.087 -15.924 10.248 12.333 102.075 -103.115 -0.478 -2.875 -75.661 -15.423 0.129 -32.457 0.000 -5.863 -1.362 0.000 1.902 3.871 34.889 25.926 -10.035 1.804 -14.219 -1.257 4.000 14.953 2.000 59.557 0.000 19.929 14.000 16.135 225.897 12.642 6.978 15.000 6.397 0.657 9.298 0.795 -1.696 0.603 72.093 27.907 0.000 18.000 4.000 31.000 12.000 0.000 43.000 0.349 0.267 0.0,-64.3519467853161,-63.418086930463815,-65.56673176992616,-62.937028353387916,-64.84600479810152,-60.46768276861964,-64.99142204050862,-59.049636840404,-63.18631177283314,-58.85645964636771,-64.35015465192834,-97.54005666361657,-52.86373021885636,100.75694461007625,-71.36374889851632,-72.82703291356235,-61.32485242033397,-64.54206754213402,-64.50010229369639,-64.6732629210743,-57.12234914566474,-61.09981426241765,-64.47279134871839,-62.10672300145529,-66.14427121037937,-66.00261452846901,-68.06192326827916,-69.68543652922278,91.85104777792408,-81.18992895090004,-109.41994732519733,-61.87846575537298,-61.974640237969076,-65.06401434230709,-62.69618238650833,-58.63360441093861,-57.32725924615807,-58.089019700406446,-63.92901632178451,-78.36838629831337,-67.86420289769583,-89.24805136111644 135.29049056466624,-44.3565372650317,-39.44213431209112,-39.813270032614355,-44.34201877339164,-43.534511504796356,-41.92051977907319,-40.62558720133791,-44.1940958663573,-43.6038936284092,-48.88955537867602,-34.80524214505524,18.73689667446474,134.23485792624905,-14.193883138670655,156.87051590470855,163.20839740726998,-37.125238128619756,-41.06313289927764,-43.28759722099899,-41.801725412414605,-48.76218444761745,-43.068821843732735,-40.55155304541878,-38.54489931440367,-36.85904541676932,-35.12446892323645,125.3914543230007,145.65503193618588,-8.208151559667714,126.69306929503253,-174.3708053732862,-38.44431561898169,-46.07858141526455,-37.39032838784732,-45.66377989383726,-40.39137357798858,-48.76846703504008,-38.57259568994066,-33.276471026442586,-34.93916532435953,-38.69601513404585,0.0 LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb
+REMARK DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL
+REMARK PHI 0,-64.3519,-63.4181,-65.5667,-62.937,-64.846,-60.4677,-64.9914,-59.0496,-63.1863,-58.8565,-64.3502,-97.5401,-52.8637,100.757,-71.3637,-72.827,-61.3249,-64.5421,-64.5001,-64.6733,-57.1223,-61.0998,-64.4728,-62.1067,-66.1443,-66.0026,-68.0619,-69.6854,91.851,-81.1899,-109.42,-61.8785,-61.9746,-65.064,-62.6962,-58.6336,-57.3273,-58.089,-63.929,-78.3684,-67.8642,-89.2481
+REMARK PSI 135.29,-44.3565,-39.4421,-39.8133,-44.342,-43.5345,-41.9205,-40.6256,-44.1941,-43.6039,-48.8896,-34.8052,18.7369,134.235,-14.1939,156.871,163.208,-37.1252,-41.0631,-43.2876,-41.8017,-48.7622,-43.0688,-40.5516,-38.5449,-36.859,-35.1245,125.391,145.655,-8.20815,126.693,-174.371,-38.4443,-46.0786,-37.3903,-45.6638,-40.3914,-48.7685,-38.5726,-33.2765,-34.9392,-38.696,0
+ANNOTATED_SEQUENCE: S[SER:NtermProteinFull]VEEIVKKMIKKASGASREQIKKLAEKIPGVDERVIKMAERLI[ILE:CtermProteinFull] EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb
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+SEQUENCE: SEEEKEFLKRVKDKDPELAKKMQKLLENGYASIEQLQKQLEKR
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -107.145 -245.738 23.800 223.426 -17.090 6.658 15.022 112.316 -111.729 -0.325 -2.326 -89.092 -14.958 0.009 -31.630 -0.853 -5.588 -7.279 0.000 2.292 4.512 28.181 49.139 -9.196 1.209 -38.106 0.202 2.000 13.465 0.000 45.790 16.368 19.625 8.000 10.509 84.069 4.454 2.384 7.000 7.560 0.616 9.814 0.811 -1.753 0.801 76.744 23.256 0.000 13.000 1.000 33.000 10.000 0.000 43.000 0.163 0.281 0.0,-65.67988795578451,-63.810354341309825,-66.02631367384691,-62.52707616603043,-63.14156238435789,-57.622158107998445,-67.00528688950165,-62.262488202654865,-56.67415089889363,-75.70994045838138,-57.82533593806999,-59.59509360861571,-107.55320642586815,-158.6619894605935,-60.21877818562311,-77.72389500225836,-66.73588150093684,-58.28927125331593,-63.51405894541939,-64.2112927310839,-69.99061840234413,-63.167751675530006,-61.341939555083336,-62.479825943586405,-64.86060162547874,-66.09188262454094,-74.38667346389701,76.63920879829728,-63.18352223795158,-159.69209623128305,-71.53124764266492,-68.15041659663433,-67.36767207528698,-69.8458102064516,-66.3839607671189,-61.57783095416169,-62.74107723116324,-63.47241380519334,-64.46457303636892,-76.13233073851131,-73.17889096830872,-78.7192332015827 169.09647837628498,-38.48610986516323,-37.445295306603136,-40.034129454495364,-41.834791793462465,-41.06188007692538,-51.58163334308966,-34.94163317775788,-44.66379813137101,-38.533143540345364,-45.42500838170542,-36.897986758152186,-23.396858595182916,-35.92803772141464,95.48536968252863,-25.673874565266583,-37.54831860695169,-38.97888818191979,-41.1154614010036,-41.7877290810818,-41.08227751004935,-32.58560008045613,-40.321241605636544,-43.801834336452735,-41.654211107244144,-48.31989573685587,-34.35399011170958,-7.225226659148367,25.0225457801468,-48.73117370127896,160.46243708095133,162.4646737504978,-26.420342328218975,-42.254404777018586,-41.76209955541568,-38.34376695162168,-43.453214025532574,-41.121342661767876,-38.10191093818169,-37.77791301457546,-35.21126264156708,-38.34464722698572,0.0 LHHHHHHHHHHHLLLHHHHHHHHHHHHLLLLLHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb
+REMARK DSSP LHHHHHHHHHHHLLLHHHHHHHHHHHHLLLLLHHHHHHHHHHL
+REMARK PHI 0,-65.6799,-63.8104,-66.0263,-62.5271,-63.1416,-57.6222,-67.0053,-62.2625,-56.6742,-75.7099,-57.8253,-59.5951,-107.553,-158.662,-60.2188,-77.7239,-66.7359,-58.2893,-63.5141,-64.2113,-69.9906,-63.1678,-61.3419,-62.4798,-64.8606,-66.0919,-74.3867,76.6392,-63.1835,-159.692,-71.5312,-68.1504,-67.3677,-69.8458,-66.384,-61.5778,-62.7411,-63.4724,-64.4646,-76.1323,-73.1789,-78.7192
+REMARK PSI 169.096,-38.4861,-37.4453,-40.0341,-41.8348,-41.0619,-51.5816,-34.9416,-44.6638,-38.5331,-45.425,-36.898,-23.3969,-35.928,95.4854,-25.6739,-37.5483,-38.9789,-41.1155,-41.7877,-41.0823,-32.5856,-40.3212,-43.8018,-41.6542,-48.3199,-34.354,-7.22523,25.0225,-48.7312,160.462,162.465,-26.4203,-42.2544,-41.7621,-38.3438,-43.4532,-41.1213,-38.1019,-37.7779,-35.2113,-38.3446,0
+ANNOTATED_SEQUENCE: S[SER:NtermProteinFull]EEEKEFLKRVKDKDPELAKKMQKLLENGYASIEQLQKQLEKR[ARG:CtermProteinFull] EHPC100_job_77_hhh_11.5.10.5.10_20201122032428.pdb
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+SEQUENCE: SEIEELAKRLLKDSRGDLRKLLEELQRNNQPNYQYVEHLLRKY
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -116.810 -243.867 21.962 204.181 -19.960 7.784 15.809 99.764 -105.959 -0.406 -2.789 -77.293 -14.347 0.073 -28.644 -1.350 -3.241 -9.931 0.000 1.626 3.720 27.608 48.243 -11.540 1.222 -29.915 0.441 1.000 14.395 2.000 51.116 0.104 20.364 11.000 20.387 224.252 12.598 6.411 11.000 6.394 0.647 10.024 0.782 -1.791 1.020 72.093 27.907 0.000 15.000 1.000 31.000 12.000 0.000 43.000 0.256 0.263 0.0,-60.41701762419428,-62.675160123107226,-70.10098078315754,-64.88399338823248,-69.65684202319159,-59.603332249509705,-64.4636382929172,-66.62407160551683,-68.01143557705103,-67.5380429291549,-73.80987013133573,-90.85796234297753,-69.94094913557602,-79.81313507238924,-94.81372016085895,-151.03575484796272,-65.63837798853463,-61.132050356335164,-63.47669383079445,-64.8374521706156,-58.34859948618523,-62.7030418816911,-66.88012705092636,-63.3090138766452,-66.67452906083983,-63.007572751935776,-90.96756434017595,51.691141337611676,-85.84308565212628,-74.69164821856461,65.50240324414355,-66.40320359459368,-65.30457235609691,-61.29426610974433,-65.92025799759239,-61.072022534417314,-59.010936427298354,-65.33854952588165,-62.64194002032411,-79.04483017805029,-70.18726567742983,-100.86203701342042 86.74988983051828,-35.43574203071179,-44.264025830871745,-40.264730299547274,-42.00316272215953,-43.08710072713454,-39.0367254939542,-41.58783205986145,-38.48062529563729,-34.43132537612126,-44.539483318275025,-40.968118195248366,105.54981797603179,-8.611823088569498,-12.731158985482608,188.41102386615586,117.68107209112323,-31.37530121369642,-41.74732274223366,-41.378424084585916,-45.07194621269743,-48.39564053902063,-39.383863140665454,-43.82211734772339,-38.140323684482496,-43.66674349744812,-36.128816745921185,8.596738620396577,44.30053003129075,149.508606440333,157.78686210264664,18.797113052684725,-21.577057865304276,-23.03697033590036,-45.3551632047944,-42.054520962554825,-39.58632838781002,-49.411982585802136,-38.503412389800715,-43.68088267743077,-35.701322994965885,-45.27853349148709,0.0 LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb
+REMARK DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL
+REMARK PHI 0,-60.417,-62.6752,-70.101,-64.884,-69.6568,-59.6033,-64.4636,-66.6241,-68.0114,-67.538,-73.8099,-90.858,-69.9409,-79.8131,-94.8137,-151.036,-65.6384,-61.1321,-63.4767,-64.8375,-58.3486,-62.703,-66.8801,-63.309,-66.6745,-63.0076,-90.9676,51.6911,-85.8431,-74.6916,65.5024,-66.4032,-65.3046,-61.2943,-65.9203,-61.072,-59.0109,-65.3385,-62.6419,-79.0448,-70.1873,-100.862
+REMARK PSI 86.7499,-35.4357,-44.264,-40.2647,-42.0032,-43.0871,-39.0367,-41.5878,-38.4806,-34.4313,-44.5395,-40.9681,105.55,-8.61182,-12.7312,188.411,117.681,-31.3753,-41.7473,-41.3784,-45.0719,-48.3956,-39.3839,-43.8221,-38.1403,-43.6667,-36.1288,8.59674,44.3005,149.509,157.787,18.7971,-21.5771,-23.037,-45.3552,-42.0545,-39.5863,-49.412,-38.5034,-43.6809,-35.7013,-45.2785,0
+ANNOTATED_SEQUENCE: S[SER:NtermProteinFull]EIEELAKRLLKDSRGDLRKLLEELQRNNQPNYQYVEH[HIS_D]LLRKY[TYR:CtermProteinFull] EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb
+LAAAAAAAAAAAAAAAAH/pu/AAAAAAAAAAA7DJAAZCy1+DAAAAAVtrEA1qO+/T6gc4vTCX//syHB9bjHq5vvvIz/MogGA8hhS5v8iuq+SPUx9r9XUQp8iuq+SPUx7Ta8D1P8iuq+SPUx7Ta8D1vY6u5/giZA87aje2PUiCz/MXMX6bREeAw87DRApRvu87PZ65vNru//gK9gAsw5d/v EHPC100_job_77_hhh_11.5.10.5.10_20201122032600.pdb
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+SEQUENCE: TPLDEEARRAFQRNSSTAQELLKQLERDSRADPRVIEELRRLK
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -121.064 -244.426 29.031 221.440 -17.579 6.851 14.169 107.873 -114.030 -0.525 -4.145 -87.002 -11.852 0.190 -30.554 -1.082 -7.131 -7.511 0.000 0.716 4.252 24.644 40.330 -9.574 6.467 -38.104 -3.513 4.000 15.093 2.000 44.254 0.000 20.909 11.000 15.328 168.603 9.735 5.141 11.000 6.845 0.672 9.488 0.780 -1.913 0.743 72.093 27.907 0.000 13.000 1.000 31.000 12.000 0.000 43.000 0.256 0.287 0.0,-51.87091799368676,-64.6619591856215,-67.61696240054658,-68.15975572226549,-71.10474117445663,-62.46121453509447,-62.61452674806745,-67.89731257742798,-62.55881781233866,-68.5433416761228,-63.82896994855344,-85.80341139138933,56.238664341087066,-69.16292169749866,-69.21465142956552,-101.90658947165075,-60.46202918505737,-69.99063157805487,-65.54272678848187,-66.10689404058697,-60.979556832525034,-59.496566229136114,-66.39828838949327,-66.26009193783216,-65.49731637112234,-73.73102319912029,-73.8132209120679,-69.16042616655248,-86.52764131526719,-68.9760938350884,-77.84712300540829,-52.324042504390604,-60.13170929156555,-75.09475589765687,-57.594179672415535,-62.4475439910981,-61.26251605252609,-62.806547038625695,-63.269954706990006,-70.35241607797168,-64.62569574424363,66.20302967140654 158.8579996719137,-30.483444726833095,-32.24966634417741,-40.66226199826478,-41.84621438723774,-39.879622281899074,-42.469617160418764,-41.46906769299146,-39.146936718130824,-41.31672044189506,-41.86360955382718,-34.57961066131456,-1.7720340892158377,42.32001699982879,143.9117036570796,-15.216632004172949,5.741726509719791,-39.11750978556931,-33.1278924424146,-39.1048546699204,-39.857079619737355,-45.89146191163548,-39.08065643394893,-37.76813369687862,-36.68836023879931,-38.39662212288831,-37.722542188143855,113.4728854094521,-14.16973576661007,-9.542043474613491,147.16288667981735,114.8157539937289,-34.792142714240384,-40.00108152122428,-40.073499268994205,-43.91745967870654,-43.187365836602496,-44.357076094918824,-39.699446516716655,-37.37637887519146,-37.74235305659722,-40.76796426813538,0.0 LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb
+REMARK DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL
+REMARK PHI 0,-51.8709,-64.662,-67.617,-68.1598,-71.1047,-62.4612,-62.6145,-67.8973,-62.5588,-68.5433,-63.829,-85.8034,56.2387,-69.1629,-69.2147,-101.907,-60.462,-69.9906,-65.5427,-66.1069,-60.9796,-59.4966,-66.3983,-66.2601,-65.4973,-73.731,-73.8132,-69.1604,-86.5276,-68.9761,-77.8471,-52.324,-60.1317,-75.0948,-57.5942,-62.4475,-61.2625,-62.8065,-63.27,-70.3524,-64.6257,66.203
+REMARK PSI 158.858,-30.4834,-32.2497,-40.6623,-41.8462,-39.8796,-42.4696,-41.4691,-39.1469,-41.3167,-41.8636,-34.5796,-1.77203,42.32,143.912,-15.2166,5.74173,-39.1175,-33.1279,-39.1049,-39.8571,-45.8915,-39.0807,-37.7681,-36.6884,-38.3966,-37.7225,113.473,-14.1697,-9.54204,147.163,114.816,-34.7921,-40.0011,-40.0735,-43.9175,-43.1874,-44.3571,-39.6994,-37.3764,-37.7424,-40.768,0
+ANNOTATED_SEQUENCE: T[THR:NtermProteinFull]PLDEEARRAFQRNSSTAQELLKQLERDSRADPRVIEELRRLK[LYS:CtermProteinFull] EHPC100_job_77_hhh_11.5.10.5.10_20201122032649.pdb
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+SEQUENCE: SEEVKKILKELLKDKDKQEALKKWAKKAGLTDEHVRRLMKKIM
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -118.053 -246.797 27.615 201.156 -16.486 7.773 13.151 99.955 -105.873 -0.279 -1.793 -90.478 -13.608 0.000 -29.998 -1.120 -4.221 -8.614 0.000 0.698 3.748 39.455 34.449 -7.570 2.950 -21.371 -0.796 3.000 14.488 3.000 55.013 0.065 20.455 11.000 17.973 197.705 10.115 5.689 8.000 7.108 0.631 9.841 0.807 -1.928 1.325 76.744 23.256 0.000 16.000 6.000 33.000 10.000 0.000 43.000 0.186 0.261 0.0,-64.14140572246093,-63.00727802265437,-66.34861710895203,-58.86076460132219,-62.32542656366038,-65.59917619717174,-61.577051799155115,-62.86491434010714,-71.14408707352696,-63.27032769683299,-63.983364546726165,-88.98161138277746,-85.30664850078092,-67.0799340141522,-91.62369411037075,45.98458859119583,-66.60056501798285,-65.95521872473674,-63.19634522125229,-70.51178137209546,-67.67434342381853,-62.54734420907427,-65.32080118341315,-58.85400398229917,-66.83881907878119,-65.88550842831933,-72.89619674594299,72.84512983861967,-98.83603473442105,-117.27724688833295,-80.01600306074138,-67.078988418097,-58.355349657405085,-65.23554308562461,-60.641376535734004,-65.317036597681,-61.866853984711135,-58.54084510362138,-60.56779610872141,-69.87167144311813,-79.73645301805705,-49.25889852186145 25.578814731294123,-38.00816667494092,-38.18603508456187,-44.88949754838419,-47.05544184821509,-47.948703778124596,-45.48749695423693,-42.14243390476543,-37.75151528353585,-38.74388794487499,-36.112909419401255,-18.55808297235601,-1.707423120995015,178.80482024228107,-21.902334647745658,-1.8914604902347074,-123.96138219092286,-24.93882293050007,-29.618265586630912,-35.521979218319345,-40.681965387906416,-43.16171991450866,-44.16894954911073,-49.56610388582879,-39.46124767285913,-48.7936201972212,-32.65535564981697,-11.482352446127866,32.81110840004064,101.3670297959233,16.59891847155383,157.62533469511726,-37.63931354464049,-47.29777990400261,-42.491036399236435,-39.72059060432613,-41.17966549868329,-41.44066064018972,-50.92708679416365,-39.259762522794176,-36.37017595744394,-42.88985425838916,0.0 LHHHHHHHHHHHHLLLHHHHHHHHHHHLLLLLHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb
+REMARK DSSP LHHHHHHHHHHHHLLLHHHHHHHHHHHLLLLLHHHHHHHHHHL
+REMARK PHI 0,-64.1414,-63.0073,-66.3486,-58.8608,-62.3254,-65.5992,-61.5771,-62.8649,-71.1441,-63.2703,-63.9834,-88.9816,-85.3066,-67.0799,-91.6237,45.9846,-66.6006,-65.9552,-63.1963,-70.5118,-67.6743,-62.5473,-65.3208,-58.854,-66.8388,-65.8855,-72.8962,72.8451,-98.836,-117.277,-80.016,-67.079,-58.3553,-65.2355,-60.6414,-65.317,-61.8669,-58.5408,-60.5678,-69.8717,-79.7365,-49.2589
+REMARK PSI 25.5788,-38.0082,-38.186,-44.8895,-47.0554,-47.9487,-45.4875,-42.1424,-37.7515,-38.7439,-36.1129,-18.5581,-1.70742,178.805,-21.9023,-1.89146,-123.961,-24.9388,-29.6183,-35.522,-40.682,-43.1617,-44.1689,-49.5661,-39.4612,-48.7936,-32.6554,-11.4824,32.8111,101.367,16.5989,157.625,-37.6393,-47.2978,-42.491,-39.7206,-41.1797,-41.4407,-50.9271,-39.2598,-36.3702,-42.8899,0
+ANNOTATED_SEQUENCE: S[SER:NtermProteinFull]EEVKKILKELLKDKDKQEALKKWAKKAGLTDEH[HIS_D]VRRLMKKIM[MET:CtermProteinFull] EHPC100_job_77_hhh_11.5.10.5.10_20201122032655.pdb
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+SEQUENCE: DPKTEELIKQYQRKERSEEMMEELRKKANNRNKEMIKKARKDG
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -104.212 -233.769 22.690 224.682 -19.032 7.830 17.118 105.340 -107.677 -0.330 -2.633 -98.448 -10.484 0.125 -31.059 -2.632 -3.585 -11.475 0.000 2.100 3.763 40.745 43.304 -6.772 2.891 -44.723 -2.180 2.000 13.651 1.000 35.924 2.871 18.900 10.000 19.122 191.218 10.367 5.318 7.000 6.967 0.650 9.786 0.690 -1.713 0.870 72.093 27.907 0.000 10.000 4.000 31.000 12.000 0.000 43.000 0.163 0.334 0.0,-54.55716758878108,-60.24671925133987,-60.96339544115801,-60.4675875865348,-65.77193234772929,-63.55634861036867,-65.2463797731284,-62.50391995000622,-63.22152662835138,-64.12082980279126,-60.019510478858145,-83.12438915418637,58.74835726165174,-96.7981056833779,-137.85384467753593,-66.3124475793145,-66.15849001928508,-59.9076502864336,-64.3169028034401,-76.79331549477475,-66.36850353169604,-68.16591033137897,-64.04728039289955,-61.70678618814965,-63.609803242619186,-65.94857491469905,-82.15981537380956,54.80929852805371,63.573395064002774,-73.04058179696266,-100.49654188783236,-59.99847576735693,-64.14260214702321,-64.89686513161355,-68.97927149490033,-58.905041199309586,-63.52492336847542,-60.74298066505938,-71.18874876998304,-63.4746892769842,-59.87672154381264,104.91421937347923 162.466560504179,-34.371169669132804,-48.198721119432335,-44.746258974755015,-41.58444350400652,-44.175525554528924,-40.431811999497974,-45.50860646436511,-39.02126456509508,-39.202897049339164,-46.86641819406775,-35.31366694139388,1.0583826778749952,42.434925560250385,-9.48288859027419,152.04987206388313,150.80409295854002,-14.525527849873443,-29.266363669273485,-30.398676915398468,-35.677547225261804,-39.83633257978659,-37.358933341260766,-45.122994051902474,-45.49768997278267,-50.004448638381334,-34.320891167795246,-1.2759854872937306,44.098749022055536,19.181033426575183,-38.37219849376893,15.606161452197789,-38.24378966839477,-39.36839166390034,-41.2411702671999,-45.793755546932815,-43.14053151466278,-43.815162619659574,-39.80814871403034,-36.98126239102244,-42.777828401291885,-41.08526266485512,0.0 LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb
+REMARK DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL
+REMARK PHI 0,-54.5572,-60.2467,-60.9634,-60.4676,-65.7719,-63.5563,-65.2464,-62.5039,-63.2215,-64.1208,-60.0195,-83.1244,58.7484,-96.7981,-137.854,-66.3124,-66.1585,-59.9077,-64.3169,-76.7933,-66.3685,-68.1659,-64.0473,-61.7068,-63.6098,-65.9486,-82.1598,54.8093,63.5734,-73.0406,-100.497,-59.9985,-64.1426,-64.8969,-68.9793,-58.905,-63.5249,-60.743,-71.1887,-63.4747,-59.8767,104.914
+REMARK PSI 162.467,-34.3712,-48.1987,-44.7463,-41.5844,-44.1755,-40.4318,-45.5086,-39.0213,-39.2029,-46.8664,-35.3137,1.05838,42.4349,-9.48289,152.05,150.804,-14.5255,-29.2664,-30.3987,-35.6775,-39.8363,-37.3589,-45.123,-45.4977,-50.0044,-34.3209,-1.27599,44.0987,19.181,-38.3722,15.6062,-38.2438,-39.3684,-41.2412,-45.7938,-43.1405,-43.8152,-39.8081,-36.9813,-42.7778,-41.0853,0
+ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]PKTEELIKQYQRKERSEEMMEELRKKANNRNKEMIKKARKDG[GLY:CtermProteinFull] EHPC100_job_77_hhh_11.5.10.5.10_20201122032822.pdb
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+SEQUENCE: TEVEEILKRAAKKPDHKFREIFRELIERNLANELAKQILKELG
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -111.605 -241.044 29.032 188.744 -17.360 7.708 13.119 95.556 -102.038 -0.335 -2.242 -75.418 -13.068 0.032 -30.063 -2.684 -3.335 -6.603 0.000 2.171 3.407 24.813 42.367 -7.324 2.286 -23.002 3.677 4.000 14.628 1.000 55.351 0.645 21.364 11.000 18.243 200.672 10.942 5.860 8.000 6.882 0.632 9.818 0.794 -1.782 0.782 76.744 23.256 0.000 17.000 1.000 33.000 10.000 0.000 43.000 0.186 0.335 0.0,-61.816026473581395,-60.87873427386993,-64.51024770761043,-63.10392233294926,-64.23482012032534,-64.680874248356,-60.66961314351576,-71.64463978334865,-63.24105965575744,-68.51336264921207,-87.40874592621869,52.85547148280792,-66.37135130048894,-159.28162388186527,-72.04898204335726,-91.23362478670171,-59.19866149020611,-70.40617266813769,-69.41468304560698,-64.35874575364411,-63.02918602763617,-61.24466252896299,-60.56573364691166,-66.43755382418904,-72.25860023352529,-66.28395963794418,-87.08050049367311,54.3695702401474,-99.04581680264154,-104.37947103434662,50.59528408561853,-68.21538426658607,-67.12484362281268,-66.47994182018405,-61.428431832870345,-66.59170804313756,-66.229930924608,-62.46970952055127,-62.91998644731243,-66.55357012253441,-64.34196161315106,104.4673399414333 115.99844970876589,-37.54483533122744,-43.79033726430612,-42.33399027064176,-39.63509633907059,-46.13586564515068,-39.62586069732336,-40.02115810065967,-43.597573295722896,-31.508669700612042,-13.493978955523716,-4.813174407090667,58.97031925478837,-22.27680664176824,177.99664528032784,-10.477330060180872,1.265725177997705,-27.14115361849895,-30.681013517424013,-32.61183114514764,-46.83765846926104,-42.68357484593599,-46.187160289435205,-47.060519436449425,-30.670942054519475,-51.41204082569745,-34.63503503189473,3.9149217565832197,43.50019502443131,-34.696627768614924,-22.945302628210737,-123.52096880255584,-21.947745499194514,-51.95328061082064,-35.67083657211858,-47.92772919130619,-42.27368173394641,-45.14734723283217,-41.7848860485962,-40.029111067566824,-38.54908540192382,-41.05432821808837,0.0 LHHHHHHHHHHHLLLHHHHHHHHHHHHLLLLLHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb
+REMARK DSSP LHHHHHHHHHHHLLLHHHHHHHHHHHHLLLLLHHHHHHHHHHL
+REMARK PHI 0,-61.816,-60.8787,-64.5102,-63.1039,-64.2348,-64.6809,-60.6696,-71.6446,-63.2411,-68.5134,-87.4087,52.8555,-66.3714,-159.282,-72.049,-91.2336,-59.1987,-70.4062,-69.4147,-64.3587,-63.0292,-61.2447,-60.5657,-66.4376,-72.2586,-66.284,-87.0805,54.3696,-99.0458,-104.379,50.5953,-68.2154,-67.1248,-66.4799,-61.4284,-66.5917,-66.2299,-62.4697,-62.92,-66.5536,-64.342,104.467
+REMARK PSI 115.998,-37.5448,-43.7903,-42.334,-39.6351,-46.1359,-39.6259,-40.0212,-43.5976,-31.5087,-13.494,-4.81317,58.9703,-22.2768,177.997,-10.4773,1.26573,-27.1412,-30.681,-32.6118,-46.8377,-42.6836,-46.1872,-47.0605,-30.6709,-51.412,-34.635,3.91492,43.5002,-34.6966,-22.9453,-123.521,-21.9477,-51.9533,-35.6708,-47.9277,-42.2737,-45.1473,-41.7849,-40.0291,-38.5491,-41.0543,0
+ANNOTATED_SEQUENCE: T[THR:NtermProteinFull]EVEEILKRAAKKPDH[HIS_D]KFREIFRELIERNLANELAKQILKELG[GLY:CtermProteinFull] EHPC100_job_77_hhh_11.5.10.5.10_20201122032833.pdb
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+SEQUENCE: SPEEFEKLKEKAKRENNEEVLRKLEEAAKNASEEEIKELKRQI
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -114.042 -232.848 25.142 220.845 -15.183 5.901 16.186 108.961 -109.326 -0.454 -2.581 -96.857 -18.700 0.078 -30.148 -1.871 -3.039 -9.960 0.000 1.535 4.280 25.857 57.025 -9.015 1.203 -43.537 -7.535 4.000 13.651 2.000 39.819 34.851 19.444 9.000 10.396 93.563 5.279 2.685 9.000 8.140 0.636 10.149 0.719 -1.900 0.628 72.093 27.907 0.000 12.000 -2.000 31.000 12.000 0.000 43.000 0.209 0.307 0.0,-51.48024869435859,-59.30778457208701,-70.60289584858495,-66.93899312498681,-66.40987252599236,-63.39382558395998,-68.04356223920345,-60.652432621310155,-61.89635497385933,-66.37577601401324,-59.33058313849102,-61.15876480231454,-92.94710455669764,-91.84443978530747,55.43377521064221,-93.5287567500433,-61.22058011758979,-62.6599744987428,-67.9175329438902,-60.01443546754284,-68.75214466312453,-65.62739940328859,-64.87353840147269,-66.29795444331049,-76.10226119083158,-64.29362577571187,-69.72607493706828,-83.862996791081,52.1357800088046,-77.40988220337988,-60.408693077595245,-61.86958068055051,-62.64951573690476,-69.13596403458016,-68.27742022206758,-61.49792138406971,-63.987110515267474,-61.724628545273895,-60.13465608934933,-68.32074089335299,-70.37578445473903,-77.69343976874832 104.35277004349973,-33.65241222333037,-38.1849871291387,-37.941728883025604,-42.30006626124337,-37.574514526073806,-39.9311708273235,-34.412428732484315,-41.697672561826515,-36.432959821076594,-47.81068520869051,-33.899854395478414,-30.250117653227385,-26.322558143473863,2.5274835592379366,41.845325944061216,84.410194385844,-40.774269149420036,-36.95627350673593,-43.41264520614228,-40.41748703627092,-42.770426428818716,-39.39398806304044,-39.46164868323077,-41.46422271617256,-36.54568408518662,-30.80083988264804,-19.210582850185627,64.44608830757603,43.668058673575395,161.29180496716185,146.2035885699289,-37.855518496395646,-39.54432856162265,-39.83097584997943,-45.23404029279285,-41.49031865761338,-43.20410430845697,-43.061475307962596,-39.412520277521644,-36.44286754001981,-36.33698118177661,0.0 LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb
+REMARK DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLLLHHHHHHHHHHL
+REMARK PHI 0,-51.4802,-59.3078,-70.6029,-66.939,-66.4099,-63.3938,-68.0436,-60.6524,-61.8964,-66.3758,-59.3306,-61.1588,-92.9471,-91.8444,55.4338,-93.5288,-61.2206,-62.66,-67.9175,-60.0144,-68.7521,-65.6274,-64.8735,-66.298,-76.1023,-64.2936,-69.7261,-83.863,52.1358,-77.4099,-60.4087,-61.8696,-62.6495,-69.136,-68.2774,-61.4979,-63.9871,-61.7246,-60.1347,-68.3207,-70.3758,-77.6934
+REMARK PSI 104.353,-33.6524,-38.185,-37.9417,-42.3001,-37.5745,-39.9312,-34.4124,-41.6977,-36.433,-47.8107,-33.8999,-30.2501,-26.3226,2.52748,41.8453,84.4102,-40.7743,-36.9563,-43.4126,-40.4175,-42.7704,-39.394,-39.4616,-41.4642,-36.5457,-30.8008,-19.2106,64.4461,43.6681,161.292,146.204,-37.8555,-39.5443,-39.831,-45.234,-41.4903,-43.2041,-43.0615,-39.4125,-36.4429,-36.337,0
+ANNOTATED_SEQUENCE: S[SER:NtermProteinFull]PEEFEKLKEKAKRENNEEVLRKLEEAAKNASEEEIKELKRQI[ILE:CtermProteinFull] EHPC100_job_77_hhh_11.5.10.5.10_20201122032943.pdb
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+SEQUENCE: SEIEERLEKLARSETGTEEQMRQLAKKYEDPSAREFLKRYREK
+SCORE: score fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro AlaCount AverageDegree BuriedUnsatHbond Buried_non_polar_SASA_per_res CavityVolume CoreAverageDegree CoreResidueCount ExposeCoreHydrophobicsPerCoreResidue ExposeCoreHydrophobicsSASA ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent ExposedHydrophobics_on_TotalSASAPercent HasCoreResidueNum MaxDistanceToToMassCenter PackStat Rg SSShapeComplementarity ScorePerResFilter driftRMSD frac_helix frac_loop frac_sheet n_hydrophobic netcharge nres_helix nres_loop nres_sheet nres_total percent_core ss_mismatch_probability PHI PSI SSE description
+REMARK BINARY SILENTFILE
+SCORE: -99.049 -240.205 23.017 218.837 -17.455 6.648 16.604 109.615 -109.807 -0.414 -2.855 -82.079 -20.341 0.040 -31.548 0.000 -7.507 -9.731 0.000 3.226 5.860 31.716 48.274 -7.257 7.782 -40.589 -0.882 3.000 14.674 3.000 42.243 6.160 19.800 10.000 18.416 184.159 10.126 5.324 12.000 6.672 0.661 9.831 0.798 -1.452 0.622 76.744 23.256 0.000 12.000 0.000 33.000 10.000 0.000 43.000 0.279 0.275 0.0,-64.0487359118943,-69.69104607827998,-61.32384411097726,-62.316170158356016,-60.94259923238814,-63.14942364428239,-62.10751237754549,-62.23635579091567,-67.79393522723588,-67.30264243643552,-75.58324111263224,-70.17633470937064,-72.37674482389288,-96.35816108479204,-88.32445184168974,-128.1497200942804,-64.11788841385271,-58.5515355621417,-64.59986106202211,-62.604239688873925,-62.35188106160262,-61.03252802587855,-66.81474002031639,-65.98858419729268,-79.24528850470969,-67.7229091745369,-101.72399468575834,-77.61431535481827,-64.53081199307239,-57.304811091192086,-54.71748629994325,-67.85111585098318,-83.14762414240734,-66.18775915739461,-63.62534372613044,-60.39420097192371,-56.75266710610848,-65.19042031492202,-59.02636279350242,-64.9602074846891,-67.76554881186445,-53.10341749547002 179.99932169695205,-37.016486662352094,-41.47630395662156,-40.03030656890961,-39.56292271313878,-43.38610646529196,-40.96371913397039,-44.21868303816494,-40.58901651385193,-40.99133170661388,-37.51278143834419,-43.982415527758825,139.10487165398837,-10.323620520779322,-4.799437836543055,156.37941986362603,159.37891113067573,-31.029282653163424,-43.24960993315491,-40.19749163258058,-45.053573671948094,-40.1418523683894,-40.0845007678448,-39.738177637595804,-35.183828082290965,-37.66835459458902,-44.69273313376687,144.888762214947,-12.15119120213544,113.68605589268499,-23.632059907604464,-33.84497063726042,-34.23792356033179,-32.29024893858771,-37.36357065360846,-45.28548026384168,-40.55544530300989,-51.823455234278185,-37.526876634262045,-48.16444199700557,-38.89715626752906,-37.274510720964294,0.0 LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLHHHHHHHHHHHHL EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb
+REMARK DSSP LHHHHHHHHHHHLLLLLHHHHHHHHHHLLLHHHHHHHHHHHHL
+REMARK PHI 0,-64.0487,-69.691,-61.3238,-62.3162,-60.9426,-63.1494,-62.1075,-62.2364,-67.7939,-67.3026,-75.5832,-70.1763,-72.3767,-96.3582,-88.3245,-128.15,-64.1179,-58.5515,-64.5999,-62.6042,-62.3519,-61.0325,-66.8147,-65.9886,-79.2453,-67.7229,-101.724,-77.6143,-64.5308,-57.3048,-54.7175,-67.8511,-83.1476,-66.1878,-63.6253,-60.3942,-56.7527,-65.1904,-59.0264,-64.9602,-67.7655,-53.1034
+REMARK PSI 179.999,-37.0165,-41.4763,-40.0303,-39.5629,-43.3861,-40.9637,-44.2187,-40.589,-40.9913,-37.5128,-43.9824,139.105,-10.3236,-4.79944,156.379,159.379,-31.0293,-43.2496,-40.1975,-45.0536,-40.1419,-40.0845,-39.7382,-35.1838,-37.6684,-44.6927,144.889,-12.1512,113.686,-23.6321,-33.845,-34.2379,-32.2902,-37.3636,-45.2855,-40.5554,-51.8235,-37.5269,-48.1644,-38.8972,-37.2745,0
+ANNOTATED_SEQUENCE: S[SER:NtermProteinFull]EIEERLEKLARSETGTEEQMRQLAKKYEDPSAREFLKRYREK[LYS:CtermProteinFull] EHPC100_job_77_hhh_11.5.10.5.10_20201122032955.pdb
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diff --git a/10_Analysis/run_design.py b/10_Analysis/run_design.py
new file mode 100644
index 0000000..8c32a1f
--- /dev/null
+++ b/10_Analysis/run_design.py
@@ -0,0 +1,28 @@
+# 举例使用FastDesign快速设计一些序列和结构:
+from pyrosetta import pose_from_pdb, init, create_score_function
+from pyrosetta.rosetta.protocols.denovo_design.movers import FastDesign
+from pyrosetta.rosetta.core.pack.task import TaskFactory
+from pyrosetta.rosetta.core.pose import Pose
+from pyrosetta.io import poses_to_silent
+
+# init
+init('')
+
+# load pose
+starting_pose = pose_from_pdb('./data/EHPC100_job_77_hhh_11.5.10.5.10_20201122032313.pdb')
+ref2015 = create_score_function('ref2015')
+design_tf = TaskFactory()
+
+# setup FastDesign
+fastdesign = FastDesign(ref2015, 1)
+fastdesign.set_default_movemap() #使用默认的Movemap()
+fastdesign.set_task_factory(design_tf)
+
+
+# design for 10 times:
+for i in range(10):
+ design_pose = Pose()
+ design_pose.assign(starting_pose) # assign pose
+ fastdesign.apply(design_pose) ## apply design
+ # output to silent file;
+ poses_to_silent(design_pose, './data/design_result.silent')
diff --git a/1_PoseIO/.ipynb_checkpoints/0_0_Installation-checkpoint.ipynb b/1_PoseIO/.ipynb_checkpoints/0_0_Installation-checkpoint.ipynb
index b9e5334..53e750d 100644
--- a/1_PoseIO/.ipynb_checkpoints/0_0_Installation-checkpoint.ipynb
+++ b/1_PoseIO/.ipynb_checkpoints/0_0_Installation-checkpoint.ipynb
@@ -46,15 +46,27 @@
"\n",
"PyRosetta目前兼容2种平台: MacOS, Linux\n",
"\n",
- "\n",
- "\n",
- "\n",
+ "
\n",
+ "(图片来源: 晶泰科技团队)"
]
},
{
@@ -386,7 +390,7 @@
},
{
"cell_type": "code",
- "execution_count": 29,
+ "execution_count": 12,
"metadata": {},
"outputs": [
{
@@ -405,6 +409,159 @@
"print(ss)"
]
},
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "### 五、理想化初始拓扑数据\n",
+ "在晶体中，可能会存在一些非理想二面角、键长、键角等。可以通过IdealizeMover进行修复。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 13,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mprotocols.idealize.IdealizeMover: {0} \u001b[0mtotal atompairs: 0\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mlastjumpmin: 1\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpremin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 2 N 0.075 0.000 0.000 0.000 0.000 1.416\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpostmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 2 N 0.039 4.106 5.979 2.375 4.050 0.283\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " pro_close 0.500 0.000 0.000\n",
+ " dslf_ss_dst 0.500 0.000 0.000\n",
+ " dslf_cs_ang 2.000 0.000 0.000\n",
+ " coordinate_constraint 0.010 28.336 0.283\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 0.283\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpremin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 3 Y 2.619 2.531 5.979 0.950 4.050 1095.920\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpostmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 3 Y 0.656 46.121 77.515 28.485 109.577 56.651\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " pro_close 0.500 0.000 0.000\n",
+ " dslf_ss_dst 0.500 0.000 0.000\n",
+ " dslf_cs_ang 2.000 0.000 0.000\n",
+ " coordinate_constraint 0.010 5665.102 56.651\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 56.651\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpremin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 4 V 0.657 44.944 118.620 23.737 109.577 56.780\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpostmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 4 V 0.657 44.944 118.629 23.737 109.577 56.747\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " pro_close 0.500 0.000 0.000\n",
+ " dslf_ss_dst 0.500 0.000 0.000\n",
+ " dslf_cs_ang 2.000 0.000 0.000\n",
+ " coordinate_constraint 0.010 5674.731 56.747\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 56.747\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpremin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 5 V 0.654 34.395 118.629 20.346 109.577 57.267\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpostmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 5 V 0.656 34.377 118.361 20.353 109.577 56.568\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " pro_close 0.500 0.000 0.000\n",
+ " dslf_ss_dst 0.500 0.000 0.000\n",
+ " dslf_cs_ang 2.000 0.000 0.000\n",
+ " coordinate_constraint 0.010 5656.769 56.568\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 56.568\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpremin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 6 T 0.667 27.842 118.361 15.830 109.577 60.651\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpostmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 6 T 0.655 27.895 118.453 15.832 109.577 56.600\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " pro_close 0.500 0.000 0.000\n",
+ " dslf_ss_dst 0.500 0.000 0.000\n",
+ " dslf_cs_ang 2.000 0.000 0.000\n",
+ " coordinate_constraint 0.010 5660.035 56.600\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 56.600\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpremin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 8 A 0.670 26.155 118.453 15.832 109.577 57.959\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpostmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 8 A 0.670 26.155 118.453 15.832 109.577 57.957\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " pro_close 0.500 0.000 0.000\n",
+ " dslf_ss_dst 0.500 0.000 0.000\n",
+ " dslf_cs_ang 2.000 0.000 0.000\n",
+ " coordinate_constraint 0.010 5795.692 57.957\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 57.957\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpremin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 7 Y 0.796 22.061 118.453 11.874 109.577 71.358\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpostmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 7 Y 0.796 22.060 118.455 11.875 109.577 71.337\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " pro_close 0.500 0.000 0.000\n",
+ " dslf_ss_dst 0.500 0.000 0.000\n",
+ " dslf_cs_ang 2.000 0.000 0.000\n",
+ " coordinate_constraint 0.010 7133.705 71.337\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 71.337\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpremin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 1 G 0.796 21.383 118.455 11.875 109.577 71.315\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpostmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 1 G 0.796 21.383 118.457 11.875 109.577 71.307\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " pro_close 0.500 0.000 0.000\n",
+ " dslf_ss_dst 0.500 0.000 0.000\n",
+ " dslf_cs_ang 2.000 0.000 0.000\n",
+ " coordinate_constraint 0.010 7130.685 71.307\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 71.307\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpre-finalmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 0.796 21.383 118.457 11.875 109.577 71.307\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0mpost-finalmin: (pos,rmsd,avg-bb,max-bb,avg-chi,max-chi,score) 0.796 21.383 118.459 11.875 109.576 71.292\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " pro_close 0.500 0.000 0.000\n",
+ " dslf_ss_dst 0.500 0.000 0.000\n",
+ " dslf_cs_ang 2.000 0.000 0.000\n",
+ " coordinate_constraint 0.010 7129.185 71.292\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 71.292\n",
+ "\u001b[0mprotocols.idealize: {0} \u001b[0m\n",
+ "\u001b[0mprotocols.idealize.IdealizeMover: {0} \u001b[0mRMS between original pose and idealised pose: 0.524355 CA RMSD, 0.811604 All-Atom RMSD,\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.idealize import IdealizeMover\n",
+ "# idealized\n",
+ "idm = IdealizeMover()\n",
+ "idm.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "理想化之后，的All-Atom RMSD发生了轻微的变化。"
+ ]
+ },
{
"cell_type": "markdown",
"metadata": {},
@@ -439,7 +596,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/1_PoseIO/1_6_Pose_Operating.ipynb b/1_PoseIO/1_6_Pose_Operating.ipynb
index 3f09840..4a8a023 100644
--- a/1_PoseIO/1_6_Pose_Operating.ipynb
+++ b/1_PoseIO/1_6_Pose_Operating.ipynb
@@ -21,20 +21,22 @@
},
{
"cell_type": "code",
- "execution_count": 10,
+ "execution_count": 1,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release 2021.18+release.54b4909cd528ede1d749ea69e8046c244fc797f2 2021-05-04T21:04:43] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.31+release.c7009b3115c22daa9efe2805d9d1ebba08426a54 2021-08-07T10:04:12] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
"\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release r282 2021.18+release.54b4909cd52 54b4909cd528ede1d749ea69e8046c244fc797f2 http://www.pyrosetta.org 2021-05-04T21:04:43\n",
- "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.6/site-packages/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-1413260087 seed_offset=0 real_seed=-1413260087 thread_index=0\n",
- "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-1413260087 RG_type=mt19937\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r292 2021.31+release.c7009b3115c c7009b3115c22daa9efe2805d9d1ebba08426a54 http://www.pyrosetta.org 2021-08-07T10:04:12\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-1249606663 seed_offset=0 real_seed=-1249606663 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-1249606663 RG_type=mt19937\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 983 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.695115 seconds.\n",
"\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/4R80.clean.pdb' automatically determined to be of type PDB\n",
"\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue SER:CtermProteinFull 76\n",
"\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue SER:CtermProteinFull 152\n"
@@ -59,7 +61,7 @@
},
{
"cell_type": "code",
- "execution_count": 11,
+ "execution_count": 2,
"metadata": {},
"outputs": [],
"source": [
@@ -78,7 +80,7 @@
},
{
"cell_type": "code",
- "execution_count": 12,
+ "execution_count": 3,
"metadata": {},
"outputs": [
{
@@ -121,7 +123,7 @@
},
{
"cell_type": "code",
- "execution_count": 13,
+ "execution_count": 4,
"metadata": {},
"outputs": [
{
@@ -168,7 +170,7 @@
},
{
"cell_type": "code",
- "execution_count": 14,
+ "execution_count": 5,
"metadata": {},
"outputs": [
{
@@ -215,7 +217,7 @@
},
{
"cell_type": "code",
- "execution_count": 24,
+ "execution_count": 6,
"metadata": {},
"outputs": [
{
@@ -223,6 +225,26 @@
"output_type": "stream",
"text": [
"\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
"\u001b[0mprotocols.simple_moves.SwitchChainOrderMover: {0} \u001b[0mNumber of chains in pose: 2\n",
"\u001b[0mprotocols.simple_moves.SwitchChainOrderMover: {0} \u001b[0mNow at chain: 2\n",
"\u001b[0mprotocols.simple_moves.SwitchChainOrderMover: {0} \u001b[0mNow at chain: 1\n",
@@ -236,6 +258,13 @@
"\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 198 CYD\n",
"\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 125 CYD\n",
"\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 198 CYD\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.181558 seconds to load from binary\n",
"\u001b[0mprotocols.simple_moves.SwitchChainOrderMover: {0} \u001b[0mNew pose's foldtree FOLD_TREE EDGE 1 104 -1 EDGE 1 105 1 EDGE 105 223 -1\n",
"PDB file name: \n",
" Pose Range Chain PDB Range | #Residues #Atoms\n",
@@ -271,7 +300,7 @@
},
{
"cell_type": "code",
- "execution_count": 25,
+ "execution_count": 7,
"metadata": {},
"outputs": [
{
@@ -316,7 +345,7 @@
},
{
"cell_type": "code",
- "execution_count": 37,
+ "execution_count": 8,
"metadata": {},
"outputs": [
{
@@ -349,10 +378,10 @@
{
"data": {
"text/plain": [
- "vector1_std_shared_ptr_core_pose_Pose_t[0x7fafa3b845e0, 0x7fafa4b94130]"
+ "vector1_std_shared_ptr_core_pose_Pose_t[0x7ff14f8106a8, 0x7ff14e6a6a18]"
]
},
- "execution_count": 37,
+ "execution_count": 8,
"metadata": {},
"output_type": "execute_result"
}
@@ -375,7 +404,7 @@
},
{
"cell_type": "code",
- "execution_count": 38,
+ "execution_count": 9,
"metadata": {},
"outputs": [
{
@@ -454,7 +483,7 @@
},
{
"cell_type": "code",
- "execution_count": 39,
+ "execution_count": 10,
"metadata": {},
"outputs": [
{
@@ -485,7 +514,7 @@
},
{
"cell_type": "code",
- "execution_count": 40,
+ "execution_count": 11,
"metadata": {},
"outputs": [
{
@@ -509,7 +538,7 @@
"0120 -- 0223 L 0002 -- 0105 | 0104 residues; 01588 atoms\n",
" TOTAL | 0223 residues; 03433 atoms\n",
"\n",
- "PDBinfo是否需要被更新:False\n"
+ "PDBinfo是否需要被更新:True\n"
]
}
],
@@ -517,12 +546,12 @@
"print(chain1_pose.pdb_info())\n",
"\n",
"# 检查Pose的PDB_info是否是奇怪的:\n",
- "print(f'PDBinfo是否需要被更新:{combine_pose.pdb_info().obsolete()}')"
+ "print(f'PDBinfo是否需要被更新:{chain1_pose.pdb_info().obsolete()}')"
]
},
{
"cell_type": "code",
- "execution_count": 41,
+ "execution_count": 12,
"metadata": {},
"outputs": [
{
@@ -535,10 +564,19 @@
],
"source": [
"# update pdbinfo; 别忘了更新pdbinfo;\n",
- "# 更新pdb_info; [别忘了]\n",
"from pyrosetta.rosetta.core.pose import renumber_pdbinfo_based_on_conf_chains\n",
- "renumber_pdbinfo_based_on_conf_chains(combine_pose)\n",
- "print(f'PDBinfo是否需要被更新:{combine_pose.pdb_info().obsolete()}')"
+ "renumber_pdbinfo_based_on_conf_chains(chain1_pose)\n",
+ "print(f'PDBinfo是否需要被更新:{chain1_pose.pdb_info().obsolete()}')"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 13,
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "# 如果你非常确定，新的pose中不会有PDB的编号冲突等问题。可以直接修改obsolete的检查结果:\n",
+ "chain1_pose.pdb_info().obsolete(False)"
]
},
{
@@ -550,7 +588,7 @@
},
{
"cell_type": "code",
- "execution_count": 45,
+ "execution_count": 14,
"metadata": {},
"outputs": [
{
@@ -601,6 +639,7 @@
],
"source": [
"# 链的延伸; 合并成一条链的意思;\n",
+ "from pyrosetta.rosetta.core.pose import append_pose_to_pose\n",
"pose = pose_from_pdb('./data/6LZ9_H_L.pdb')\n",
"chain1_pose = pose.split_by_chain()[1]\n",
"chain2_pose = pose.split_by_chain()[2]\n",
@@ -628,7 +667,7 @@
},
{
"cell_type": "code",
- "execution_count": 52,
+ "execution_count": 15,
"metadata": {},
"outputs": [
{
@@ -665,6 +704,9 @@
"from pyrosetta.rosetta.protocols.grafting import delete_region\n",
"delete_region_mover = delete_region(pose, 1, 50) # 此处是pose number;\n",
"\n",
+ "# update pdbinfo; 别忘了更新pdbinfo;\n",
+ "renumber_pdbinfo_based_on_conf_chains(pose)\n",
+ "\n",
"# 打印查看信息, 一整个区域都被删除【比一个个氨基酸删除快得多】:\n",
"print('删除后的PDB_info:')\n",
"print(pose.pdb_info())"
@@ -689,12 +731,12 @@
"metadata": {},
"source": [
"除了对链的合并之外，我们还可以对链中的氨基酸进行添加、删除的操作！具体的过程是用户需要创建一个独立的氨基酸(residue object)，并将这个氨基酸加载到现有的构像中。\n",
- "加载的方式可以是前置后后置，根据使用的函数不同而定。"
+ "加载的方式可以是前置或后置，根据使用的函数不同而定。"
]
},
{
"cell_type": "code",
- "execution_count": 58,
+ "execution_count": 16,
"metadata": {},
"outputs": [
{
@@ -723,7 +765,7 @@
},
{
"cell_type": "code",
- "execution_count": 59,
+ "execution_count": 17,
"metadata": {},
"outputs": [
{
@@ -751,7 +793,7 @@
},
{
"cell_type": "code",
- "execution_count": 60,
+ "execution_count": 18,
"metadata": {},
"outputs": [
{
@@ -767,7 +809,7 @@
"source": [
"# 向后添加氨基酸\n",
"last_residue = pose.total_residue()\n",
- "pose.append_polymer_residue_after_seqpos(new_rsd, last_residue, True) # 在第一个氨基酸前添加一个ALA\n",
+ "pose.append_polymer_residue_after_seqpos(new_rsd, last_residue, True) # 在最后一个氨基酸后添加一个ALA\n",
"\n",
"print(f'Pose的残基数量:{pose.total_residue()}')\n",
"print(f'氨基酸序列:{pose.sequence()}\\n')"
@@ -775,7 +817,7 @@
},
{
"cell_type": "code",
- "execution_count": 61,
+ "execution_count": 19,
"metadata": {},
"outputs": [
{
@@ -798,7 +840,7 @@
},
{
"cell_type": "code",
- "execution_count": 62,
+ "execution_count": 20,
"metadata": {},
"outputs": [
{
@@ -828,7 +870,7 @@
},
{
"cell_type": "code",
- "execution_count": 64,
+ "execution_count": 21,
"metadata": {},
"outputs": [
{
@@ -867,7 +909,7 @@
},
{
"cell_type": "code",
- "execution_count": 75,
+ "execution_count": 22,
"metadata": {},
"outputs": [
{
@@ -895,7 +937,7 @@
},
{
"cell_type": "code",
- "execution_count": 76,
+ "execution_count": 23,
"metadata": {},
"outputs": [
{
@@ -918,7 +960,7 @@
},
{
"cell_type": "code",
- "execution_count": 77,
+ "execution_count": 24,
"metadata": {},
"outputs": [
{
@@ -934,7 +976,7 @@
"True"
]
},
- "execution_count": 77,
+ "execution_count": 24,
"metadata": {},
"output_type": "execute_result"
}
@@ -949,6 +991,50 @@
"sub_region_pose.dump_pdb('./data/sub_region.pdb')"
]
},
+ {
+ "cell_type": "code",
+ "execution_count": 25,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "None\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 这种非官方的操作方法，默认没有创建pdb_info!\n",
+ "print(sub_region_pose.pdb_info())"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 26,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PDB file name: \n",
+ " Pose Range Chain PDB Range | #Residues #Atoms\n",
+ "\n",
+ "0001 -- 0005 A 0001 -- 0005 | 0005 residues; 00074 atoms\n",
+ " TOTAL | 0005 residues; 00074 atoms\n",
+ "\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 通过AddPDBInfoMover可以创建对应的pdb_info给到当前的Pose\n",
+ "from pyrosetta.rosetta.protocols.simple_moves import AddPDBInfoMover\n",
+ "pdb_mover = AddPDBInfoMover()\n",
+ "pdb_mover.apply(sub_region_pose)\n",
+ "print(sub_region_pose.pdb_info())"
+ ]
+ },
{
"cell_type": "markdown",
"metadata": {},
@@ -959,32 +1045,63 @@
},
{
"cell_type": "code",
- "execution_count": 65,
+ "execution_count": 27,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "原始氨基酸类型:PRO:NtermProteinFull\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 调整氨基酸的类型\n",
+ "from pyrosetta.toolbox import mutate_residue\n",
+ "print(f'原始氨基酸类型:{pose.residue(1).name()}')"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 28,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "原始氨基酸类型:GLU\n",
"突变氨基酸中...\n",
"\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
"\u001b[0mcore.pack.task: {0} \u001b[0mPacker task: initialize from command line()\n",
- "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 137 rotamers at 10 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 161 rotamers at 8 positions.\n",
"\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
"\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating PDInteractionGraph\n",
- "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
- "突变后氨基酸类型:ALA\n"
+ "\u001b[0mbasic.thread_manager.RosettaThreadManager: {?} \u001b[0mCreating a thread pool of 1 threads.\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadPool: {?} \u001b[0mLaunched 0 new threads.\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n"
]
}
],
"source": [
- "# 调整氨基酸的类型\n",
- "from pyrosetta.toolbox import mutate_residue\n",
- "print(f'原始氨基酸类型:{pose.residue(1).name()}')\n",
- "\n",
"print('突变氨基酸中...')\n",
- "mutate_residue(pose, 1, 'A', 9.0) # 1 代表氨基酸突变的pose编号，9.0代表对氨基酸附近9埃范围内的氨基酸进行侧链优化，适应新的突变。\n",
+ "mutate_residue(pose, 1, 'C', 9.0) # 1 代表氨基酸突变的pose编号，9.0代表对氨基酸附近9埃范围内的氨基酸进行侧链优化，适应新的突变。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 29,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "突变后氨基酸类型:CYS:NtermProteinFull\n"
+ ]
+ }
+ ],
+ "source": [
"print(f'突变后氨基酸类型:{pose.residue(1).name()}')"
]
},
@@ -998,7 +1115,20 @@
},
{
"cell_type": "code",
- "execution_count": 66,
+ "execution_count": 30,
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "# 给pose加入额外的信息: 比如filter计算的值就可以储存.\n",
+ "from pyrosetta.rosetta.core.pose import setPoseExtraScore, getPoseExtraScore\n",
+ "\n",
+ "setPoseExtraScore(pose, \"distance\", 1.0)\n",
+ "setPoseExtraScore(pose, \"angle\", 120.5)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 31,
"metadata": {},
"outputs": [
{
@@ -1011,15 +1141,9 @@
}
],
"source": [
- "# 给pose加入额外的信息: 比如filter计算的值就可以储存.\n",
- "from pyrosetta.rosetta.core.pose import setPoseExtraScore, getPoseExtraScore\n",
- "\n",
- "setPoseExtraScore(pose, \"distance\", 1.0)\n",
- "setPoseExtraScore(pose, \"angle\", 120.5)\n",
- "\n",
"# 提取信息\n",
"print(getPoseExtraScore(pose, 'distance'))\n",
- "print(getPoseExtraScore(pose, 'angle')) # 目前有bug，但是信息已经储存在pose中了"
+ "print(getPoseExtraScore(pose, 'angle'))"
]
},
{
@@ -1055,7 +1179,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/1_PoseIO/data/3cjk_metalsetip.pdb b/1_PoseIO/data/3cjk_metalsetip.pdb
index 090ea85..3f4c4b0 100644
--- a/1_PoseIO/data/3cjk_metalsetip.pdb
+++ b/1_PoseIO/data/3cjk_metalsetip.pdb
@@ -1,12 +1,12 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.31+release.c7009b3115c
HETNAM CD B 1 CD
LINK SG CYS A 12 CD CD B 1 2.54
LINK OG1 THR B 14 CD CD B 1 2.45
diff --git a/1_PoseIO/data/4jfx_peptide_chi_conf0.pdb b/1_PoseIO/data/4jfx_peptide_chi_conf0.pdb
index 938b6a2..23ad40b 100644
--- a/1_PoseIO/data/4jfx_peptide_chi_conf0.pdb
+++ b/1_PoseIO/data/4jfx_peptide_chi_conf0.pdb
@@ -1,12 +1,12 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.31+release.c7009b3115c
ATOM 1 N GLY P 2 39.100 -52.568 -62.320 1.00 64.55 N
ATOM 2 CA GLY P 2 39.676 -51.920 -61.152 1.00 61.86 C
ATOM 3 C GLY P 2 40.413 -52.886 -60.239 1.00 61.32 C
diff --git a/1_PoseIO/data/4jfx_peptide_chi_conf1.pdb b/1_PoseIO/data/4jfx_peptide_chi_conf1.pdb
index f65e27e..29645e3 100644
--- a/1_PoseIO/data/4jfx_peptide_chi_conf1.pdb
+++ b/1_PoseIO/data/4jfx_peptide_chi_conf1.pdb
@@ -1,12 +1,12 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.31+release.c7009b3115c
ATOM 1 N GLY P 2 39.100 -52.568 -62.320 1.00 64.55 N
ATOM 2 CA GLY P 2 39.676 -51.920 -61.152 1.00 61.86 C
ATOM 3 C GLY P 2 40.413 -52.886 -60.239 1.00 61.32 C
diff --git a/1_PoseIO/data/4jfx_peptide_chi_conf2.pdb b/1_PoseIO/data/4jfx_peptide_chi_conf2.pdb
index a554e08..93307d7 100644
--- a/1_PoseIO/data/4jfx_peptide_chi_conf2.pdb
+++ b/1_PoseIO/data/4jfx_peptide_chi_conf2.pdb
@@ -1,12 +1,12 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.31+release.c7009b3115c
ATOM 1 N GLY P 2 39.100 -52.568 -62.320 1.00 64.55 N
ATOM 2 CA GLY P 2 39.676 -51.920 -61.152 1.00 61.86 C
ATOM 3 C GLY P 2 40.413 -52.886 -60.239 1.00 61.32 C
diff --git a/1_PoseIO/data/4jfx_peptide_conf0.pdb b/1_PoseIO/data/4jfx_peptide_conf0.pdb
index a554e08..e749270 100644
--- a/1_PoseIO/data/4jfx_peptide_conf0.pdb
+++ b/1_PoseIO/data/4jfx_peptide_conf0.pdb
@@ -1,12 +1,12 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.31+release.c7009b3115c
ATOM 1 N GLY P 2 39.100 -52.568 -62.320 1.00 64.55 N
ATOM 2 CA GLY P 2 39.676 -51.920 -61.152 1.00 61.86 C
ATOM 3 C GLY P 2 40.413 -52.886 -60.239 1.00 61.32 C
@@ -35,22 +35,22 @@ ATOM 25 CA TYR P 4 40.461 -52.094 -55.275 1.00 48.07 C
ATOM 26 C TYR P 4 39.218 -51.225 -55.055 1.00 48.72 C
ATOM 27 O TYR P 4 38.816 -50.472 -55.936 1.00 48.66 O
ATOM 28 CB TYR P 4 41.677 -51.478 -54.573 1.00 46.30 C
-ATOM 29 CG TYR P 4 41.482 -51.170 -53.104 1.00 46.06 C
-ATOM 30 CD1 TYR P 4 41.623 -52.165 -52.149 1.00 46.72 C
-ATOM 31 CD2 TYR P 4 41.180 -49.879 -52.667 1.00 44.82 C
-ATOM 32 CE1 TYR P 4 41.460 -51.902 -50.818 1.00 43.67 C
-ATOM 33 CE2 TYR P 4 41.012 -49.606 -51.323 1.00 42.55 C
-ATOM 34 CZ TYR P 4 41.157 -50.628 -50.404 1.00 43.46 C
-ATOM 35 OH TYR P 4 41.011 -50.408 -49.056 1.00 41.35 O
+ATOM 29 CG TYR P 4 41.998 -50.055 -54.978 1.00 46.06 C
+ATOM 30 CD1 TYR P 4 41.317 -48.988 -54.410 1.00 46.72 C
+ATOM 31 CD2 TYR P 4 42.998 -49.773 -55.910 1.00 44.82 C
+ATOM 32 CE1 TYR P 4 41.601 -47.697 -54.757 1.00 43.67 C
+ATOM 33 CE2 TYR P 4 43.289 -48.471 -56.267 1.00 42.55 C
+ATOM 34 CZ TYR P 4 42.583 -47.436 -55.680 1.00 43.46 C
+ATOM 35 OH TYR P 4 42.841 -46.123 -55.991 1.00 41.35 O
ATOM 36 H TYR P 4 40.075 -52.092 -57.385 1.00 0.00 H
ATOM 37 HA TYR P 4 40.225 -53.043 -54.792 1.00 0.00 H
-ATOM 38 1HB TYR P 4 42.528 -52.156 -54.657 1.00 0.00 H
-ATOM 39 2HB TYR P 4 41.950 -50.547 -55.070 1.00 0.00 H
-ATOM 40 HD1 TYR P 4 41.869 -53.182 -52.453 1.00 0.00 H
-ATOM 41 HD2 TYR P 4 41.073 -49.070 -53.390 1.00 0.00 H
-ATOM 42 HE1 TYR P 4 41.575 -52.702 -50.087 1.00 0.00 H
-ATOM 43 HE2 TYR P 4 40.767 -48.594 -50.999 1.00 0.00 H
-ATOM 44 HH TYR P 4 40.807 -49.482 -48.904 1.00 0.00 H
+ATOM 38 1HB TYR P 4 41.517 -51.484 -53.494 1.00 0.00 H
+ATOM 39 2HB TYR P 4 42.560 -52.083 -54.777 1.00 0.00 H
+ATOM 40 HD1 TYR P 4 40.538 -49.170 -53.671 1.00 0.00 H
+ATOM 41 HD2 TYR P 4 43.561 -50.586 -56.368 1.00 0.00 H
+ATOM 42 HE1 TYR P 4 41.052 -46.876 -54.296 1.00 0.00 H
+ATOM 43 HE2 TYR P 4 44.067 -48.268 -57.004 1.00 0.00 H
+ATOM 44 HH TYR P 4 43.548 -46.082 -56.640 1.00 0.00 H
ATOM 45 N VAL P 5 38.621 -51.331 -53.871 1.00 49.38 N
ATOM 46 CA VAL P 5 37.505 -50.463 -53.498 1.00 49.93 C
ATOM 47 C VAL P 5 37.922 -49.521 -52.377 1.00 51.30 C
diff --git a/1_PoseIO/data/5A.pdb b/1_PoseIO/data/5A.pdb
index ad8ce4a..1762668 100644
--- a/1_PoseIO/data/5A.pdb
+++ b/1_PoseIO/data/5A.pdb
@@ -1,12 +1,12 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.31+release.c7009b3115c
ATOM 1 N ALA A 1 0.000 0.000 0.000 1.00 0.00 N
ATOM 2 CA ALA A 1 1.458 0.000 0.000 1.00 0.00 C
ATOM 3 C ALA A 1 2.009 1.420 0.000 1.00 0.00 C
diff --git a/1_PoseIO/data/insert_icode.pdb b/1_PoseIO/data/insert_icode.pdb
index 04d5937..660adb5 100644
--- a/1_PoseIO/data/insert_icode.pdb
+++ b/1_PoseIO/data/insert_icode.pdb
@@ -1,28 +1,28 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
-ATOM 1 N PRO A 1A 35.432 -0.708 7.647 1.00 49.13 N
-ATOM 2 CA PRO A 1A 35.959 0.478 8.332 1.00 38.65 C
-ATOM 3 C PRO A 1A 36.620 1.469 7.374 1.00 28.53 C
-ATOM 4 O PRO A 1A 36.946 1.110 6.240 1.00 28.02 O
-ATOM 5 CB PRO A 1A 36.987 -0.100 9.317 1.00 32.04 C
-ATOM 6 CG PRO A 1A 37.119 -1.563 8.970 1.00 40.69 C
-ATOM 7 CD PRO A 1A 35.846 -1.957 8.305 1.00 42.21 C
-ATOM 8 HA PRO A 1A 35.141 0.977 8.872 1.00 0.00 H
-ATOM 9 1HB PRO A 1A 37.944 0.434 9.218 1.00 0.00 H
-ATOM 10 2HB PRO A 1A 36.642 0.048 10.351 1.00 0.00 H
-ATOM 11 1HG PRO A 1A 37.985 -1.720 8.311 1.00 0.00 H
-ATOM 12 2HG PRO A 1A 37.300 -2.154 9.880 1.00 0.00 H
-ATOM 13 1HD PRO A 1A 36.044 -2.759 7.579 1.00 0.00 H
-ATOM 14 2HD PRO A 1A 35.123 -2.291 9.064 1.00 0.00 H
-ATOM 15 1H PRO A 1A 35.759 -0.700 6.700 1.00 0.00 H
-ATOM 16 2H PRO A 1A 34.427 -0.649 7.643 1.00 0.00 H
+REMARK 220 VERSION 2021.31+release.c7009b3115c
+ATOM 1 N PRO A 1m 35.432 -0.708 7.647 1.00 49.13 N
+ATOM 2 CA PRO A 1m 35.959 0.478 8.332 1.00 38.65 C
+ATOM 3 C PRO A 1m 36.620 1.469 7.374 1.00 28.53 C
+ATOM 4 O PRO A 1m 36.946 1.110 6.240 1.00 28.02 O
+ATOM 5 CB PRO A 1m 36.987 -0.100 9.317 1.00 32.04 C
+ATOM 6 CG PRO A 1m 37.119 -1.563 8.970 1.00 40.69 C
+ATOM 7 CD PRO A 1m 35.846 -1.957 8.305 1.00 42.21 C
+ATOM 8 HA PRO A 1m 35.141 0.977 8.872 1.00 0.00 H
+ATOM 9 1HB PRO A 1m 37.944 0.434 9.218 1.00 0.00 H
+ATOM 10 2HB PRO A 1m 36.642 0.048 10.351 1.00 0.00 H
+ATOM 11 1HG PRO A 1m 37.985 -1.720 8.311 1.00 0.00 H
+ATOM 12 2HG PRO A 1m 37.300 -2.154 9.880 1.00 0.00 H
+ATOM 13 1HD PRO A 1m 36.044 -2.759 7.579 1.00 0.00 H
+ATOM 14 2HD PRO A 1m 35.123 -2.291 9.064 1.00 0.00 H
+ATOM 15 1H PRO A 1m 35.759 -0.700 6.700 1.00 0.00 H
+ATOM 16 2H PRO A 1m 34.427 -0.649 7.643 1.00 0.00 H
ATOM 17 N SER A 2 36.815 2.698 7.838 1.00 22.66 N
ATOM 18 CA SER A 2 37.414 3.747 7.016 1.00 31.33 C
ATOM 19 C SER A 2 38.879 3.483 6.687 1.00 20.81 C
diff --git a/1_PoseIO/data/multi_AAAAA.silent b/1_PoseIO/data/multi_AAAAA.silent
index b3b4a2c..9a69a99 100644
--- a/1_PoseIO/data/multi_AAAAA.silent
+++ b/1_PoseIO/data/multi_AAAAA.silent
@@ -966,3 +966,343 @@ LbnvqAJwKnD0NJuTQoa8tApFZ3DUy2BVQGEY2AJwKNEUHa5UQ14l2ARgVcEUeprVQR2OyAtd+SDkZm5V
L99T9Apa8KEkZm5TQKc9CBNdTaEEYlrTQvJxABR14vE0jCPTQdolCBB/pAF0bSsTQam5GBFsyRE0P1oSQBWZKBhU4+DUGEITQR2uNB5OfrDkEDCSQkC3MBxKH2DkoF5QQ++JRBd++RD0coVSQJbn8AV3k8DEsyRTQJbHFBlsdcEUhrnUQlDtEBFXPME0P1wRQFDiJBlDteEUJGUSQO0CNBBBWFEEXP6TQaR2HBJaRmD0w1jTQ ./data/pose_demo.pdb
L0is5AlCXvE0coVSQ6mE1ABW5CFkvfyRQBW5sAx1jMFUbnvSQ/pGrAV46fFUhrvSQlDtvA9na+EEoacQQPKcjAx0NvEkVOkQQ8S32AZlDhEEsyBSQFue7AlsdOFU3koRQBW5tA9RhNF00N5PQ+TN1AJbn1EE/pmPQ ./data/pose_demo.pdb
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+SCORE: 0.000 ./data/pose_demo.pdb
+REMARK PDBinfo-LABEL: 2 DISULFIDIZE
+REMARK PDBinfo-LABEL: 5 DISULFIDIZE
+REMARK PDBinfo-LABEL: 11 DISULFIDIZE
+REMARK PDBinfo-LABEL: 25 DISULFIDIZE
+ANNOTATED_SEQUENCE: H[HIS:NtermProteinFull]C[CYS:disulfide]FH[HIS_D]C[CYS:disulfide]RNIRFC[CYS:disulfide]SEDEEELRRAREEC[CYS:disulfide]K[LYS:CtermProteinFull] ./data/pose_demo.pdb
+NONCANONICAL_CONNECTION: 11 SG 2 SG
+NONCANONICAL_CONNECTION: 25 SG 5 SG
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+LBrc0AtyhW+DsyxMQuz3rAFsyJA0d+eMQoa8nANc9oAkArMPQnEDmA99T1BkQglPQsyhiA9owF/jvf6KQ8S3kAx0NZ+j789HQNzMXAdSMI7DShrFQ67nmAtyheAUzMzEQXPKzAh/Uj5zMzMMQoa8uABrcABk8SXLQe++fAdTih8jvf6LQ5luXAtz3PAUPK8KQFDCsA989T8zz3vHQsyhaAhpbS4TiBhBQ03PVAJwKH8LUN+HQx1jIA57n69Ty25FQb8SoAB/pOAErcoAQjX6eA1NJGB0JxAFQGEYtAdTiBBksdeGQ ./data/pose_demo.pdb
+L5lumAxgAb/TdTiQQCBWjAFtIDAUc94RQzhWrAtyh+AUPKkSQ99ToAtco9BEueMTQxgAiApvfK9D/puSQCsyPA9mEDub0icSQ5QLMABVjH+b14dTQnvfaAhVOMAMXPSTQAAAWAxfqRBspbiSQ/UjDAR2OXBcjX6RQJGEiAVMIIC825bSQcSMoAJFu+8DShTQQW5QXAFYljAEEY1RQzMzoANJGE4TJGkSQZ78hAJwKH+TdTyTQFDCCApvfq8zMzcSQ/pGRAltz377HFeRQjX6OAJEYl8rQgdUQ/Uj3/Q141+LBWZTQtIbkAFXPKAcGEwTQZQgx/kCXnA8Ib/RQcSMAAxfqFC84lWRQmuJpAlBBGCMCs6SQGEYgA5QLiCcGE4RQ ./data/pose_demo.pdb
+LY6m1AV46pA0LdbSQdoF+AJv0dBUiBBTQbnv+AB/paCUgVWSQIFOABBqG7CEW5ATQU4aEB5P1wAUiB5SQJGEFB989D/juJxTQRLSKBZPKc9jpbiTQbnvKBJxgA7ra8SUQHaRPB9naM+rvfaUQShrTBV46x8b6m0TQ46RPBZQgNAcMIIVQEYl3Ad++p/Ty25RQCBW8ARLymB0MzEUQdTCFBZlDdAkX62RQJbnHB13PdBUNeJTQQg1EBx0Np/zbS0UQfU4BBxfqR9jU4iTQ+TtKB5Off8DFueSQiBhNB9mED/jBB2TQ35bHBltz38biBxUQhArTBdnvf4DmuRTQ6mEXBtHFe+bdT6TQQ14LB56RhAM+TlVQIwqSBJGEwAMv0NVQ ./data/pose_demo.pdb
+LamZ9Ah/UbCk++BRQbnv9AFtIDDUNeRQQ6mE1AlBBiD0d+uQQuz32AxeUEEU0i0QQJbn8A1NJ6C0hWkNQOJG8A1jC/BECsiQQvJxCBtHFSDEShbQQBW58AZPKYDkWkdMQ6mkBBZQglCkvf6MQxgA1AFXPqCEoaMNQ ./data/pose_demo.pdb
+LNeprAxJxQDU46BRQMIwiA57nqDUiBhRQLHalAh/U/DE/p2SQDCsiAdSMSE0NJGTQPKcRAtIbPDkvfqRQR2O7/ktznDkR2GSQR2Or/UjXCE01jCRQepbS+gArOE0yheRQU46h+gqxhEEaRGSQQ14t/IxgqEEUNWSQsHFW/6lurE03PdSQ67nqAFZ7wC01j6QQ1NJhAR14BEUjXyQQgqxNAVMIAD0cotQQueUUA1NJ2CkuJZSQQ14h/sxLRDULyWSQLHaBABqG7D0d++SQ+TNCA9RhNE0kYwQQLy2h/My2xD0gALQQsHFO/msdIE0FZTRQKxgEAlX6iEkArESQ7Rhv/4P14EE99zSQktz3/ygAlEUc9QSQfU4S/GDC6E0gA7SQ ./data/pose_demo.pdb
+LbnvqAJwKnD0NJuTQoa8tApFZ3DUy2BVQGEY2AJwKNEUHa5UQ14l2ARgVcEUeprVQR2OyAtd+SDkZm5VQCsypAdR2yCU14VWQkCXuARLyOC0KHKXQZ783AhVOMC00NRXQR2OoAFYlrB0gArXQrcosA1MzIDk78dTQU46mAZmZCEEBWhVQLHa4AhWkBDEFuWVQ3571AlYQgDka8yWQvJxjApFZDD0w17WQfU4lA9owlCEEYdVQ ./data/pose_demo.pdb
+L99T9Apa8KEkZm5TQKc9CBNdTaEEYlrTQvJxABR14vE0jCPTQdolCBB/pAF0bSsTQam5GBFsyRE0P1oSQBWZKBhU4+DUGEITQR2uNB5OfrDkEDCSQkC3MBxKH2DkoF5QQ++JRBd++RD0coVSQJbn8AV3k8DEsyRTQJbHFBlsdcEUhrnUQlDtEBFXPME0P1wRQFDiJBlDteEUJGUSQO0CNBBBWFEEXP6TQaR2HBJaRmD0w1jTQ ./data/pose_demo.pdb
+L0is5AlCXvE0coVSQ6mE1ABW5CFkvfyRQBW5sAx1jMFUbnvSQ/pGrAV46fFUhrvSQlDtvA9na+EEoacQQPKcjAx0NvEkVOkQQ8S32AZlDhEEsyBSQFue7AlsdOFU3koRQBW5tA9RhNF00N5PQ+TN1AJbn1EE/pmPQ ./data/pose_demo.pdb
+LKc9nApa8+EUepjTQgVOgA9TNGFUzMjUQGZ7kA5luXFEShbVQEYluAxeUYFkU4qVQamZeAtxLlFkZm5VQjX6YAxLdzEUjXaVQU46HA56R5EkVOcWQ1NJAApZmlE0hWMXQgVOc/kCXrEkU4GYQnvf6+kYQYEEFueYQY6mpAJwKvE0jCfTQsyhSA14lMFEsyBUQVjXSApa8mEUHaxUQlYQjAB/psEU0i8VQO0iOAhArEFk++JXQlDt0/MIwAFUPK8VQ2jCz/sHFaEEqGfWQEYlNA1NJeEEEYtXQ/pGr/cR22E0fqdYQc9ow9QLyyEEEYtXQ2Off+OIwcEEDC0YQjsde9IbnNEU46JYQkCXn/sIbREkmZuYQ ./data/pose_demo.pdb
diff --git a/1_PoseIO/data/output.pdb b/1_PoseIO/data/output.pdb
index f6c2084..1a4b6ce 100644
--- a/1_PoseIO/data/output.pdb
+++ b/1_PoseIO/data/output.pdb
@@ -1,12 +1,12 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.31+release.c7009b3115c
SSBOND CYS A 2 CYS A 11 2.07
SSBOND CYS A 5 CYS A 25 2.03
ATOM 1 N HIS A 1 0.000 0.000 0.000 1.00 0.00 N
diff --git a/1_PoseIO/data/ptm.pdb b/1_PoseIO/data/ptm.pdb
index 3bc108d..fb55e21 100644
--- a/1_PoseIO/data/ptm.pdb
+++ b/1_PoseIO/data/ptm.pdb
@@ -1,12 +1,12 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.31+release.c7009b3115c
ATOM 1 N GLY P 2 39.100 -52.568 -62.320 1.00 64.55 N
ATOM 2 CA GLY P 2 39.676 -51.920 -61.152 1.00 61.86 C
ATOM 3 C GLY P 2 40.413 -52.886 -60.239 1.00 61.32 C
diff --git a/1_PoseIO/data/sub_region.pdb b/1_PoseIO/data/sub_region.pdb
index abb3d5d..5b78fb2 100644
--- a/1_PoseIO/data/sub_region.pdb
+++ b/1_PoseIO/data/sub_region.pdb
@@ -1,12 +1,12 @@
-HEADER 12-JUN-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 12-JUN-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2021.18+release.54b4909cd52
+REMARK 220 VERSION 2021.31+release.c7009b3115c
ATOM 1 N PRO A 1 35.432 -0.708 7.647 1.00 0.00 N
ATOM 2 CA PRO A 1 35.959 0.478 8.332 1.00 0.00 C
ATOM 3 C PRO A 1 36.620 1.469 7.374 1.00 0.00 C
diff --git a/1_PoseIO/data/trans.pdb b/1_PoseIO/data/trans.pdb
index 67d52e9..b2ddffc 100644
--- a/1_PoseIO/data/trans.pdb
+++ b/1_PoseIO/data/trans.pdb
@@ -1,137 +1,137 @@
-HEADER 11-MAY-21 XXXX
+HEADER 23-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 11-MAY-21
+REMARK 220 DATE OF DATA COLLECTION : 23-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
-ATOM 1 N GLY P 2 45.100 -46.568 -56.320 1.00 64.55 N
-ATOM 2 CA GLY P 2 45.676 -45.920 -55.152 1.00 61.86 C
-ATOM 3 C GLY P 2 46.413 -46.886 -54.239 1.00 61.32 C
-ATOM 4 O GLY P 2 46.157 -48.094 -54.261 1.00 64.58 O
-ATOM 5 1H GLY P 2 44.630 -45.887 -56.882 1.00 0.00 H
-ATOM 6 2H GLY P 2 45.827 -46.997 -56.856 1.00 0.00 H
-ATOM 7 3H GLY P 2 44.447 -47.266 -56.026 1.00 0.00 H
-ATOM 8 1HA GLY P 2 46.370 -45.142 -55.472 1.00 0.00 H
-ATOM 9 2HA GLY P 2 44.887 -45.431 -54.581 1.00 0.00 H
-ATOM 10 N ASN P 3 47.325 -46.353 -53.427 1.00 54.80 N
-ATOM 11 CA ASN P 3 48.132 -47.181 -52.527 1.00 53.77 C
-ATOM 12 C ASN P 3 47.906 -46.918 -51.038 1.00 50.52 C
-ATOM 13 O ASN P 3 48.776 -47.216 -50.219 1.00 48.56 O
-ATOM 14 CB ASN P 3 49.634 -47.050 -52.856 1.00 53.12 C
-ATOM 15 CG ASN P 3 50.216 -45.684 -52.472 1.00 51.72 C
-ATOM 16 OD1 ASN P 3 49.484 -44.754 -52.144 1.00 45.00 O
-ATOM 17 ND2 ASN P 3 51.545 -45.567 -52.519 1.00 45.35 N
-ATOM 18 H ASN P 3 47.464 -45.353 -53.432 1.00 0.00 H
-ATOM 19 HA ASN P 3 47.839 -48.224 -52.660 1.00 0.00 H
-ATOM 20 1HB ASN P 3 50.191 -47.826 -52.329 1.00 0.00 H
-ATOM 21 2HB ASN P 3 49.787 -47.205 -53.924 1.00 0.00 H
-ATOM 22 1HD2 ASN P 3 51.980 -44.698 -52.279 1.00 0.00 H
-ATOM 23 2HD2 ASN P 3 52.106 -46.347 -52.794 1.00 0.00 H
-ATOM 24 N TYR P 4 46.756 -46.351 -50.685 1.00 48.04 N
-ATOM 25 CA TYR P 4 46.454 -46.088 -49.240 1.00 48.07 C
-ATOM 26 C TYR P 4 46.467 -46.040 -47.708 1.00 48.72 C
-ATOM 27 O TYR P 4 45.913 -45.126 -47.105 1.00 48.66 O
-ATOM 28 CB TYR P 4 47.669 -45.471 -48.538 1.00 46.30 C
-ATOM 29 CG TYR P 4 47.475 -45.163 -47.069 1.00 46.06 C
-ATOM 30 CD1 TYR P 4 47.615 -46.158 -46.113 1.00 46.72 C
-ATOM 31 CD2 TYR P 4 47.173 -43.873 -46.632 1.00 44.82 C
-ATOM 32 CE1 TYR P 4 47.452 -45.896 -44.782 1.00 43.67 C
-ATOM 33 CE2 TYR P 4 47.005 -43.599 -45.288 1.00 42.55 C
-ATOM 34 CZ TYR P 4 47.149 -44.622 -44.368 1.00 43.46 C
-ATOM 35 OH TYR P 4 47.004 -44.401 -43.020 1.00 41.35 O
-ATOM 36 H TYR P 4 46.075 -46.092 -51.385 1.00 0.00 H
-ATOM 37 HA TYR P 4 46.218 -47.036 -48.757 1.00 0.00 H
-ATOM 38 1HB TYR P 4 48.520 -46.149 -48.621 1.00 0.00 H
-ATOM 39 2HB TYR P 4 47.943 -44.541 -49.035 1.00 0.00 H
-ATOM 40 HD1 TYR P 4 47.861 -47.176 -46.418 1.00 0.00 H
-ATOM 41 HD2 TYR P 4 47.066 -43.063 -47.354 1.00 0.00 H
-ATOM 42 HE1 TYR P 4 47.568 -46.695 -44.051 1.00 0.00 H
-ATOM 43 HE2 TYR P 4 46.760 -42.587 -44.964 1.00 0.00 H
-ATOM 44 HH TYR P 4 46.800 -43.475 -42.869 1.00 0.00 H
-ATOM 45 N VAL P 5 47.109 -47.026 -47.088 1.00 49.38 N
-ATOM 46 CA VAL P 5 47.299 -47.021 -45.639 1.00 49.93 C
-ATOM 47 C VAL P 5 48.773 -46.839 -45.299 1.00 51.30 C
-ATOM 48 O VAL P 5 49.656 -47.118 -46.121 1.00 47.92 O
-ATOM 49 CB VAL P 5 46.755 -48.305 -44.960 1.00 51.84 C
-ATOM 50 CG1 VAL P 5 45.253 -48.400 -45.138 1.00 55.13 C
-ATOM 51 CG2 VAL P 5 47.436 -49.535 -45.518 1.00 52.15 C
-ATOM 52 H VAL P 5 47.475 -47.796 -47.629 1.00 0.00 H
-ATOM 53 HA VAL P 5 46.755 -46.172 -45.221 1.00 0.00 H
-ATOM 54 HB VAL P 5 46.946 -48.247 -43.888 1.00 0.00 H
-ATOM 55 1HG1 VAL P 5 44.886 -49.306 -44.656 1.00 0.00 H
-ATOM 56 2HG1 VAL P 5 44.777 -47.530 -44.684 1.00 0.00 H
-ATOM 57 3HG1 VAL P 5 45.014 -48.432 -46.201 1.00 0.00 H
-ATOM 58 1HG2 VAL P 5 47.040 -50.424 -45.028 1.00 0.00 H
-ATOM 59 2HG2 VAL P 5 47.251 -49.599 -46.591 1.00 0.00 H
-ATOM 60 3HG2 VAL P 5 48.509 -49.470 -45.339 1.00 0.00 H
-ATOM 61 N VAL P 6 49.031 -46.353 -44.090 1.00 48.75 N
-ATOM 62 CA VAL P 6 50.392 -46.109 -43.626 1.00 47.73 C
-ATOM 63 C VAL P 6 50.675 -46.937 -42.371 1.00 48.91 C
-ATOM 64 O VAL P 6 51.659 -47.678 -42.304 1.00 48.87 O
-ATOM 65 CB VAL P 6 50.639 -44.607 -43.346 1.00 46.36 C
-ATOM 66 CG1 VAL P 6 51.970 -44.410 -42.636 1.00 45.56 C
-ATOM 67 CG2 VAL P 6 50.596 -43.813 -44.650 1.00 45.02 C
-ATOM 68 H VAL P 6 48.257 -46.147 -43.474 1.00 0.00 H
-ATOM 69 HA VAL P 6 51.085 -46.427 -44.405 1.00 0.00 H
-ATOM 70 HB VAL P 6 49.864 -44.239 -42.674 1.00 0.00 H
-ATOM 71 1HG1 VAL P 6 52.128 -43.348 -42.447 1.00 0.00 H
-ATOM 72 2HG1 VAL P 6 51.960 -44.949 -41.689 1.00 0.00 H
-ATOM 73 3HG1 VAL P 6 52.777 -44.790 -43.263 1.00 0.00 H
-ATOM 74 1HG2 VAL P 6 50.771 -42.758 -44.439 1.00 0.00 H
-ATOM 75 2HG2 VAL P 6 51.368 -44.181 -45.326 1.00 0.00 H
-ATOM 76 3HG2 VAL P 6 49.618 -43.932 -45.116 1.00 0.00 H
-ATOM 77 N THR P 7 49.806 -46.812 -41.375 1.00 50.00 N
-ATOM 78 CA THR P 7 49.922 -47.642 -40.186 1.00 52.99 C
-ATOM 79 C THR P 7 49.162 -48.938 -40.406 1.00 56.18 C
-ATOM 80 O THR P 7 47.930 -48.944 -40.382 1.00 58.95 O
-ATOM 81 CB THR P 7 49.359 -46.941 -38.941 1.00 52.47 C
-ATOM 82 OG1 THR P 7 50.019 -45.684 -38.763 1.00 50.28 O
-ATOM 83 CG2 THR P 7 49.570 -47.820 -37.697 1.00 54.40 C
-ATOM 84 H THR P 7 49.056 -46.139 -41.433 1.00 0.00 H
-ATOM 85 HA THR P 7 50.978 -47.846 -40.008 1.00 0.00 H
-ATOM 86 HB THR P 7 48.293 -46.758 -39.077 1.00 0.00 H
-ATOM 87 HG1 THR P 7 50.665 -45.561 -39.462 1.00 0.00 H
-ATOM 88 1HG2 THR P 7 49.167 -47.313 -36.821 1.00 0.00 H
-ATOM 89 2HG2 THR P 7 49.058 -48.772 -37.834 1.00 0.00 H
-ATOM 90 3HG2 THR P 7 50.635 -47.998 -37.554 1.00 0.00 H
-HETATM 91 N PTR P 8 49.893 -50.034 -40.611 1.00 53.25 N
-HETATM 92 CA PTR P 8 49.273 -51.319 -40.919 1.00 55.86 C
-HETATM 93 C PTR P 8 50.119 -52.376 -40.306 1.00 57.13 C
-HETATM 94 O PTR P 8 51.233 -52.592 -40.748 1.00 54.55 O
-HETATM 95 CB PTR P 8 49.154 -51.615 -42.403 1.00 57.39 C
-HETATM 96 CG PTR P 8 48.175 -52.713 -42.836 1.00 61.77 C
-HETATM 97 CD1 PTR P 8 48.594 -54.022 -43.124 1.00 62.82 C
-HETATM 98 CD2 PTR P 8 46.827 -52.381 -42.949 1.00 66.09 C
-HETATM 99 CE1 PTR P 8 47.652 -54.991 -43.515 1.00 67.82 C
-HETATM 100 CE2 PTR P 8 45.895 -53.339 -43.341 1.00 69.61 C
-HETATM 101 CZ PTR P 8 46.298 -54.645 -43.631 1.00 72.98 C
-HETATM 102 OH PTR P 8 45.333 -55.528 -43.986 1.00 78.18 O
-HETATM 103 P PTR P 8 45.558 -56.770 -44.896 1.00106.91 P
-HETATM 104 O1P PTR P 8 46.286 -57.849 -44.105 1.00108.23 O
-HETATM 105 O2P PTR P 8 44.213 -57.294 -45.319 1.00108.16 O
-HETATM 106 O3P PTR P 8 46.354 -56.380 -46.118 1.00105.12 O
-HETATM 107 H PTR P 8 50.900 -49.975 -40.552 1.00 0.00 H
-HETATM 108 HA PTR P 8 48.261 -51.321 -40.515 1.00 0.00 H
-HETATM 109 1HB PTR P 8 48.847 -50.711 -42.931 1.00 0.00 H
-HETATM 110 2HB PTR P 8 50.128 -51.908 -42.795 1.00 0.00 H
-HETATM 111 HD1 PTR P 8 49.649 -54.287 -43.045 1.00 0.00 H
-HETATM 112 HD2 PTR P 8 46.495 -51.366 -42.730 1.00 0.00 H
-HETATM 113 HE1 PTR P 8 47.977 -56.007 -43.740 1.00 0.00 H
-HETATM 114 HE2 PTR P 8 44.841 -53.072 -43.425 1.00 0.00 H
-ATOM 115 N ALA P 9 49.598 -53.043 -39.280 1.00 56.99 N
-ATOM 116 CA ALA P 9 50.305 -54.153 -38.656 1.00 63.33 C
-ATOM 117 C ALA P 9 50.148 -55.411 -39.509 1.00 66.02 C
-ATOM 118 O ALA P 9 51.122 -56.059 -39.899 1.00 63.73 O
-ATOM 119 OXT ALA P 9 49.031 -55.805 -39.840 1.00 70.95 O
-ATOM 120 CB ALA P 9 49.779 -54.395 -37.240 1.00 59.28 C
-ATOM 121 H ALA P 9 48.692 -52.775 -38.925 1.00 0.00 H
-ATOM 122 HA ALA P 9 51.362 -53.892 -38.599 1.00 0.00 H
-ATOM 123 1HB ALA P 9 50.318 -55.228 -36.788 1.00 0.00 H
-ATOM 124 2HB ALA P 9 49.927 -53.498 -36.638 1.00 0.00 H
-ATOM 125 3HB ALA P 9 48.717 -54.631 -37.282 1.00 0.00 H
+REMARK 220 VERSION 2021.31+release.c7009b3115c
+ATOM 1 N GLY P 2 42.100 -49.568 -59.320 1.00 64.55 N
+ATOM 2 CA GLY P 2 42.676 -48.920 -58.152 1.00 61.86 C
+ATOM 3 C GLY P 2 43.413 -49.886 -57.239 1.00 61.32 C
+ATOM 4 O GLY P 2 43.157 -51.094 -57.261 1.00 64.58 O
+ATOM 5 1H GLY P 2 41.630 -48.887 -59.882 1.00 0.00 H
+ATOM 6 2H GLY P 2 42.827 -49.997 -59.856 1.00 0.00 H
+ATOM 7 3H GLY P 2 41.447 -50.266 -59.026 1.00 0.00 H
+ATOM 8 1HA GLY P 2 43.370 -48.142 -58.472 1.00 0.00 H
+ATOM 9 2HA GLY P 2 41.887 -48.431 -57.581 1.00 0.00 H
+ATOM 10 N ASN P 3 44.325 -49.353 -56.427 1.00 54.80 N
+ATOM 11 CA ASN P 3 45.132 -50.181 -55.527 1.00 53.77 C
+ATOM 12 C ASN P 3 44.906 -49.918 -54.038 1.00 50.52 C
+ATOM 13 O ASN P 3 45.776 -50.216 -53.219 1.00 48.56 O
+ATOM 14 CB ASN P 3 46.634 -50.050 -55.856 1.00 53.12 C
+ATOM 15 CG ASN P 3 47.216 -48.684 -55.472 1.00 51.72 C
+ATOM 16 OD1 ASN P 3 46.484 -47.754 -55.144 1.00 45.00 O
+ATOM 17 ND2 ASN P 3 48.545 -48.567 -55.519 1.00 45.35 N
+ATOM 18 H ASN P 3 44.464 -48.353 -56.432 1.00 0.00 H
+ATOM 19 HA ASN P 3 44.839 -51.224 -55.660 1.00 0.00 H
+ATOM 20 1HB ASN P 3 47.191 -50.826 -55.329 1.00 0.00 H
+ATOM 21 2HB ASN P 3 46.787 -50.205 -56.924 1.00 0.00 H
+ATOM 22 1HD2 ASN P 3 48.980 -47.698 -55.279 1.00 0.00 H
+ATOM 23 2HD2 ASN P 3 49.106 -49.347 -55.794 1.00 0.00 H
+ATOM 24 N TYR P 4 43.756 -49.351 -53.685 1.00 48.04 N
+ATOM 25 CA TYR P 4 43.454 -49.088 -52.240 1.00 48.07 C
+ATOM 26 C TYR P 4 43.467 -49.040 -50.708 1.00 48.72 C
+ATOM 27 O TYR P 4 42.913 -48.126 -50.105 1.00 48.66 O
+ATOM 28 CB TYR P 4 44.669 -48.471 -51.538 1.00 46.30 C
+ATOM 29 CG TYR P 4 44.475 -48.163 -50.069 1.00 46.06 C
+ATOM 30 CD1 TYR P 4 44.615 -49.158 -49.113 1.00 46.72 C
+ATOM 31 CD2 TYR P 4 44.173 -46.873 -49.632 1.00 44.82 C
+ATOM 32 CE1 TYR P 4 44.452 -48.896 -47.782 1.00 43.67 C
+ATOM 33 CE2 TYR P 4 44.005 -46.599 -48.288 1.00 42.55 C
+ATOM 34 CZ TYR P 4 44.149 -47.622 -47.368 1.00 43.46 C
+ATOM 35 OH TYR P 4 44.004 -47.401 -46.020 1.00 41.35 O
+ATOM 36 H TYR P 4 43.075 -49.092 -54.385 1.00 0.00 H
+ATOM 37 HA TYR P 4 43.218 -50.036 -51.757 1.00 0.00 H
+ATOM 38 1HB TYR P 4 45.520 -49.149 -51.621 1.00 0.00 H
+ATOM 39 2HB TYR P 4 44.943 -47.541 -52.035 1.00 0.00 H
+ATOM 40 HD1 TYR P 4 44.861 -50.176 -49.418 1.00 0.00 H
+ATOM 41 HD2 TYR P 4 44.066 -46.063 -50.354 1.00 0.00 H
+ATOM 42 HE1 TYR P 4 44.568 -49.695 -47.051 1.00 0.00 H
+ATOM 43 HE2 TYR P 4 43.760 -45.587 -47.964 1.00 0.00 H
+ATOM 44 HH TYR P 4 43.800 -46.475 -45.869 1.00 0.00 H
+ATOM 45 N VAL P 5 44.109 -50.026 -50.088 1.00 49.38 N
+ATOM 46 CA VAL P 5 44.299 -50.021 -48.639 1.00 49.93 C
+ATOM 47 C VAL P 5 45.773 -49.839 -48.299 1.00 51.30 C
+ATOM 48 O VAL P 5 46.656 -50.118 -49.121 1.00 47.92 O
+ATOM 49 CB VAL P 5 43.755 -51.305 -47.960 1.00 51.84 C
+ATOM 50 CG1 VAL P 5 42.253 -51.400 -48.138 1.00 55.13 C
+ATOM 51 CG2 VAL P 5 44.436 -52.535 -48.518 1.00 52.15 C
+ATOM 52 H VAL P 5 44.475 -50.796 -50.629 1.00 0.00 H
+ATOM 53 HA VAL P 5 43.755 -49.172 -48.221 1.00 0.00 H
+ATOM 54 HB VAL P 5 43.946 -51.247 -46.888 1.00 0.00 H
+ATOM 55 1HG1 VAL P 5 41.886 -52.306 -47.656 1.00 0.00 H
+ATOM 56 2HG1 VAL P 5 41.777 -50.530 -47.684 1.00 0.00 H
+ATOM 57 3HG1 VAL P 5 42.014 -51.432 -49.201 1.00 0.00 H
+ATOM 58 1HG2 VAL P 5 44.040 -53.424 -48.028 1.00 0.00 H
+ATOM 59 2HG2 VAL P 5 44.251 -52.599 -49.591 1.00 0.00 H
+ATOM 60 3HG2 VAL P 5 45.509 -52.470 -48.339 1.00 0.00 H
+ATOM 61 N VAL P 6 46.031 -49.353 -47.090 1.00 48.75 N
+ATOM 62 CA VAL P 6 47.392 -49.109 -46.626 1.00 47.73 C
+ATOM 63 C VAL P 6 47.675 -49.937 -45.371 1.00 48.91 C
+ATOM 64 O VAL P 6 48.659 -50.678 -45.304 1.00 48.87 O
+ATOM 65 CB VAL P 6 47.639 -47.607 -46.346 1.00 46.36 C
+ATOM 66 CG1 VAL P 6 48.970 -47.410 -45.636 1.00 45.56 C
+ATOM 67 CG2 VAL P 6 47.596 -46.813 -47.650 1.00 45.02 C
+ATOM 68 H VAL P 6 45.257 -49.147 -46.474 1.00 0.00 H
+ATOM 69 HA VAL P 6 48.085 -49.427 -47.405 1.00 0.00 H
+ATOM 70 HB VAL P 6 46.864 -47.239 -45.674 1.00 0.00 H
+ATOM 71 1HG1 VAL P 6 49.128 -46.348 -45.447 1.00 0.00 H
+ATOM 72 2HG1 VAL P 6 48.960 -47.949 -44.689 1.00 0.00 H
+ATOM 73 3HG1 VAL P 6 49.777 -47.790 -46.263 1.00 0.00 H
+ATOM 74 1HG2 VAL P 6 47.771 -45.758 -47.439 1.00 0.00 H
+ATOM 75 2HG2 VAL P 6 48.368 -47.181 -48.326 1.00 0.00 H
+ATOM 76 3HG2 VAL P 6 46.618 -46.932 -48.116 1.00 0.00 H
+ATOM 77 N THR P 7 46.806 -49.812 -44.375 1.00 50.00 N
+ATOM 78 CA THR P 7 46.922 -50.642 -43.186 1.00 52.99 C
+ATOM 79 C THR P 7 46.162 -51.938 -43.406 1.00 56.18 C
+ATOM 80 O THR P 7 44.930 -51.944 -43.382 1.00 58.95 O
+ATOM 81 CB THR P 7 46.359 -49.941 -41.941 1.00 52.47 C
+ATOM 82 OG1 THR P 7 47.019 -48.684 -41.763 1.00 50.28 O
+ATOM 83 CG2 THR P 7 46.570 -50.820 -40.697 1.00 54.40 C
+ATOM 84 H THR P 7 46.056 -49.139 -44.433 1.00 0.00 H
+ATOM 85 HA THR P 7 47.978 -50.846 -43.008 1.00 0.00 H
+ATOM 86 HB THR P 7 45.293 -49.758 -42.077 1.00 0.00 H
+ATOM 87 HG1 THR P 7 47.665 -48.561 -42.462 1.00 0.00 H
+ATOM 88 1HG2 THR P 7 46.167 -50.313 -39.821 1.00 0.00 H
+ATOM 89 2HG2 THR P 7 46.058 -51.772 -40.834 1.00 0.00 H
+ATOM 90 3HG2 THR P 7 47.635 -50.998 -40.554 1.00 0.00 H
+HETATM 91 N PTR P 8 46.893 -53.034 -43.611 1.00 53.25 N
+HETATM 92 CA PTR P 8 46.273 -54.319 -43.919 1.00 55.86 C
+HETATM 93 C PTR P 8 47.119 -55.376 -43.306 1.00 57.13 C
+HETATM 94 O PTR P 8 48.233 -55.592 -43.748 1.00 54.55 O
+HETATM 95 CB PTR P 8 46.154 -54.615 -45.403 1.00 57.39 C
+HETATM 96 CG PTR P 8 45.175 -55.713 -45.836 1.00 61.77 C
+HETATM 97 CD1 PTR P 8 45.594 -57.022 -46.124 1.00 62.82 C
+HETATM 98 CD2 PTR P 8 43.827 -55.381 -45.949 1.00 66.09 C
+HETATM 99 CE1 PTR P 8 44.652 -57.991 -46.515 1.00 67.82 C
+HETATM 100 CE2 PTR P 8 42.895 -56.339 -46.341 1.00 69.61 C
+HETATM 101 CZ PTR P 8 43.298 -57.645 -46.631 1.00 72.98 C
+HETATM 102 OH PTR P 8 42.333 -58.528 -46.986 1.00 78.18 O
+HETATM 103 P PTR P 8 42.558 -59.770 -47.896 1.00106.91 P
+HETATM 104 O1P PTR P 8 43.286 -60.849 -47.105 1.00108.23 O
+HETATM 105 O2P PTR P 8 41.213 -60.294 -48.319 1.00108.16 O
+HETATM 106 O3P PTR P 8 43.354 -59.380 -49.118 1.00105.12 O
+HETATM 107 H PTR P 8 47.900 -52.975 -43.552 1.00 0.00 H
+HETATM 108 HA PTR P 8 45.261 -54.321 -43.515 1.00 0.00 H
+HETATM 109 1HB PTR P 8 45.847 -53.711 -45.931 1.00 0.00 H
+HETATM 110 2HB PTR P 8 47.128 -54.908 -45.795 1.00 0.00 H
+HETATM 111 HD1 PTR P 8 46.649 -57.287 -46.045 1.00 0.00 H
+HETATM 112 HD2 PTR P 8 43.495 -54.366 -45.730 1.00 0.00 H
+HETATM 113 HE1 PTR P 8 44.977 -59.007 -46.740 1.00 0.00 H
+HETATM 114 HE2 PTR P 8 41.841 -56.072 -46.425 1.00 0.00 H
+ATOM 115 N ALA P 9 46.598 -56.043 -42.280 1.00 56.99 N
+ATOM 116 CA ALA P 9 47.305 -57.153 -41.656 1.00 63.33 C
+ATOM 117 C ALA P 9 47.148 -58.411 -42.509 1.00 66.02 C
+ATOM 118 O ALA P 9 48.122 -59.059 -42.899 1.00 63.73 O
+ATOM 119 OXT ALA P 9 46.031 -58.805 -42.840 1.00 70.95 O
+ATOM 120 CB ALA P 9 46.779 -57.395 -40.240 1.00 59.28 C
+ATOM 121 H ALA P 9 45.692 -55.775 -41.925 1.00 0.00 H
+ATOM 122 HA ALA P 9 48.362 -56.892 -41.599 1.00 0.00 H
+ATOM 123 1HB ALA P 9 47.318 -58.228 -39.788 1.00 0.00 H
+ATOM 124 2HB ALA P 9 46.927 -56.498 -39.638 1.00 0.00 H
+ATOM 125 3HB ALA P 9 45.717 -57.631 -40.282 1.00 0.00 H
TER
CONECT 79 91
CONECT 91 79 92 107
diff --git a/2_Energy/.ipynb_checkpoints/2_1_Atom_Model-checkpoint.ipynb b/2_Energy/.ipynb_checkpoints/2_1_Atom_Model-checkpoint.ipynb
index c000063..828a605 100644
--- a/2_Energy/.ipynb_checkpoints/2_1_Atom_Model-checkpoint.ipynb
+++ b/2_Energy/.ipynb_checkpoints/2_1_Atom_Model-checkpoint.ipynb
@@ -17,9 +17,9 @@
"\n",
"@pictures: partly from weikun.wu@xtalpi.com\n",
"\n",
- "经过第一章的学习，我们知道在pyrosetta中通过conformation层储存、控制了构象的信息。\n",
+ "经过第一章的学习，我们知道在pyrosetta中通过Pose储存构象的所有信息。\n",
"\n",
- "对于一个大分子构象而言，例如一个简单的含有一个蛋白Model的PDB文件，rosetta对其中构象的处理主要分为**全原子描述**（Full atom representation）和**质心描述**（centriod representation）。\n",
+ "对于一个大分子构象而言，例如一个简单的含有一个蛋白Model的PDB文件，Rosetta对其中构象的处理主要分为**全原子描述**（Full atom representation）和**质心描述**（centriod representation）。\n",
"\n",
"**全原子描述**，即对蛋白的所有原子都采用精确（x, y, z）坐标进行描述的方法。相比之下，**质心描述**保留骨架部分的精确全原子描述，但简化了氨基酸残基的侧链，通过对残基整体性质（坐标、原子质量、体积等）计算构建出一个假原子（pseudo atom，又称CEN原子），以该假原子作为原本侧链剩余部分的描述。侧链质心的位置基于侧链整体的质心决定，而假原子的大小由侧链的平均大小决定。可见，这种处理方式简化了蛋白构象，或者说丢失了部分信息，是一种“**粗粒化**”的描述。\n",
"\n",
@@ -37,9 +37,16 @@
"\n",
"**总结**\n",
"\n",
- "这种两种原子模型在rosetta大部分protocal中都会涉及到。基本思路：首先通过质心粗颗粒描述快速搜索大量的构象空间，称为“low-resolution/Coarse-grain phase”，这样可以快速在能量面上找到能量较低的范围；然后通过全原子描述在该范围内进一步精确、优化地寻找低能构象的细节，称为“high-resolution refinement phase”。\n",
+ "这种两种原子模型在rosetta大部分protocal中都会涉及到。基本思路：首先通过质心粗颗粒描述快速搜索大量的构象空间，称为“low-resolution/Coarse-grain phase”，这样可以快速在能量面上找到能量较低的范围；然后通过全原子描述在该范围内进一步精确、优化地寻找低能构象的细节，称为“high-resolution refinement phase”。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "
\n",
"\n",
- ""
+ "(图片来源: google搜索拼接)"
]
},
{
@@ -49,6 +56,13 @@
"### 一、单个氨基酸全原子和质心描述的直观感受"
]
},
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "在Rosetta中，PDB的读入默认采取全原子的方式进行表示。"
+ ]
+ },
{
"cell_type": "code",
"execution_count": 1,
@@ -58,13 +72,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.Release.python36.ubuntu 2020.28+release.8ecab77aa50ac1301efe53641e07e09ac91fee3b 2020-07-07T16:41:06] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
- "\u001b[0mcore.init: \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: \u001b[0mRosetta version: PyRosetta4.Release.python36.ubuntu r260 2020.28+release.8ecab77aa50 8ecab77aa50ac1301efe53641e07e09ac91fee3b http://www.pyrosetta.org 2020-07-07T16:41:06\n",
- "\u001b[0mcore.init: \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=916345825 seed_offset=0 real_seed=916345825\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0mRandomGenerator:init: Normal mode, seed=916345825 RG_type=mt19937\n"
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-850433861 seed_offset=0 real_seed=-850433861 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-850433861 RG_type=mt19937\n"
]
}
],
@@ -82,8 +96,8 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mFinished initializing fa_standard residue type set. Created 981 residue types\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mTotal time to initialize 0.921875 seconds.\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 984 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.692792 seconds.\n",
"Is the pose a full-atom description?\n",
" True\n"
]
@@ -112,6 +126,13 @@
"pose.dump_pdb(\"./data/trp_fullatom.pdb\")"
]
},
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "当Pose的表示形式需要转换时，可以使用相关的函数来实现(SwitchResidueTypeSetMover)"
+ ]
+ },
{
"cell_type": "code",
"execution_count": 3,
@@ -121,8 +142,8 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mFinished initializing centroid residue type set. Created 69 residue types\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mTotal time to initialize 0.046875 seconds.\n"
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing centroid residue type set. Created 69 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.023072 seconds.\n"
]
},
{
@@ -163,6 +184,7 @@
"\n",
"这里顺带强调一下PDB文件，我们用文本编辑器打开trp_centroid.pdb文件，如下：\n",
"\n",
+ "```\n",
"ATOM 1 N TRP A 1 0.000 0.000 0.000 1.00 0.00 N \n",
"ATOM 2 CA TRP A 1 1.458 0.000 0.000 1.00 0.00 C \n",
"ATOM 3 C TRP A 1 2.009 1.420 0.000 1.00 0.00 C \n",
@@ -171,6 +193,7 @@
"ATOM 6 **CEN** TRP A 1 2.937 -2.180 -1.648 1.00 0.00 X \n",
"ATOM 7 H TRP A 1 -0.500 -0.433 -0.750 1.00 0.00 H \n",
"TER\n",
+ "```\n",
"\n",
"可以看到Trp侧链的假原子名字为**CEN**。（请打开trp_fullatom.pdb查看其中的ATOM描述，观察差别）"
]
@@ -180,7 +203,7 @@
"metadata": {},
"source": [
"### 二、一个更“有趣”的例子\n",
- "\n",
+ "接下来的案例，我们将展示Rosetta对PDB->Pose过程中的处理逻辑，实现过程:\n",
"1. 从PDB库中下载的1ubq.pdb文件，并进行简单处理\n",
"2. 转化为质心描述，保存质心描述的构象为PDB\n",
"3. 将该质心描述的构象再转化为全原子描述（称为new_fullatom）\n",
@@ -196,7 +219,7 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile '1UBQ.clean.pdb' automatically determined to be of type PDB\n"
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile '1UBQ.clean.pdb' automatically determined to be of type PDB\n"
]
}
],
@@ -249,7 +272,7 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
]
}
],
@@ -301,486 +324,490 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile './data/1ubq_clean_centroid.pdb' automatically determined to be of type PDB\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 1 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: MET:NtermProteinFull\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 2 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 3 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 4 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PHE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 5 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 6 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 7 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 8 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 9 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 10 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 11 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 12 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 13 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 14 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 15 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 16 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 17 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 18 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 19 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 20 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 21 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 22 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 23 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 24 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 25 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 26 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 27 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 28 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ALA\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 29 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 30 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 31 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 32 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 33 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 34 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 35 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 36 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 37 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 38 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 39 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 40 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 41 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 42 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 43 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 44 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 45 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PHE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 46 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ALA\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 47 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 48 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 49 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 50 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 51 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 52 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 53 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 54 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 55 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 56 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 57 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 58 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 59 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: TYR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 60 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 61 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 62 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 63 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 64 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 65 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 66 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 67 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 68 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: HIS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 69 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 70 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 71 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 72 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 73 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 74 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 75 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 76 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY:CtermProteinFull\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue MET:NtermProteinFull 1\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: SD on residue MET:NtermProteinFull 1\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue MET:NtermProteinFull 1\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 2\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 2\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 2\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 2\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 3\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 3\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 3\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 5\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 5\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 6\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 6\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 6\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 6\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 7\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 7\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 8\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 8\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 8\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 9\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 9\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 11\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 11\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 11\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 11\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 12\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 12\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 13\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 13\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 13\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 14\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 14\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 15\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 15\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 15\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 16\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 16\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 16\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 16\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 17\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 17\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 18\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 18\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 18\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 18\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 19\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 19\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 20\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 21\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 21\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 21\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 22\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 22\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 23\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 23\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 23\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 24\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 24\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 24\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 24\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASN 25\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASN 25\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND2 on residue ASN 25\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 26\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 26\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 27\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 27\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 27\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 27\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 29\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 29\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 29\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 29\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 30\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 30\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 30\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 31\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 31\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 31\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 31\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 32\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 32\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 32\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 33\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 33\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 33\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 33\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 34\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 34\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 34\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 34\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 36\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 36\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 36\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 37\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 37\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 38\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 38\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 39\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 39\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 39\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 40\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 40\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 40\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 40\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 41\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 41\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 41\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 41\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 43\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 43\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 43\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 44\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 44\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 44\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 48\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 48\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 48\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 48\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 49\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 49\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 49\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 49\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 50\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 50\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 50\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 51\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 51\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 51\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 51\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 52\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 52\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 52\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 55\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 55\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 56\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 56\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 56\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 57\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 58\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 58\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 58\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OH on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASN 60\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASN 60\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND2 on residue ASN 60\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 61\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 61\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 61\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 62\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 62\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 62\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 62\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 63\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 63\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 63\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 63\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 64\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 64\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 64\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 64\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 65\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 66\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 66\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 67\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 67\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 67\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND1 on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 69\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 69\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 69\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 70\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 70\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 71\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 71\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 71\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 73\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 73\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 73\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue GLY:CtermProteinFull 76\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 1 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 2 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 3 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 4 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 5 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 6 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 7 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 8 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 9 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 10 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 11 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 12 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 13 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 14 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 15 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 16 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 17 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 18 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 19 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 20 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 21 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 22 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 23 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 24 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 25 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 26 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 27 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 28 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 29 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 30 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 31 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 32 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 33 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 34 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 35 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 36 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 37 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 38 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 39 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 40 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 41 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 42 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 43 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 44 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 45 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 46 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 47 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 48 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 49 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 50 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 51 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 52 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 53 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 54 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 55 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 56 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 57 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 58 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 59 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 60 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 61 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 62 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 63 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 64 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 65 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 66 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 67 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 68 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 69 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 70 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 71 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 72 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 73 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 74 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 75 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 76 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 1 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 2 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 3 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 4 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 5 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 6 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 7 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 8 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 9 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 11 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 12 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 13 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 14 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 15 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 16 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 17 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 18 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 19 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 20 because of missing atom number 6 atom name OG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 21 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 22 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 23 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 24 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 25 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 26 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 27 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 29 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 30 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 31 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 32 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 33 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 34 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 36 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 37 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 38 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 39 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 40 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 41 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 42 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 43 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 44 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 45 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 48 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 49 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 50 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 51 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 52 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 54 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 55 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 56 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 57 because of missing atom number 6 atom name OG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 58 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 59 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 60 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 61 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 62 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 63 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 64 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 65 because of missing atom number 6 atom name OG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 66 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 67 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 68 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 69 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 70 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 71 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 72 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 73 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 74 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.task: \u001b[0mPacker task: initialize from command line()\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mStarting energy table calculation\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mFinished calculating energy tables.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
- "\u001b[0mcore.scoring.P_AA: \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
- "\u001b[0mcore.scoring.elec.util: \u001b[0mRead 40 countpair representative atoms\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mBinary rotamer library selected: /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mUsing Dunbrack library binary file '/home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mDunbrack 2010 library took 0.234375 seconds to load from binary\n",
- "\u001b[0mcore.pack.pack_rotamers: \u001b[0mbuilt 1391 rotamers at 68 positions.\n",
- "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean_centroid.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 1 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: MET:NtermProteinFull\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 2 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 3 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 4 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PHE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 5 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 6 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 7 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 8 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 9 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 10 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 11 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 12 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 13 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 14 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 15 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 16 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 17 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 18 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 19 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 20 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 21 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 22 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 23 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 24 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 25 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 26 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 27 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 28 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ALA\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 29 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 30 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 31 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 32 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 33 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 34 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 35 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 36 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 37 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 38 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 39 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 40 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 41 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 42 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 43 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 44 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 45 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PHE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 46 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ALA\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 47 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 48 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 49 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 50 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 51 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 52 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 53 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 54 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 55 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 56 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 57 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 58 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 59 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: TYR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 60 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 61 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 62 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 63 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 64 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 65 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 66 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 67 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 68 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: HIS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 69 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 70 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 71 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 72 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 73 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 74 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 75 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 76 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY:CtermProteinFull\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue MET:NtermProteinFull 1\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: SD on residue MET:NtermProteinFull 1\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue MET:NtermProteinFull 1\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 2\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 2\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 2\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 2\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 3\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 3\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 3\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 5\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 5\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 6\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 6\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 6\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 6\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 7\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 7\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 8\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 8\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 8\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 9\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 9\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 11\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 11\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 11\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 11\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 12\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 12\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 13\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 13\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 13\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 14\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 14\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 15\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 15\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 15\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 16\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 16\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 16\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 16\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 17\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 17\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 18\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 18\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 18\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 18\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 19\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 19\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 21\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 21\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 21\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 22\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 22\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 23\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 23\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 23\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 24\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 24\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 24\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 24\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASN 25\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASN 25\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND2 on residue ASN 25\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 26\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 26\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 27\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 27\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 27\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 27\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 29\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 29\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 29\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 29\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 30\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 30\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 30\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 31\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 31\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 31\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 31\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 32\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 32\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 32\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 33\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 33\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 33\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 33\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 34\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 34\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 34\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 34\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 36\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 36\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 36\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 37\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 37\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 38\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 38\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 39\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 39\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 39\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 40\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 40\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 40\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 40\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 41\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 41\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 41\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 41\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 43\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 43\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 43\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 44\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 44\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 44\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 48\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 48\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 48\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 48\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 49\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 49\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 49\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 49\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 50\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 50\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 50\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 51\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 51\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 51\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 51\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 52\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 52\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 52\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 55\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 55\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 56\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 56\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 56\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 57\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 58\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 58\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 58\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OH on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASN 60\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASN 60\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND2 on residue ASN 60\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 61\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 61\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 61\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 62\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 62\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 62\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 62\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 63\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 63\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 63\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 63\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 64\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 64\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 64\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 64\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 65\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 66\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 66\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 67\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 67\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 67\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND1 on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 69\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 69\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 69\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 70\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 70\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 71\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 71\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 71\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 73\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 73\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 73\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue GLY:CtermProteinFull 76\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 1 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 2 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 3 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 4 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 5 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 6 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 7 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 8 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 9 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 10 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 11 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 12 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 13 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 14 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 15 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 16 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 17 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 18 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 19 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 20 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 21 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 22 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 23 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 24 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 25 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 26 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 27 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 28 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 29 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 30 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 31 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 32 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 33 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 34 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 35 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 36 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 37 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 38 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 39 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 40 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 41 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 42 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 43 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 44 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 45 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 46 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 47 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 48 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 49 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 50 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 51 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 52 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 53 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 54 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 55 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 56 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 57 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 58 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 59 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 60 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 61 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 62 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 63 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 64 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 65 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 66 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 67 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 68 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 69 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 70 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 71 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 72 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 73 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 74 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 75 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 76 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 1 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 2 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 3 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 4 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 5 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 6 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 7 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 8 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 9 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 11 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 12 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 13 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 14 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 15 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 16 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 17 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 18 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 19 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 20 because of missing atom number 6 atom name OG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 21 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 22 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 23 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 24 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 25 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 26 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 27 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 29 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 30 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 31 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 32 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 33 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 34 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 36 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 37 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 38 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 39 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 40 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 41 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 42 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 43 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 44 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 45 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 48 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 49 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 50 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 51 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 52 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 54 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 55 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 56 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 57 because of missing atom number 6 atom name OG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 58 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 59 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 60 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 61 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 62 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 63 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 64 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 65 because of missing atom number 6 atom name OG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 66 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 67 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 68 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 69 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 70 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 71 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 72 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 73 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 74 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.task: {0} \u001b[0mPacker task: initialize from command line()\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.195489 seconds to load from binary\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 1391 rotamers at 68 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
+ "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadManager: {?} \u001b[0mCreating a thread pool of 1 threads.\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadPool: {?} \u001b[0mLaunched 0 new threads.\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
"True\n"
]
}
@@ -792,12 +819,20 @@
"\n",
"# 也可以从./data/1ubq_clean_centroid.pdb重新读入\n",
"pose_1ubq_centroid = pose_from_pdb(\"./data/1ubq_clean_centroid.pdb\")\n",
- "print(pose_1ubq_centroid.is_fullatom())\n",
+ "print(pose_1ubq_centroid.is_fullatom())"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "在这里注意pose_from_pdb函数将会直接将原本为质心描述的构象转化为全原子描述！\n",
+ "\n",
+ "查看输出日志可以发现 [ WARNING ] discarding xx atoms at position xx in file\n",
"\n",
- "# 在这里注意pose_from_pdb函数将会直接将原本为质心描述的构象转化为全原子描述！\n",
- "# 查看输出日志可以发现 [ WARNING ] discarding xx atoms at position xx in file\n",
- "# 这种信息经常出现，这就是rosetta的运行逻辑决定的，该函数会检查侧链残基，发现CEN就全部丢弃掉，然后按照\n",
- "# 标准库中的rotamer排布上侧链，并进行了packing的过程"
+ "这种信息经常出现，这就是Rosetta的运行逻辑决定的，该函数会检查侧链残基，发现CEN就全部丢弃掉，然后按照理想的氨基酸侧链补全了缺失的原子，并进行了一定的侧链的能量优化。\n",
+ "\n",
+ "**因此如果从PDB文件读入并生成Pose时，使用init('-use_input_sc')可以保留原始的结构侧链信息。**"
]
},
{
@@ -837,8 +872,13 @@
"source": [
"1. 1ubq_clean_newfullatom.pdb文件和1ubq_clean.pdb文件的构象有什么区别？为什么会有这种区别？(难度指数：*)\n",
"\n",
- "\n",
- "\n",
+ ""
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
"2. 1ubq_clean_newfullatom.1ubq_clean_newfullatom2.pdb文件的构象有什么区别？为什么会有这种区别？（难度指数：***）"
]
},
@@ -866,7 +906,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/2_Energy/.ipynb_checkpoints/2_2_Energy_Function-checkpoint.ipynb b/2_Energy/.ipynb_checkpoints/2_2_Energy_Function-checkpoint.ipynb
index 1695efd..3d270a3 100644
--- a/2_Energy/.ipynb_checkpoints/2_2_Energy_Function-checkpoint.ipynb
+++ b/2_Energy/.ipynb_checkpoints/2_2_Energy_Function-checkpoint.ipynb
@@ -4,126 +4,105 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "# 打分（能量）函数和能量项 -- Score Function & Energy Terms\n",
+ "# 能量函数和打分项(Score Function & Energy Terms)\n",
"\n",
- "@Author: Jian Huang\n",
+ "@Author: Jian Huang | 吴炜坤\n",
"\n",
- "@email: jian.huang@xtalpi.com\n",
- "\n",
- "### 一、Introduction\n",
+ "@email: jian.huang@xtalpi.com | weikun.wu@xtalpi.com\n",
"\n",
"这一章的内容是Rosetta中至关重要的核心 -- **能量函数**和**能量项**\n",
"\n",
- "我们知道，Rosetta擅长进行生物大分子蛋白的构象优化，快速在广阔的构象空间中，通过**蒙特卡洛-模拟退火**的核心算法，搜索较优、能量较低的稳定构象。\n",
- "\n",
- "这里对其过程进行简要介绍。在构象能量优化的过程中，我们首先必须要有对当前构象进行评价的**能量函数**，也称为**打分函数**。能量函数中会对该构象的能量进行数值评价，在三维空间中的由各个原子笛卡尔坐标构成的构象信息，其能量既包含了原子之间成键键能、键角、二面角等“*bonded energy terms*”，也需要包含描述非共价相互作用的其他能量项“*non-bonded terms*”（比如氢键、Lennard-Jones相互作用、静电作用等）。\n",
- "\n",
- "可以看到，一个能量函数在构象优化过程中至关重要，不管是该能量函数的各个能量项的描述形式还是其中的参数设置，对我们实际进行构象优化有直接的影响。\n",
- "\n",
- "***\n",
- "\n",
- "可以想象，当我们使用Rosetta对构象进行了某些随机操作，对应的可以用选取的能量函数（默认的能量函数是REF2015）计算出各个能量项的值和他们的加和值得到的总能量值。在Rosetta中这些随机操作可以看作在广阔的构象空间中漫步，目的是为了走到能量面的“洼地”或“山谷”，这种漫步的过程就涉及到蒙特卡洛-模拟退火算法。\n",
- "\n",
- "
\n",
"\n",
- ""
+ "(图片来源: google搜索拼接)"
]
},
{
@@ -49,6 +56,13 @@
"### 一、单个氨基酸全原子和质心描述的直观感受"
]
},
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "在Rosetta中，PDB的读入默认采取全原子的方式进行表示。"
+ ]
+ },
{
"cell_type": "code",
"execution_count": 1,
@@ -58,13 +72,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.Release.python36.ubuntu 2020.28+release.8ecab77aa50ac1301efe53641e07e09ac91fee3b 2020-07-07T16:41:06] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
- "\u001b[0mcore.init: \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: \u001b[0mRosetta version: PyRosetta4.Release.python36.ubuntu r260 2020.28+release.8ecab77aa50 8ecab77aa50ac1301efe53641e07e09ac91fee3b http://www.pyrosetta.org 2020-07-07T16:41:06\n",
- "\u001b[0mcore.init: \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=916345825 seed_offset=0 real_seed=916345825\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0mRandomGenerator:init: Normal mode, seed=916345825 RG_type=mt19937\n"
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-850433861 seed_offset=0 real_seed=-850433861 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-850433861 RG_type=mt19937\n"
]
}
],
@@ -82,8 +96,8 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mFinished initializing fa_standard residue type set. Created 981 residue types\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mTotal time to initialize 0.921875 seconds.\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 984 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.692792 seconds.\n",
"Is the pose a full-atom description?\n",
" True\n"
]
@@ -112,6 +126,13 @@
"pose.dump_pdb(\"./data/trp_fullatom.pdb\")"
]
},
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "当Pose的表示形式需要转换时，可以使用相关的函数来实现(SwitchResidueTypeSetMover)"
+ ]
+ },
{
"cell_type": "code",
"execution_count": 3,
@@ -121,8 +142,8 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mFinished initializing centroid residue type set. Created 69 residue types\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mTotal time to initialize 0.046875 seconds.\n"
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing centroid residue type set. Created 69 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.023072 seconds.\n"
]
},
{
@@ -163,6 +184,7 @@
"\n",
"这里顺带强调一下PDB文件，我们用文本编辑器打开trp_centroid.pdb文件，如下：\n",
"\n",
+ "```\n",
"ATOM 1 N TRP A 1 0.000 0.000 0.000 1.00 0.00 N \n",
"ATOM 2 CA TRP A 1 1.458 0.000 0.000 1.00 0.00 C \n",
"ATOM 3 C TRP A 1 2.009 1.420 0.000 1.00 0.00 C \n",
@@ -171,6 +193,7 @@
"ATOM 6 **CEN** TRP A 1 2.937 -2.180 -1.648 1.00 0.00 X \n",
"ATOM 7 H TRP A 1 -0.500 -0.433 -0.750 1.00 0.00 H \n",
"TER\n",
+ "```\n",
"\n",
"可以看到Trp侧链的假原子名字为**CEN**。（请打开trp_fullatom.pdb查看其中的ATOM描述，观察差别）"
]
@@ -180,7 +203,7 @@
"metadata": {},
"source": [
"### 二、一个更“有趣”的例子\n",
- "\n",
+ "接下来的案例，我们将展示Rosetta对PDB->Pose过程中的处理逻辑，实现过程:\n",
"1. 从PDB库中下载的1ubq.pdb文件，并进行简单处理\n",
"2. 转化为质心描述，保存质心描述的构象为PDB\n",
"3. 将该质心描述的构象再转化为全原子描述（称为new_fullatom）\n",
@@ -196,7 +219,7 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile '1UBQ.clean.pdb' automatically determined to be of type PDB\n"
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile '1UBQ.clean.pdb' automatically determined to be of type PDB\n"
]
}
],
@@ -249,7 +272,7 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
]
}
],
@@ -301,486 +324,490 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile './data/1ubq_clean_centroid.pdb' automatically determined to be of type PDB\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 1 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: MET:NtermProteinFull\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 2 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 3 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 4 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PHE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 5 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 6 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 7 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 8 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 9 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 10 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 11 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 12 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 13 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 14 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 15 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 16 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 17 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 18 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 19 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 20 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 21 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 22 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 23 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 24 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 25 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 26 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 27 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 28 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ALA\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 29 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 30 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 31 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 32 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 33 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 34 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 35 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 36 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 37 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 38 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 39 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 40 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 41 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 42 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 43 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 44 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 45 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PHE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 46 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ALA\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 47 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 48 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 49 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 50 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 51 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 52 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 53 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 54 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 55 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 56 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 57 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 58 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 59 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: TYR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 60 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 61 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 62 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 63 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 64 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 65 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 66 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 67 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 68 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: HIS\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 69 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 70 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 71 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 72 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 73 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 74 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 75 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 76 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY:CtermProteinFull\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue MET:NtermProteinFull 1\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: SD on residue MET:NtermProteinFull 1\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue MET:NtermProteinFull 1\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 2\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 2\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 2\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 2\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 3\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 3\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 3\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue PHE 4\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 5\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 5\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 6\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 6\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 6\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 6\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 7\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 7\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 8\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 8\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 8\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 9\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 9\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 11\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 11\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 11\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 11\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 12\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 12\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 13\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 13\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 13\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 14\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 14\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 15\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 15\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 15\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 16\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 16\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 16\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 16\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 17\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 17\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 18\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 18\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 18\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 18\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 19\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 19\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 20\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 21\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 21\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 21\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 22\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 22\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 23\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 23\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 23\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 24\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 24\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 24\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 24\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASN 25\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASN 25\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND2 on residue ASN 25\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 26\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 26\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 27\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 27\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 27\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 27\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 29\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 29\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 29\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 29\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 30\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 30\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 30\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 31\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 31\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 31\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 31\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 32\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 32\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 32\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 33\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 33\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 33\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 33\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 34\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 34\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 34\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 34\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 36\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 36\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 36\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 37\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 37\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 38\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 38\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 39\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 39\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 39\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 40\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 40\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 40\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 40\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 41\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 41\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 41\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 41\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 42\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 43\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 43\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 43\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 44\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 44\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 44\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue PHE 45\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 48\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 48\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 48\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 48\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 49\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 49\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 49\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 49\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 50\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 50\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 50\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 51\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 51\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 51\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 51\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 52\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 52\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 52\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 54\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 55\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 55\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 56\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 56\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 56\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 57\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 58\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 58\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 58\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OH on residue TYR 59\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASN 60\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASN 60\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND2 on residue ASN 60\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 61\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 61\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 61\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 62\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 62\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 62\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 62\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 63\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 63\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 63\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 63\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 64\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 64\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 64\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 64\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 65\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 66\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 66\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 67\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 67\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 67\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND1 on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue HIS 68\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 69\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 69\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 69\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 70\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 70\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 71\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 71\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 71\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 72\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 73\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 73\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 73\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 74\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue GLY:CtermProteinFull 76\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 1 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 2 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 3 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 4 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 5 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 6 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 7 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 8 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 9 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 10 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 11 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 12 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 13 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 14 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 15 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 16 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 17 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 18 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 19 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 20 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 21 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 22 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 23 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 24 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 25 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 26 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 27 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 28 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 29 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 30 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 31 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 32 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 33 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 34 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 35 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 36 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 37 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 38 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 39 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 40 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 41 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 42 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 43 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 44 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 45 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 46 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 47 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 48 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 49 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 50 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 51 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 52 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 53 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 54 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 55 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 56 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 57 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 58 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 59 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 60 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 61 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 62 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 63 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 64 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 65 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 66 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 67 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 68 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 69 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 70 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 71 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 72 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 73 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 74 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 75 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 76 atom CEN (trying to store temperature in PDBInfo)\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 1 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 2 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 3 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 4 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 5 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 6 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 7 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 8 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 9 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 11 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 12 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 13 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 14 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 15 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 16 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 17 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 18 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 19 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 20 because of missing atom number 6 atom name OG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 21 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 22 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 23 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 24 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 25 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 26 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 27 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 29 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 30 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 31 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 32 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 33 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 34 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 36 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 37 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 38 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 39 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 40 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 41 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 42 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 43 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 44 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 45 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 48 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 49 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 50 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 51 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 52 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 54 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 55 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 56 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 57 because of missing atom number 6 atom name OG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 58 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 59 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 60 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 61 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 62 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 63 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 64 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 65 because of missing atom number 6 atom name OG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 66 because of missing atom number 6 atom name OG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 67 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 68 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 69 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 70 because of missing atom number 6 atom name CG1\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 71 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 72 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 73 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.pack_missing_sidechains: \u001b[0mpacking residue number 74 because of missing atom number 6 atom name CG\n",
- "\u001b[0mcore.pack.task: \u001b[0mPacker task: initialize from command line()\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mStarting energy table calculation\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mFinished calculating energy tables.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
- "\u001b[0mcore.scoring.P_AA: \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
- "\u001b[0mcore.scoring.elec.util: \u001b[0mRead 40 countpair representative atoms\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mBinary rotamer library selected: /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mUsing Dunbrack library binary file '/home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mDunbrack 2010 library took 0.234375 seconds to load from binary\n",
- "\u001b[0mcore.pack.pack_rotamers: \u001b[0mbuilt 1391 rotamers at 68 positions.\n",
- "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean_centroid.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 1 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: MET:NtermProteinFull\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 2 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 3 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 4 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PHE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 5 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 6 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 7 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 8 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 9 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 10 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 11 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 12 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 13 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 14 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 15 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 16 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 17 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 18 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 19 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 20 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 21 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 22 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 23 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 24 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 25 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 26 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 27 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 28 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ALA\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 29 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 30 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 31 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 32 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 33 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 34 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 35 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 36 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 37 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 38 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PRO\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 39 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 40 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 41 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 42 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 43 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 44 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 45 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: PHE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 46 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ALA\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 47 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 48 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 49 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 50 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 51 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 52 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 53 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 54 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 55 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 56 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 57 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 58 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASP\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 59 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: TYR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 60 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ASN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 61 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ILE\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 62 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLN\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 63 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LYS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 64 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 65 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: SER\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 66 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: THR\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 67 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 68 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: HIS\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 69 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 70 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: VAL\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 71 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 72 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 73 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: LEU\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 74 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: ARG\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 75 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m discarding 1 atoms at position 76 in file ./data/1ubq_clean_centroid.pdb. Best match rsd_type: GLY:CtermProteinFull\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue MET:NtermProteinFull 1\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: SD on residue MET:NtermProteinFull 1\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue MET:NtermProteinFull 1\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 2\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 2\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 2\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 2\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 3\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 3\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 3\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue PHE 4\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 5\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 5\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 6\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 6\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 6\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 6\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 7\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 7\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 8\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 8\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 8\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 9\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 9\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 11\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 11\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 11\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 11\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 12\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 12\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 13\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 13\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 13\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 14\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 14\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 15\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 15\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 15\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 16\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 16\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 16\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 16\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 17\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 17\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 18\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 18\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 18\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 18\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 19\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 19\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 21\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 21\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 21\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 22\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 22\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 23\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 23\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 23\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 24\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 24\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 24\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 24\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASN 25\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASN 25\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND2 on residue ASN 25\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 26\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 26\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 27\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 27\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 27\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 27\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 29\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 29\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 29\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 29\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 30\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 30\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 30\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 31\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 31\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 31\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 31\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 32\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 32\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 32\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 33\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 33\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 33\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 33\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 34\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 34\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 34\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 34\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 36\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 36\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 36\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 37\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 37\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PRO 38\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue PRO 38\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 39\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 39\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 39\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 40\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 40\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 40\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 40\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 41\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 41\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 41\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 41\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 42\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 43\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 43\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 43\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 44\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 44\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 44\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue PHE 45\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 48\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 48\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 48\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 48\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 49\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 49\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 49\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 49\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 50\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 50\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 50\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 51\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 51\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 51\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 51\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 52\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 52\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 52\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 54\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 55\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 55\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 56\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 56\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 56\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 57\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASP 58\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASP 58\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD2 on residue ASP 58\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE2 on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OH on residue TYR 59\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ASN 60\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OD1 on residue ASN 60\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND2 on residue ASN 60\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue ILE 61\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue ILE 61\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue ILE 61\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLN 62\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLN 62\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLN 62\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue GLN 62\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LYS 63\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue LYS 63\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE on residue LYS 63\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NZ on residue LYS 63\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue GLU 64\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue GLU 64\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE1 on residue GLU 64\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OE2 on residue GLU 64\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG on residue SER 65\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OG1 on residue THR 66\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue THR 66\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 67\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 67\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 67\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: ND1 on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CE1 on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE2 on residue HIS 68\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 69\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 69\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 69\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG1 on residue VAL 70\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG2 on residue VAL 70\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 71\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 71\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 71\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 72\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue LEU 73\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD1 on residue LEU 73\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD2 on residue LEU 73\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CG on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CD on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NE on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: CZ on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH1 on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: NH2 on residue ARG 74\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue GLY:CtermProteinFull 76\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 1 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 2 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 3 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 4 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 5 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 6 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 7 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 8 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 9 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 10 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 11 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 12 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 13 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 14 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 15 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 16 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 17 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 18 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 19 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 20 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 21 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 22 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 23 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 24 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 25 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 26 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 27 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 28 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 29 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 30 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 31 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 32 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 33 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 34 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 35 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 36 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 37 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 38 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 39 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 40 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 41 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 42 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 43 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 44 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 45 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 46 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 47 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 48 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 49 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 50 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 51 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 52 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 53 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 54 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 55 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 56 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 57 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 58 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 59 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 60 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 61 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 62 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 63 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 64 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 65 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 66 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 67 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 68 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 69 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 70 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 71 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 72 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 73 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 74 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 75 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.io.pose_from_sfr.PoseFromSFRBuilder: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m can't find pose atom for file-residue 76 atom CEN (trying to store temperature in PDBInfo)\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 1 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 2 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 3 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 4 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 5 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 6 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 7 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 8 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 9 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 11 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 12 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 13 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 14 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 15 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 16 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 17 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 18 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 19 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 20 because of missing atom number 6 atom name OG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 21 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 22 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 23 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 24 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 25 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 26 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 27 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 29 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 30 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 31 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 32 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 33 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 34 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 36 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 37 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 38 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 39 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 40 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 41 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 42 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 43 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 44 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 45 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 48 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 49 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 50 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 51 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 52 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 54 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 55 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 56 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 57 because of missing atom number 6 atom name OG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 58 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 59 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 60 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 61 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 62 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 63 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 64 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 65 because of missing atom number 6 atom name OG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 66 because of missing atom number 6 atom name OG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 67 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 68 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 69 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 70 because of missing atom number 6 atom name CG1\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 71 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 72 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 73 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.pack_missing_sidechains: {0} \u001b[0mpacking residue number 74 because of missing atom number 6 atom name CG\n",
+ "\u001b[0mcore.pack.task: {0} \u001b[0mPacker task: initialize from command line()\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.195489 seconds to load from binary\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 1391 rotamers at 68 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
+ "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadManager: {?} \u001b[0mCreating a thread pool of 1 threads.\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadPool: {?} \u001b[0mLaunched 0 new threads.\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
"True\n"
]
}
@@ -792,12 +819,20 @@
"\n",
"# 也可以从./data/1ubq_clean_centroid.pdb重新读入\n",
"pose_1ubq_centroid = pose_from_pdb(\"./data/1ubq_clean_centroid.pdb\")\n",
- "print(pose_1ubq_centroid.is_fullatom())\n",
+ "print(pose_1ubq_centroid.is_fullatom())"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "在这里注意pose_from_pdb函数将会直接将原本为质心描述的构象转化为全原子描述！\n",
+ "\n",
+ "查看输出日志可以发现 [ WARNING ] discarding xx atoms at position xx in file\n",
"\n",
- "# 在这里注意pose_from_pdb函数将会直接将原本为质心描述的构象转化为全原子描述！\n",
- "# 查看输出日志可以发现 [ WARNING ] discarding xx atoms at position xx in file\n",
- "# 这种信息经常出现，这就是rosetta的运行逻辑决定的，该函数会检查侧链残基，发现CEN就全部丢弃掉，然后按照\n",
- "# 标准库中的rotamer排布上侧链，并进行了packing的过程"
+ "这种信息经常出现，这就是Rosetta的运行逻辑决定的，该函数会检查侧链残基，发现CEN就全部丢弃掉，然后按照理想的氨基酸侧链补全了缺失的原子，并进行了一定的侧链的能量优化。\n",
+ "\n",
+ "**因此如果从PDB文件读入并生成Pose时，使用init('-use_input_sc')可以保留原始的结构侧链信息。**"
]
},
{
@@ -837,8 +872,13 @@
"source": [
"1. 1ubq_clean_newfullatom.pdb文件和1ubq_clean.pdb文件的构象有什么区别？为什么会有这种区别？(难度指数：*)\n",
"\n",
- "\n",
- "\n",
+ ""
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
"2. 1ubq_clean_newfullatom.1ubq_clean_newfullatom2.pdb文件的构象有什么区别？为什么会有这种区别？（难度指数：***）"
]
},
@@ -866,7 +906,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/2_Energy/2_2_Energy_Function.ipynb b/2_Energy/2_2_Energy_Function.ipynb
index 1695efd..3d270a3 100644
--- a/2_Energy/2_2_Energy_Function.ipynb
+++ b/2_Energy/2_2_Energy_Function.ipynb
@@ -4,126 +4,105 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "# 打分（能量）函数和能量项 -- Score Function & Energy Terms\n",
+ "# 能量函数和打分项(Score Function & Energy Terms)\n",
"\n",
- "@Author: Jian Huang\n",
+ "@Author: Jian Huang | 吴炜坤\n",
"\n",
- "@email: jian.huang@xtalpi.com\n",
- "\n",
- "### 一、Introduction\n",
+ "@email: jian.huang@xtalpi.com | weikun.wu@xtalpi.com\n",
"\n",
"这一章的内容是Rosetta中至关重要的核心 -- **能量函数**和**能量项**\n",
"\n",
- "我们知道，Rosetta擅长进行生物大分子蛋白的构象优化，快速在广阔的构象空间中，通过**蒙特卡洛-模拟退火**的核心算法，搜索较优、能量较低的稳定构象。\n",
- "\n",
- "这里对其过程进行简要介绍。在构象能量优化的过程中，我们首先必须要有对当前构象进行评价的**能量函数**，也称为**打分函数**。能量函数中会对该构象的能量进行数值评价，在三维空间中的由各个原子笛卡尔坐标构成的构象信息，其能量既包含了原子之间成键键能、键角、二面角等“*bonded energy terms*”，也需要包含描述非共价相互作用的其他能量项“*non-bonded terms*”（比如氢键、Lennard-Jones相互作用、静电作用等）。\n",
- "\n",
- "可以看到，一个能量函数在构象优化过程中至关重要，不管是该能量函数的各个能量项的描述形式还是其中的参数设置，对我们实际进行构象优化有直接的影响。\n",
- "\n",
- "***\n",
- "\n",
- "可以想象，当我们使用Rosetta对构象进行了某些随机操作，对应的可以用选取的能量函数（默认的能量函数是REF2015）计算出各个能量项的值和他们的加和值得到的总能量值。在Rosetta中这些随机操作可以看作在广阔的构象空间中漫步，目的是为了走到能量面的“洼地”或“山谷”，这种漫步的过程就涉及到蒙特卡洛-模拟退火算法。\n",
- "\n",
- "
"
- ]
- },
{
"cell_type": "code",
"execution_count": null,
@@ -752,7 +694,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
},
"toc": {
"base_numbering": 1,
diff --git a/3_Kinematics/3_1_Jump_Cutpoint.ipynb b/3_Kinematics/3_1_Jump_Cutpoint.ipynb
new file mode 100644
index 0000000..571ee82
--- /dev/null
+++ b/3_Kinematics/3_1_Jump_Cutpoint.ipynb
@@ -0,0 +1,779 @@
+{
+ "cells": [
+ {
+ "cell_type": "markdown",
+ "id": "f3d8c35e",
+ "metadata": {},
+ "source": [
+ "# FoldTree的不连续性\n",
+ "\n",
+ "@Author: 张博文\n",
+ "@email：bowen.zhang@xtalpi.com\n",
+ "\n",
+ "@Proofread: 吴炜坤\n",
+ "@email：weikun.wu@xtalpi.com"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "6b014b71",
+ "metadata": {},
+ "source": [
+ "上一节中，我们介绍了Rosetta中坐标的处理方式Rosetta的基本概念，及其顺序性、杠杠性。这一节中，我们将继续介绍： \n",
+ "(1)FoldTree的另两个特性：跳跃性和可切割性。 \n",
+ "(2)快速设置特殊任务foldtree的方法"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 1,
+ "id": "f086eb81",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=1987000656 seed_offset=0 real_seed=1987000656 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=1987000656 RG_type=mt19937\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 初始化pyrosetta，使用pyrosetta必须要做的一件事情\n",
+ "from pyrosetta import init, pose_from_pdb, pose_from_sequence\n",
+ "init()"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "956e446f",
+ "metadata": {},
+ "source": [
+ "### 一、FoldTree的不连续性"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "3309ddef",
+ "metadata": {},
+ "source": [
+ "上一节中我们已经提到了FoldTree的另外两个特性：跳跃性和可切割性，这一节我们将详细的介绍。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "29340e34",
+ "metadata": {},
+ "source": [
+ "#### 1.1 FoldTree的跳跃性: Jump连接"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "0a905a9c",
+ "metadata": {},
+ "source": [
+ "上一节我们已经提过，在FoldTree中当蛋白质有多条链组成时，尽管每一条链中的残基都是共价连接，多条链之间实际上并不存在实际的共价连接。而在FoldTree的概念中，一个树结构只能有一个“根”, 因此在Rosetta中，引入了一种虚拟共价链接，为成为Jump。如同跳跃一般，可以建立一种\"超远程\"的上下游关系。\n",
+ "\n",
+ "以下我们将实践揭开jump的定义方式:"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 2,
+ "id": "043fc87e-0364-4db2-8821-b10202d69c47",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 984 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.640777 seconds.\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1v74.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue LEU:CtermProteinFull 107\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue LEU:CtermProteinFull 194\n"
+ ]
+ }
+ ],
+ "source": [
+ "#首先读取data文件中的PDB：1V74文件\n",
+ "pose = pose_from_pdb('./data/1v74.pdb')"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 3,
+ "id": "7b1c58d7-53ac-4ede-9e61-5ba2b797f5e2",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PDB:1V74: FOLD_TREE EDGE 1 107 -1 EDGE 1 108 1 EDGE 108 194 -1 \n",
+ "The size of the foldtree (number of edges) is 3\n",
+ "The number of the jump is 1\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 输出该pose的FoldTree\n",
+ "print(\"PDB:1V74: \",pose.fold_tree())\n",
+ "print(f\"The size of the foldtree (number of edges) is {pose.fold_tree().size()}\") #Foldtree 的尺寸（edge的个数）\n",
+ "print(f\"The number of the jump is {pose.fold_tree().num_jump()}\") #Foldtree 的jump点的个数"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "aa40610f",
+ "metadata": {},
+ "source": [
+ "可以看到该Pose中含有3个Edge（含一个Jump Edge）。与上一章介绍的一样，其中，从1-107、108-194最后一位为-1，因此这两个edge内所有残基为共价连接，而1和108号残基，即该蛋白的A链和B链的N端由一个Jump连接，即一个虚拟的“共价键”。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "34db2cd2-7afc-40ba-8a74-4175b67816f9",
+ "metadata": {},
+ "source": [
+ "将这个FoldTree进行可视化的话，即如上图所示。此时A链的1号残基为B链108-194残基的上游，同时也是2-107号残基的上游。\n",
+ "因此jump1的虚拟链接定义了ChainA和ChainB之间的上下游关系。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "15be28c8",
+ "metadata": {},
+ "source": [
+ " \n",
+ "(图片来源: 晶泰科技团队)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "14875583-123d-4b73-8486-8caa4a809c2c",
+ "metadata": {},
+ "source": [
+ "**此时，FoldTree树结构才只会有一个根部起点！！Root=PoseID:1**"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "f6d858cf-0ffe-4c13-97c4-0d2b099595c3",
+ "metadata": {},
+ "source": [
+ "**思考**:\n",
+ "1. 当改变第70号氨基酸时，杠杠效应具体表现？\n",
+ "2. 当改变第150号氨基酸时，杠杠效应具体表现？"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "d9d546f2-570f-4d95-8e91-1fc1a172ce93",
+ "metadata": {},
+ "source": [
+ "#### 1.2 正确设置一个带Jump的FoldTree"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "c3d6c16d-d718-4963-a50f-9a60f7227178",
+ "metadata": {},
+ "source": [
+ "设置带Jump点的foldtree方式也是通过FoldTree下的add_edge函数完成，用以下的例子，我们尝试复现1.1节中展示的foldtree。\n",
+ "\n",
+ "先来看一个例子:"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 4,
+ "id": "04ed5384-db07-4eb1-bee3-37d1c6485d92",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.kinematics.FoldTree: {0} \u001b[0m\u001b[31m\u001b[1m[ ERROR ]\u001b[0m Bad fold tree at edge EDGE 108 194 -1\n",
+ "\u001b[0mcore.kinematics.FoldTree: {0} \u001b[0m\u001b[31m\u001b[1m[ ERROR ]\u001b[0m Start residue 108 not built yet.\n",
+ "\u001b[0mcore.kinematics.FoldTree: {0} \u001b[0m\u001b[31m\u001b[1m[ ERROR ]\u001b[0m FOLD_TREE EDGE 1 107 -1 EDGE 108 194 -1 EDGE 1 108 1\n",
+ "FOLD_TREE EDGE 1 107 -1 EDGE 108 194 -1 EDGE 1 108 1 \n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.kinematics import FoldTree\n",
+ "# 完整定义试试:\n",
+ "ft = FoldTree() #设置一个空的foldtree对象\n",
+ "ft.add_edge(start=1, stop=107, label=-1)\n",
+ "ft.add_edge(start=108, stop=194, label=-1)\n",
+ "ft.add_edge(start=1, stop=108, label=1) # add jump\n",
+ "ft.check_fold_tree() # 检查foldtree的有效性;\n",
+ "print(ft)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "40d1204f-1993-4e99-8b59-afc8dd3c1318",
+ "metadata": {},
+ "source": [
+ "**笔者解读: 这是因为在构建foldtree时是有顺序性的。每一个子节点必须先定义父节点才能生效。在第一种做法中，108号残基在创建时没有找到他可以连接的父节点。而在第二种做法中，先定义了107-108之间的jump，因此108号残基的foldtree才是有效的！**"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "8bc2862e-2db9-4e24-b3e2-7afcdc5ee6de",
+ "metadata": {},
+ "source": [
+ "我们先定义里两个edge之后再去定义jump。但发现foldtree是无效的！"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 5,
+ "id": "84551714-66ce-477e-b54c-1dd6e740e26c",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 5,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.kinematics import FoldTree\n",
+ "# 完整定义试试:\n",
+ "ft = FoldTree() #设置一个空的foldtree对象\n",
+ "ft.add_edge(start=1, stop=107, label=-1)\n",
+ "ft.add_edge(start=1, stop=108, label=1) # add jump\n",
+ "ft.add_edge(start=108, stop=194, label=-1)\n",
+ "ft.check_fold_tree() # 检查foldtree的有效性;"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "9b9af2ef-9672-45fa-bc3d-204b1ec75bd7",
+ "metadata": {},
+ "source": [
+ "而如果先构建第一个edge，然后构建jump，在构建第二个edge时，foldtree是有效的。这种现象产生原因是？"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "c857d074-b4ad-4c6c-9410-aace7149762f",
+ "metadata": {},
+ "source": [
+ "**jump点的设置练习**: 读者可根据以下foldtree的逻辑图创建一个foldtree么？(提示注意jump编号)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "2949c0d3-e0a4-4896-bd23-214e000fc040",
+ "metadata": {},
+ "source": [
+ " \n",
+ "(图片来源: 晶泰科技团队)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 6,
+ "id": "daadb0ac-2550-4096-a061-b5fefd890aef",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 6,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# 答案\n",
+ "from pyrosetta.rosetta.core.kinematics import FoldTree\n",
+ "# 完整定义试试:\n",
+ "ft = FoldTree() #设置一个空的foldtree对象\n",
+ "\n",
+ "# 正确答案:\n",
+ "ft.add_edge(start=1, stop=107, label=-1)\n",
+ "ft.add_edge(start=107, stop=108, label=1) # add jump1\n",
+ "ft.add_edge(start=108, stop=157, label=-1)\n",
+ "ft.add_edge(start=88, stop=158, label=2) # add jump2\n",
+ "ft.add_edge(start=158, stop=194, label=-1)\n",
+ "ft.check_fold_tree() # 检查foldtree的有效性;"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "e0a51b5c-1f28-4c84-8770-130e5dbcaedd",
+ "metadata": {},
+ "source": [
+ "**关键点在于按照jump的流向构建FoldTree**"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "a41a5092",
+ "metadata": {},
+ "source": [
+ "#### 1.2 FoldTree的可切割性: Cutpoint"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "c7ee1eb9",
+ "metadata": {},
+ "source": [
+ "FoldTree是可以在edge中进行对点的切割，即设置cutpoint，在快速设置loop时十分有用。 \n",
+ "总体来说，Cutpoint就是FoldTree中的不连续点，相对于peptide edge的连续性来说，cutpoint的出现相当于一把剪刀，将非peptide edge内氨基酸的连接关系切断，也就是FoldTree内EDGE的上下游关系在此处被切断。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 7,
+ "id": "807c3145-ee9e-4468-91f2-b7401692e12b",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "FOLD_TREE EDGE 1 10 -1 \n"
+ ]
+ }
+ ],
+ "source": [
+ "# demo for add a cutpoint\n",
+ "cutpoint_pose = pose_from_sequence('AAAAAAAAAA')\n",
+ "pose_foldtree = cutpoint_pose.fold_tree()\n",
+ "print(pose_foldtree)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "b3a66dff-f4b3-4d75-bd53-9abcb719540e",
+ "metadata": {},
+ "source": [
+ "一个最简单的cutpoint的设置例子，本质上cutpoint就是原有共价连接的地方，**不构建应有的链接**\n",
+ " \n",
+ "\n",
+ "(图片来源: 晶泰科技团队)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 8,
+ "id": "89295550-c045-4493-920e-51a43f5d561f",
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "from pyrosetta.rosetta.core.kinematics import FoldTree\n",
+ "# 完整定义试试:\n",
+ "ft = FoldTree() #设置一个空的foldtree对象\n",
+ "\n",
+ "# 正确答案:\n",
+ "ft.add_edge(start=1, stop=5, label=-1)\n",
+ "ft.add_edge(start=5, stop=10, label=1)\n",
+ "ft.add_edge(start=10, stop=6, label=-1)\n",
+ "ft.check_fold_tree() # 检查foldtree的有效性;\n",
+ "\n",
+ "# 检查foldtree的cutpoint数量。\n",
+ "ft.num_cutpoint()\n",
+ "cutpoint_pose.fold_tree(ft)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "0e25e8ce",
+ "metadata": {},
+ "source": [
+ "我们可以使用对应pose的FoldTree的num_cutpoint属性来看cutpoint的数量，并通过cutpoint属性来看对应cutpoint的位置，以及is_cutpoint判断是否为cutpoint"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 9,
+ "id": "6a408f29",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "The FoldTree of the Pose: FOLD_TREE EDGE 1 5 -1 EDGE 5 10 1 EDGE 10 6 -1 \n",
+ "The number of the cutpoint in Pose is : 1\n",
+ "The cutpoint in Pose is : 5\n"
+ ]
+ }
+ ],
+ "source": [
+ "#看对应pose中cutpoint的属性\n",
+ "print(f\"The FoldTree of the Pose: {cutpoint_pose.fold_tree()}\")\n",
+ "print(f\"The number of the cutpoint in Pose is : {cutpoint_pose.fold_tree().num_cutpoint()}\") #说明Pose的cutpoint只有一个\n",
+ "print(f\"The cutpoint in Pose is : {cutpoint_pose.fold_tree().cutpoint(1)}\") #说明Pose中的断点在5号残基处"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "fc52df2f-fb35-45d9-8e4f-0eb7e83c6be9",
+ "metadata": {},
+ "source": [
+ "尝试改变7号残基的构象，看看效果: 从第5号残基处构象被切断。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 10,
+ "id": "b2fbc99c-779d-474f-b65c-f4f0164690c4",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 10,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# set phi3\n",
+ "cutpoint_pose.dump_pdb('./data/cutpoint_raw.pdb')\n",
+ "cutpoint_pose.set_phi(7, 69)\n",
+ "cutpoint_pose.set_psi(7, 60)\n",
+ "cutpoint_pose.dump_pdb('./data/cutpoint_pertuber.pdb')"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "6882a37f-5ec2-4671-a224-f615e05fbd8b",
+ "metadata": {},
+ "source": [
+ " \n",
+ "(图片来源: 晶泰科技团队)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "a246a3c2-bca2-4fe4-a152-be28635e5d29",
+ "metadata": {},
+ "source": [
+ "一个设置cutpoint更快的方法: 直接使用FoldTree的new_jump函数，就可以完成上面伸所示的foldtree构建"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 11,
+ "id": "972ed477-7443-4422-8003-66802bfd87a4",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "The FoldTree of the Pose: FOLD_TREE EDGE 1 5 -1 EDGE 5 10 1 EDGE 10 6 -1 \n",
+ "The number of the cutpoint in Pose is : 1\n",
+ "The cutpoint in Pose is : 5\n"
+ ]
+ }
+ ],
+ "source": [
+ "# demo for add a cutpoint\n",
+ "cutpoint_pose = pose_from_sequence('AAAAAAAAAA')\n",
+ "pose_foldtree = cutpoint_pose.fold_tree()\n",
+ "pose_foldtree.new_jump(jump_pos1=5, jump_pos2=10, cutpoint=5)\n",
+ "\n",
+ "#看对应pose中cutpoint的属性\n",
+ "print(f\"The FoldTree of the Pose: {cutpoint_pose.fold_tree()}\")\n",
+ "print(f\"The number of the cutpoint in Pose is : {cutpoint_pose.fold_tree().num_cutpoint()}\") #说明Pose的cutpoint只有一个\n",
+ "print(f\"The cutpoint in Pose is : {cutpoint_pose.fold_tree().cutpoint(1)}\") #说明Pose中的断点在5号残基处"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "cdee64a1",
+ "metadata": {},
+ "source": [
+ "### 二、一些常用FoldTree设置方法"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "0d63f206-7679-4b4a-a3d3-c63056745c87",
+ "metadata": {},
+ "source": [
+ "在蛋白质建模的不同任务中，不同的任务通常需要自定义特定的FoldTree:\n",
+ "- Docking FoldTree: 蛋白/小分子对接\n",
+ "- Loop modeling FoldTree: loop建模\n",
+ "- Folding FoldTree: 蛋白从头折叠"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "853d3dbc",
+ "metadata": {},
+ "source": [
+ " \n",
+ "(图片来源: Meiler Lab Rosetta2020教程中的Rosetta_Energy_Function ppt)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "79fe0811-9888-40ae-ac41-375eb7b57ef8",
+ "metadata": {},
+ "source": [
+ "#### 2.1 快速设置docking foldtree的方法:\n",
+ "\n",
+ "主要调用的函数为: setup_foldtree"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 12,
+ "id": "b6ecb1ed-7239-4037-9924-a2218c55184f",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1v74.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue LEU:CtermProteinFull 107\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue LEU:CtermProteinFull 194\n",
+ "PDB file name: ./data/1v74.pdb\n",
+ " Pose Range Chain PDB Range | #Residues #Atoms\n",
+ "\n",
+ "0001 -- 0107 A 0591 -- 0697 | 0107 residues; 01728 atoms\n",
+ "0108 -- 0194 B 0001 -- 0087 | 0087 residues; 01425 atoms\n",
+ " TOTAL | 0194 residues; 03153 atoms\n",
+ "\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.docking import setup_foldtree\n",
+ "from pyrosetta.rosetta.utility import vector1_int\n",
+ "# Docking FoldTree\n",
+ "#首先读取data文件中的PDB：1V74文件\n",
+ "pose = pose_from_pdb('./data/1v74.pdb')\n",
+ "print(pose.pdb_info())"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "44785e22-aeba-4aae-a58c-38517230f854",
+ "metadata": {},
+ "source": [
+ "读入的Pose中含有两条链，一条是A一条是B。使用setup_foldtree时我们需要先定义partner概念。\n",
+ "\n",
+ "partner参数的基本形式是\"X_Y\", 含义是我需要构建一个X链为第一个刚体，Y为第二个刚体的。\n",
+ "\n",
+ "partner参数支持3条链以上: 如“A_BC”, 含义是A作为一个可旋转平移刚体，BC链一同作为另外一个可旋转平移刚体。\n",
+ "\n",
+ "**setup_foldtree因此根据partner参数去构建相应的Docking FoldTree，并且将\"_\"中间设定为Jump1，因此一般Docking任务都会将movable_jumps参数中的vector1_int设置为1.**"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 13,
+ "id": "25405352-6304-4b26-ab64-98cdb11af194",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "FOLD_TREE EDGE 1 88 -1 EDGE 88 107 -1 EDGE 88 158 1 EDGE 158 108 -1 EDGE 158 194 -1 \n"
+ ]
+ }
+ ],
+ "source": [
+ "# 默认设置可以在刚体中移动的jumps为1\n",
+ "movable_jumps_v = vector1_int()\n",
+ "movable_jumps_v.append(1)\n",
+ "\n",
+ "# 设置foldtree\n",
+ "setup_foldtree(pose, partner_chainID='A_B', movable_jumps=movable_jumps_v)\n",
+ "\n",
+ "print(pose.fold_tree())"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "33cbbcd0-e190-4f43-b2df-d994f37eacb8",
+ "metadata": {},
+ "source": [
+ "**思考**:画出上面的图, 为什么setup_foldtree要这样去设置FoldTree呢？"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "id": "b3b1a25b-f430-476c-8e66-7ace704e11ea",
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "id": "1fc82602-7326-4d12-a1e5-8fe2cf2472ff",
+ "metadata": {},
+ "source": [
+ "#### 2.1 快速设置LoopMoldeing foldtree的方法:\n",
+ "\n",
+ "主要调用的函数为: setup_foldtree"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 14,
+ "id": "64171af1-b55b-4091-acb8-0cce67542dc3",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PDB file name: AAAAAAAA\n",
+ " Pose Range Chain PDB Range | #Residues #Atoms\n",
+ "\n",
+ "0001 -- 0027 A 0001 -- 0027 | 0027 residues; 00273 atoms\n",
+ " TOTAL | 0027 residues; 00273 atoms\n",
+ "\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 创建序列Pose\n",
+ "pose = pose_from_sequence('AAAAAAAAAAAAAAAAAAAAAAAAAAA')\n",
+ "print(pose.pdb_info())"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "1e6745e1-984d-4cbf-aaf5-0b7a2363bc8d",
+ "metadata": {},
+ "source": [
+ "假设我现在要对10-20这段区域的骨架进行随机化采样，又不希望这段区域的自由度变化对1-9, 21-27的区域造成影响。\n",
+ "\n",
+ "这就是Loop modeling FoldTree需要做的事情。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 15,
+ "id": "b61273c3-ddd4-4f72-a063-317b2cf3f2d5",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "FOLD_TREE EDGE 1 9 -1 EDGE 9 15 -1 EDGE 9 21 1 EDGE 21 16 -1 EDGE 21 27 -1 \n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.loops import Loops, Loop, fold_tree_from_loops\n",
+ "\n",
+ "# define loops;\n",
+ "loop_fold_tree = FoldTree()\n",
+ "loops = Loops()\n",
+ "loop = Loop(10, 20, 15) # start_res, end_res, cut_res\n",
+ "loops.add_loop(loop)\n",
+ "\n",
+ "# setup loop modelling foldtree;\n",
+ "fold_tree_from_loops(pose, loops, loop_fold_tree)\n",
+ "print(loop_fold_tree)\n",
+ "pose.fold_tree(loop_fold_tree)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "7dfa0176-b5ee-4991-9049-efb02db322bc",
+ "metadata": {},
+ "source": [
+ "**思考**:画出上面的图，思考为什么fold_tree_from_loops要这样去设置FoldTree呢？"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "id": "715e267f-a8fb-4255-955f-b5c1f3749839",
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "id": "9b21b508",
+ "metadata": {},
+ "source": [
+ "**练习**"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "9c2c41aa-e808-46d7-9dbe-7bc9684a0b67",
+ "metadata": {},
+ "source": [
+ "1. 如果我已知有一段功能结构区域范围，如何设置foldtree，在采样时避免这段区域发生变化呢? （难度系数: **）\n",
+ "\n",
+ "2. 如何设定一个可以在Docking中允许loops采样的FoldTree呢？（难度系数: ****）"
+ ]
+ }
+ ],
+ "metadata": {
+ "kernelspec": {
+ "display_name": "Python 3",
+ "language": "python",
+ "name": "python3"
+ },
+ "language_info": {
+ "codemirror_mode": {
+ "name": "ipython",
+ "version": 3
+ },
+ "file_extension": ".py",
+ "mimetype": "text/x-python",
+ "name": "python",
+ "nbconvert_exporter": "python",
+ "pygments_lexer": "ipython3",
+ "version": "3.7.10"
+ },
+ "toc": {
+ "base_numbering": 1,
+ "nav_menu": {},
+ "number_sections": true,
+ "sideBar": true,
+ "skip_h1_title": false,
+ "title_cell": "Table of Contents",
+ "title_sidebar": "Contents",
+ "toc_cell": false,
+ "toc_position": {},
+ "toc_section_display": true,
+ "toc_window_display": false
+ }
+ },
+ "nbformat": 4,
+ "nbformat_minor": 5
+}
diff --git a/3_Kinematics/data/1v74.pdb b/3_Kinematics/data/1v74.pdb
index 53e708b..0b874b5 100644
--- a/3_Kinematics/data/1v74.pdb
+++ b/3_Kinematics/data/1v74.pdb
@@ -1,3 +1,4 @@
+CRYST1 62.057 62.057 147.934 90.00 90.00 90.00 P 41 21 2 1
ATOM 1 N LEU A 591 24.969 13.428 30.692 1.00 48.09 N
ATOM 2 CA LEU A 591 24.044 12.661 29.808 1.00 47.58 C
ATOM 3 C LEU A 591 22.785 13.482 29.543 1.00 47.03 C
@@ -12,8 +13,8 @@ ATOM 11 C ASN A 592 20.148 14.152 28.109 1.00 42.01 C
ATOM 12 O ASN A 592 20.015 12.942 28.295 1.00 41.61 O
ATOM 13 CB ASN A 592 21.667 15.144 26.416 1.00 44.63 C
ATOM 14 CG ASN A 592 22.882 16.002 26.144 1.00 45.69 C
-ATOM 15 OD1 ASN A 592 23.278 16.182 24.993 1.00 48.92 O
-ATOM 16 ND2 ASN A 592 23.475 16.546 27.201 1.00 45.77 N
+ATOM 15 ND2 ASN A 592 23.475 16.546 27.201 1.00 45.77 N
+ATOM 16 OD1 ASN A 592 23.278 16.182 24.993 1.00 48.92 O
ATOM 17 N ASP A 593 19.128 15.005 28.069 1.00 39.24 N
ATOM 18 CA ASP A 593 17.738 14.594 28.224 1.00 35.45 C
ATOM 19 C ASP A 593 17.340 13.727 27.025 1.00 33.03 C
@@ -21,7 +22,7 @@ ATOM 20 O ASP A 593 17.895 13.869 25.934 1.00 34.19 O
ATOM 21 CB ASP A 593 16.844 15.838 28.273 1.00 34.78 C
ATOM 22 CG ASP A 593 15.387 15.502 28.496 1.00 33.26 C
ATOM 23 OD1 ASP A 593 14.979 15.377 29.666 1.00 36.26 O
-ATOM 24 OD2 ASP A 593 14.652 15.351 27.502 1.00 32.79 O
+ATOM 24 OD2 ASP A 593 14.652 15.351 27.502 1.00 32.79 O1-
ATOM 25 N PRO A 594 16.372 12.818 27.210 1.00 30.73 N
ATOM 26 CA PRO A 594 15.918 11.942 26.124 1.00 29.02 C
ATOM 27 C PRO A 594 15.425 12.707 24.894 1.00 28.35 C
@@ -44,7 +45,7 @@ ATOM 43 O ASP A 596 19.243 14.212 22.464 1.00 23.79 O
ATOM 44 CB ASP A 596 18.991 16.456 24.150 1.00 25.04 C
ATOM 45 CG ASP A 596 18.519 17.470 25.173 1.00 27.47 C
ATOM 46 OD1 ASP A 596 17.468 18.111 24.965 1.00 24.85 O
-ATOM 47 OD2 ASP A 596 19.219 17.632 26.191 1.00 31.58 O
+ATOM 47 OD2 ASP A 596 19.219 17.632 26.191 1.00 31.58 O1-
ATOM 48 N SER A 597 18.192 15.353 20.840 1.00 22.47 N
ATOM 49 CA SER A 597 18.726 14.524 19.771 1.00 22.76 C
ATOM 50 C SER A 597 18.333 15.106 18.427 1.00 21.74 C
@@ -64,7 +65,7 @@ ATOM 63 CG ARG A 599 16.941 18.532 12.911 1.00 18.71 C
ATOM 64 CD ARG A 599 15.804 18.734 11.907 1.00 18.01 C
ATOM 65 NE ARG A 599 16.098 18.203 10.580 1.00 19.30 N
ATOM 66 CZ ARG A 599 16.863 18.807 9.674 1.00 23.56 C
-ATOM 67 NH1 ARG A 599 17.426 19.980 9.944 1.00 23.21 N
+ATOM 67 NH1 ARG A 599 17.426 19.980 9.944 1.00 23.21 N1+
ATOM 68 NH2 ARG A 599 17.062 18.236 8.488 1.00 22.07 N
ATOM 69 N PHE A 600 16.580 18.600 17.704 1.00 20.20 N
ATOM 70 CA PHE A 600 15.917 19.117 18.895 1.00 21.80 C
@@ -92,7 +93,7 @@ ATOM 91 CG ARG A 602 12.977 18.856 27.558 1.00 31.08 C
ATOM 92 CD ARG A 602 13.318 18.331 28.946 1.00 36.20 C
ATOM 93 NE ARG A 602 12.130 18.034 29.745 1.00 43.41 N
ATOM 94 CZ ARG A 602 11.232 18.934 30.138 1.00 47.64 C
-ATOM 95 NH1 ARG A 602 10.188 18.548 30.863 1.00 49.38 N
+ATOM 95 NH1 ARG A 602 10.188 18.548 30.863 1.00 49.38 N1+
ATOM 96 NH2 ARG A 602 11.370 20.218 29.814 1.00 46.94 N
ATOM 97 N LYS A 603 14.886 21.773 25.854 1.00 22.43 N
ATOM 98 CA LYS A 603 14.803 23.193 26.173 1.00 24.56 C
@@ -102,7 +103,7 @@ ATOM 101 CB LYS A 603 16.213 23.755 26.381 1.00 26.76 C
ATOM 102 CG LYS A 603 16.248 25.197 26.848 1.00 32.63 C
ATOM 103 CD LYS A 603 17.681 25.655 27.087 1.00 37.08 C
ATOM 104 CE LYS A 603 17.727 27.060 27.676 1.00 41.15 C
-ATOM 105 NZ LYS A 603 19.126 27.515 27.941 1.00 42.46 N
+ATOM 105 NZ LYS A 603 19.126 27.515 27.941 1.00 42.46 N1+
ATOM 106 N GLN A 604 14.487 23.838 23.840 1.00 19.77 N
ATOM 107 CA GLN A 604 13.860 24.562 22.735 1.00 18.91 C
ATOM 108 C GLN A 604 12.396 24.168 22.547 1.00 19.58 C
@@ -110,8 +111,8 @@ ATOM 109 O GLN A 604 11.553 25.025 22.290 1.00 18.45 O
ATOM 110 CB GLN A 604 14.636 24.323 21.439 1.00 21.24 C
ATOM 111 CG GLN A 604 14.326 25.316 20.322 1.00 17.75 C
ATOM 112 CD GLN A 604 14.674 26.751 20.698 1.00 20.74 C
-ATOM 113 OE1 GLN A 604 15.522 26.991 21.557 1.00 19.47 O
-ATOM 114 NE2 GLN A 604 14.027 27.710 20.044 1.00 20.18 N
+ATOM 113 NE2 GLN A 604 14.027 27.710 20.044 1.00 20.18 N
+ATOM 114 OE1 GLN A 604 15.522 26.991 21.557 1.00 19.47 O
ATOM 115 N LEU A 605 12.094 22.876 22.664 1.00 17.78 N
ATOM 116 CA LEU A 605 10.714 22.406 22.525 1.00 18.24 C
ATOM 117 C LEU A 605 9.830 23.026 23.610 1.00 19.15 C
@@ -127,7 +128,7 @@ ATOM 126 O ASP A 606 8.207 25.646 25.870 1.00 20.93 O
ATOM 127 CB ASP A 606 10.447 23.575 27.230 1.00 22.14 C
ATOM 128 CG ASP A 606 9.650 23.976 28.468 1.00 27.04 C
ATOM 129 OD1 ASP A 606 9.340 25.176 28.629 1.00 27.12 O
-ATOM 130 OD2 ASP A 606 9.329 23.084 29.279 1.00 28.25 O
+ATOM 130 OD2 ASP A 606 9.329 23.084 29.279 1.00 28.25 O1-
ATOM 131 N LYS A 607 10.336 25.921 25.189 1.00 19.99 N
ATOM 132 CA LYS A 607 10.181 27.339 24.867 1.00 22.97 C
ATOM 133 C LYS A 607 9.130 27.589 23.795 1.00 21.15 C
@@ -136,7 +137,7 @@ ATOM 135 CB LYS A 607 11.489 27.926 24.329 1.00 24.27 C
ATOM 136 CG LYS A 607 12.595 28.122 25.330 1.00 30.94 C
ATOM 137 CD LYS A 607 13.771 28.796 24.639 1.00 29.47 C
ATOM 138 CE LYS A 607 14.875 29.119 25.614 1.00 32.30 C
-ATOM 139 NZ LYS A 607 15.976 29.854 24.941 1.00 36.46 N
+ATOM 139 NZ LYS A 607 15.976 29.854 24.941 1.00 36.46 N1+
ATOM 140 N LYS A 608 9.009 26.656 22.858 1.00 21.05 N
ATOM 141 CA LYS A 608 8.085 26.825 21.744 1.00 20.67 C
ATOM 142 C LYS A 608 6.793 26.017 21.782 1.00 21.09 C
@@ -145,7 +146,7 @@ ATOM 144 CB LYS A 608 8.831 26.529 20.437 1.00 20.04 C
ATOM 145 CG LYS A 608 10.108 27.344 20.264 1.00 20.26 C
ATOM 146 CD LYS A 608 9.821 28.847 20.294 1.00 19.84 C
ATOM 147 CE LYS A 608 11.097 29.658 20.137 1.00 23.41 C
-ATOM 148 NZ LYS A 608 10.842 31.134 20.211 1.00 22.44 N
+ATOM 148 NZ LYS A 608 10.842 31.134 20.211 1.00 22.44 N1+
ATOM 149 N TYR A 609 6.547 25.311 22.880 1.00 19.52 N
ATOM 150 CA TYR A 609 5.339 24.498 22.998 1.00 20.87 C
ATOM 151 C TYR A 609 4.078 25.329 22.755 1.00 20.99 C
@@ -166,15 +167,15 @@ ATOM 165 CB LYS A 610 3.472 28.963 23.143 1.00 17.96 C
ATOM 166 CG LYS A 610 4.691 29.416 22.353 1.00 17.76 C
ATOM 167 CD LYS A 610 5.240 30.728 22.887 1.00 19.87 C
ATOM 168 CE LYS A 610 6.471 31.172 22.101 1.00 21.45 C
-ATOM 169 NZ LYS A 610 7.043 32.447 22.629 1.00 19.94 N
+ATOM 169 NZ LYS A 610 7.043 32.447 22.629 1.00 19.94 N1+
ATOM 170 N HIS A 611 3.313 26.963 20.467 1.00 17.59 N
ATOM 171 CA HIS A 611 2.906 26.832 19.063 1.00 18.47 C
ATOM 172 C HIS A 611 2.412 25.422 18.725 1.00 18.73 C
ATOM 173 O HIS A 611 1.940 25.175 17.615 1.00 20.55 O
ATOM 174 CB HIS A 611 4.075 27.175 18.125 1.00 17.42 C
ATOM 175 CG HIS A 611 4.562 28.587 18.246 1.00 17.80 C
-ATOM 176 ND1 HIS A 611 3.752 29.677 18.017 1.00 16.57 N
-ATOM 177 CD2 HIS A 611 5.780 29.085 18.566 1.00 17.02 C
+ATOM 176 CD2 HIS A 611 5.780 29.085 18.566 1.00 17.02 C
+ATOM 177 ND1 HIS A 611 3.752 29.677 18.017 1.00 16.57 N
ATOM 178 CE1 HIS A 611 4.448 30.786 18.192 1.00 17.46 C
ATOM 179 NE2 HIS A 611 5.682 30.454 18.526 1.00 17.99 N
ATOM 180 N ALA A 612 2.522 24.499 19.674 1.00 19.32 N
@@ -193,7 +194,7 @@ ATOM 192 O ASP A 614 -0.781 23.490 13.391 1.00 19.39 O
ATOM 193 CB ASP A 614 0.217 25.970 14.874 1.00 20.91 C
ATOM 194 CG ASP A 614 -0.156 27.369 15.323 1.00 21.65 C
ATOM 195 OD1 ASP A 614 -1.244 27.548 15.912 1.00 22.86 O
-ATOM 196 OD2 ASP A 614 0.646 28.291 15.074 1.00 20.77 O
+ATOM 196 OD2 ASP A 614 0.646 28.291 15.074 1.00 20.77 O1-
ATOM 197 N PHE A 615 0.088 22.661 15.296 1.00 20.84 N
ATOM 198 CA PHE A 615 0.464 21.378 14.715 1.00 22.46 C
ATOM 199 C PHE A 615 -0.410 20.212 15.181 1.00 23.81 C
@@ -230,14 +231,14 @@ ATOM 229 O ASP A 619 -1.681 21.458 25.146 1.00 28.97 O
ATOM 230 CB ASP A 619 -1.903 18.423 25.174 1.00 30.61 C
ATOM 231 CG ASP A 619 -2.250 17.086 24.536 1.00 33.16 C
ATOM 232 OD1 ASP A 619 -2.161 16.054 25.234 1.00 34.58 O
-ATOM 233 OD2 ASP A 619 -2.607 17.062 23.338 1.00 33.46 O
+ATOM 233 OD2 ASP A 619 -2.607 17.062 23.338 1.00 33.46 O1-
ATOM 234 N THR A 620 -3.251 21.161 26.726 1.00 28.60 N
ATOM 235 CA THR A 620 -2.927 22.409 27.408 1.00 29.66 C
ATOM 236 C THR A 620 -1.758 22.229 28.366 1.00 29.63 C
ATOM 237 O THR A 620 -1.046 23.183 28.674 1.00 29.02 O
ATOM 238 CB THR A 620 -4.133 22.950 28.204 1.00 29.62 C
-ATOM 239 OG1 THR A 620 -4.536 21.981 29.179 1.00 31.69 O
-ATOM 240 CG2 THR A 620 -5.297 23.244 27.269 1.00 30.29 C
+ATOM 239 CG2 THR A 620 -5.297 23.244 27.269 1.00 30.29 C
+ATOM 240 OG1 THR A 620 -4.536 21.981 29.179 1.00 31.69 O
ATOM 241 N LYS A 621 -1.559 21.002 28.835 1.00 29.26 N
ATOM 242 CA LYS A 621 -0.473 20.718 29.758 1.00 31.14 C
ATOM 243 C LYS A 621 0.855 20.560 29.033 1.00 29.92 C
@@ -246,7 +247,7 @@ ATOM 245 CB LYS A 621 -0.773 19.451 30.568 1.00 34.45 C
ATOM 246 CG LYS A 621 -1.981 19.588 31.490 1.00 38.68 C
ATOM 247 CD LYS A 621 -2.091 18.437 32.483 1.00 43.14 C
ATOM 248 CE LYS A 621 -2.372 17.110 31.793 1.00 46.27 C
-ATOM 249 NZ LYS A 621 -2.553 16.004 32.781 1.00 48.19 N
+ATOM 249 NZ LYS A 621 -2.553 16.004 32.781 1.00 48.19 N1+
ATOM 250 N LYS A 622 1.909 21.110 29.624 1.00 28.74 N
ATOM 251 CA LYS A 622 3.241 21.023 29.046 1.00 29.33 C
ATOM 252 C LYS A 622 4.101 20.125 29.925 1.00 29.23 C
@@ -255,15 +256,15 @@ ATOM 254 CB LYS A 622 3.877 22.413 28.944 1.00 27.88 C
ATOM 255 CG LYS A 622 5.265 22.407 28.319 1.00 27.49 C
ATOM 256 CD LYS A 622 5.851 23.807 28.195 1.00 29.70 C
ATOM 257 CE LYS A 622 6.117 24.438 29.559 1.00 31.39 C
-ATOM 258 NZ LYS A 622 6.812 25.755 29.426 1.00 33.41 N
+ATOM 258 NZ LYS A 622 6.812 25.755 29.426 1.00 33.41 N1+
ATOM 259 N ASN A 623 4.334 18.903 29.464 1.00 29.64 N
ATOM 260 CA ASN A 623 5.145 17.941 30.198 1.00 29.45 C
ATOM 261 C ASN A 623 5.917 17.101 29.190 1.00 29.51 C
ATOM 262 O ASN A 623 5.818 17.331 27.988 1.00 28.52 O
ATOM 263 CB ASN A 623 4.255 17.040 31.062 1.00 30.44 C
ATOM 264 CG ASN A 623 3.120 16.418 30.274 1.00 31.93 C
-ATOM 265 OD1 ASN A 623 3.318 15.932 29.160 1.00 29.84 O
-ATOM 266 ND2 ASN A 623 1.923 16.423 30.852 1.00 30.96 N
+ATOM 265 ND2 ASN A 623 1.923 16.423 30.852 1.00 30.96 N
+ATOM 266 OD1 ASN A 623 3.318 15.932 29.160 1.00 29.84 O
ATOM 267 N ARG A 624 6.683 16.129 29.674 1.00 30.30 N
ATOM 268 CA ARG A 624 7.464 15.286 28.778 1.00 31.45 C
ATOM 269 C ARG A 624 6.612 14.661 27.679 1.00 30.90 C
@@ -273,7 +274,7 @@ ATOM 272 CG ARG A 624 8.992 13.231 28.683 1.00 37.51 C
ATOM 273 CD ARG A 624 9.941 12.382 29.512 1.00 40.36 C
ATOM 274 NE ARG A 624 10.893 13.221 30.239 1.00 43.48 N
ATOM 275 CZ ARG A 624 11.854 13.940 29.664 1.00 44.15 C
-ATOM 276 NH1 ARG A 624 12.007 13.925 28.346 1.00 42.27 N
+ATOM 276 NH1 ARG A 624 12.007 13.925 28.346 1.00 42.27 N1+
ATOM 277 NH2 ARG A 624 12.652 14.691 30.409 1.00 45.03 N
ATOM 278 N GLU A 625 5.434 14.159 28.040 1.00 29.53 N
ATOM 279 CA GLU A 625 4.562 13.531 27.055 1.00 29.36 C
@@ -283,14 +284,14 @@ ATOM 282 CB GLU A 625 3.311 12.942 27.717 1.00 33.87 C
ATOM 283 CG GLU A 625 2.295 12.420 26.698 1.00 38.27 C
ATOM 284 CD GLU A 625 1.002 11.922 27.325 1.00 41.83 C
ATOM 285 OE1 GLU A 625 0.409 12.652 28.148 1.00 43.12 O
-ATOM 286 OE2 GLU A 625 0.572 10.800 26.982 1.00 43.87 O
+ATOM 286 OE2 GLU A 625 0.572 10.800 26.982 1.00 43.87 O1-
ATOM 287 N THR A 626 3.665 15.675 26.320 1.00 24.40 N
ATOM 288 CA THR A 626 3.215 16.634 25.313 1.00 23.77 C
ATOM 289 C THR A 626 4.375 17.253 24.534 1.00 23.09 C
ATOM 290 O THR A 626 4.229 17.581 23.355 1.00 23.70 O
ATOM 291 CB THR A 626 2.343 17.739 25.941 1.00 23.29 C
-ATOM 292 OG1 THR A 626 3.078 18.411 26.972 1.00 22.86 O
-ATOM 293 CG2 THR A 626 1.073 17.122 26.539 1.00 24.60 C
+ATOM 292 CG2 THR A 626 1.073 17.122 26.539 1.00 24.60 C
+ATOM 293 OG1 THR A 626 3.078 18.411 26.972 1.00 22.86 O
ATOM 294 N LEU A 627 5.526 17.414 25.180 1.00 21.50 N
ATOM 295 CA LEU A 627 6.680 17.957 24.474 1.00 22.09 C
ATOM 296 C LEU A 627 7.102 16.925 23.427 1.00 21.48 C
@@ -304,8 +305,8 @@ ATOM 303 CA THR A 628 7.270 14.568 22.843 1.00 22.14 C
ATOM 304 C THR A 628 6.296 14.583 21.669 1.00 22.39 C
ATOM 305 O THR A 628 6.692 14.382 20.520 1.00 22.88 O
ATOM 306 CB THR A 628 7.207 13.197 23.550 1.00 22.91 C
-ATOM 307 OG1 THR A 628 8.213 13.148 24.569 1.00 22.27 O
-ATOM 308 CG2 THR A 628 7.444 12.062 22.556 1.00 23.05 C
+ATOM 307 CG2 THR A 628 7.444 12.062 22.556 1.00 23.05 C
+ATOM 308 OG1 THR A 628 8.213 13.148 24.569 1.00 22.27 O
ATOM 309 N LYS A 629 5.019 14.822 21.955 1.00 22.18 N
ATOM 310 CA LYS A 629 4.026 14.884 20.890 1.00 22.24 C
ATOM 311 C LYS A 629 4.392 16.015 19.933 1.00 21.37 C
@@ -314,7 +315,7 @@ ATOM 313 CB LYS A 629 2.630 15.145 21.457 1.00 23.96 C
ATOM 314 CG LYS A 629 1.999 13.966 22.183 1.00 27.32 C
ATOM 315 CD LYS A 629 0.573 14.307 22.613 1.00 30.16 C
ATOM 316 CE LYS A 629 -0.041 13.200 23.458 1.00 32.27 C
-ATOM 317 NZ LYS A 629 -1.425 13.547 23.891 1.00 35.23 N
+ATOM 317 NZ LYS A 629 -1.425 13.547 23.891 1.00 35.23 N1+
ATOM 318 N PHE A 630 4.820 17.141 20.501 1.00 20.09 N
ATOM 319 CA PHE A 630 5.211 18.318 19.726 1.00 19.56 C
ATOM 320 C PHE A 630 6.421 17.974 18.854 1.00 18.96 C
@@ -335,7 +336,7 @@ ATOM 334 CG ARG A 631 11.021 15.898 19.162 1.00 20.90 C
ATOM 335 CD ARG A 631 11.027 14.713 18.183 1.00 20.58 C
ATOM 336 NE ARG A 631 10.451 13.505 18.778 1.00 19.14 N
ATOM 337 CZ ARG A 631 11.049 12.745 19.691 1.00 20.49 C
-ATOM 338 NH1 ARG A 631 12.261 13.049 20.131 1.00 19.35 N
+ATOM 338 NH1 ARG A 631 12.261 13.049 20.131 1.00 19.35 N1+
ATOM 339 NH2 ARG A 631 10.424 11.678 20.177 1.00 21.00 N
ATOM 340 N ASP A 632 7.432 15.068 17.834 1.00 19.19 N
ATOM 341 CA ASP A 632 6.993 14.163 16.773 1.00 20.71 C
@@ -344,7 +345,7 @@ ATOM 343 O ASP A 632 6.382 14.597 14.488 1.00 22.01 O
ATOM 344 CB ASP A 632 6.113 13.041 17.340 1.00 20.48 C
ATOM 345 CG ASP A 632 6.866 12.124 18.291 1.00 23.90 C
ATOM 346 OD1 ASP A 632 8.117 12.116 18.260 1.00 24.02 O
-ATOM 347 OD2 ASP A 632 6.202 11.396 19.060 1.00 22.81 O
+ATOM 347 OD2 ASP A 632 6.202 11.396 19.060 1.00 22.81 O1-
ATOM 348 N ALA A 633 5.377 15.847 16.063 1.00 20.78 N
ATOM 349 CA ALA A 633 4.584 16.601 15.092 1.00 19.94 C
ATOM 350 C ALA A 633 5.463 17.462 14.189 1.00 19.91 C
@@ -366,7 +367,7 @@ ATOM 365 CB GLU A 635 9.791 14.583 13.249 1.00 27.88 C
ATOM 366 CG GLU A 635 10.783 14.862 14.357 1.00 32.99 C
ATOM 367 CD GLU A 635 11.470 13.599 14.863 1.00 37.02 C
ATOM 368 OE1 GLU A 635 10.770 12.597 15.147 1.00 37.30 O
-ATOM 369 OE2 GLU A 635 12.715 13.617 14.985 1.00 36.68 O
+ATOM 369 OE2 GLU A 635 12.715 13.617 14.985 1.00 36.68 O1-
ATOM 370 N GLU A 636 7.098 15.158 11.717 1.00 25.49 N
ATOM 371 CA GLU A 636 6.107 14.744 10.729 1.00 25.74 C
ATOM 372 C GLU A 636 5.922 15.839 9.682 1.00 24.31 C
@@ -375,15 +376,15 @@ ATOM 374 CB GLU A 636 4.783 14.408 11.420 1.00 28.10 C
ATOM 375 CG GLU A 636 4.868 13.107 12.213 1.00 35.55 C
ATOM 376 CD GLU A 636 3.708 12.893 13.172 1.00 39.22 C
ATOM 377 OE1 GLU A 636 3.733 11.879 13.906 1.00 41.01 O
-ATOM 378 OE2 GLU A 636 2.779 13.729 13.197 1.00 41.29 O
+ATOM 378 OE2 GLU A 636 2.779 13.729 13.197 1.00 41.29 O1-
ATOM 379 N HIS A 637 5.944 17.092 10.128 1.00 21.18 N
ATOM 380 CA HIS A 637 5.817 18.226 9.216 1.00 21.27 C
ATOM 381 C HIS A 637 7.011 18.237 8.265 1.00 20.79 C
ATOM 382 O HIS A 637 6.851 18.308 7.051 1.00 22.39 O
ATOM 383 CB HIS A 637 5.793 19.545 9.999 1.00 19.37 C
ATOM 384 CG HIS A 637 5.972 20.763 9.144 1.00 18.27 C
-ATOM 385 ND1 HIS A 637 4.919 21.406 8.528 1.00 18.47 N
-ATOM 386 CD2 HIS A 637 7.088 21.442 8.786 1.00 17.90 C
+ATOM 385 CD2 HIS A 637 7.088 21.442 8.786 1.00 17.90 C
+ATOM 386 ND1 HIS A 637 4.919 21.406 8.528 1.00 18.47 N
ATOM 387 CE1 HIS A 637 5.380 22.429 7.828 1.00 20.00 C
ATOM 388 NE2 HIS A 637 6.693 22.472 7.968 1.00 20.07 N
ATOM 389 N LEU A 638 8.212 18.166 8.828 1.00 21.34 N
@@ -407,7 +408,7 @@ ATOM 406 O ASP A 640 7.215 16.501 3.113 1.00 24.77 O
ATOM 407 CB ASP A 640 4.900 16.360 5.160 1.00 29.20 C
ATOM 408 CG ASP A 640 3.561 16.136 4.479 1.00 30.20 C
ATOM 409 OD1 ASP A 640 3.543 15.822 3.270 1.00 29.28 O
-ATOM 410 OD2 ASP A 640 2.524 16.288 5.159 1.00 31.80 O
+ATOM 410 OD2 ASP A 640 2.524 16.288 5.159 1.00 31.80 O1-
ATOM 411 N LYS A 641 5.938 14.803 2.387 1.00 28.36 N
ATOM 412 CA LYS A 641 6.334 15.004 0.997 1.00 29.95 C
ATOM 413 C LYS A 641 5.836 16.354 0.486 1.00 28.53 C
@@ -416,7 +417,7 @@ ATOM 415 CB LYS A 641 5.791 13.878 0.109 1.00 33.05 C
ATOM 416 CG LYS A 641 4.292 13.669 0.209 1.00 36.97 C
ATOM 417 CD LYS A 641 3.815 12.620 -0.783 1.00 40.79 C
ATOM 418 CE LYS A 641 2.335 12.330 -0.603 1.00 41.74 C
-ATOM 419 NZ LYS A 641 2.072 11.771 0.751 1.00 45.11 N
+ATOM 419 NZ LYS A 641 2.072 11.771 0.751 1.00 45.11 N1+
ATOM 420 N ASP A 642 4.729 16.839 1.044 1.00 26.59 N
ATOM 421 CA ASP A 642 4.177 18.122 0.617 1.00 25.30 C
ATOM 422 C ASP A 642 4.852 19.324 1.276 1.00 24.29 C
@@ -424,14 +425,14 @@ ATOM 423 O ASP A 642 4.522 20.475 0.968 1.00 24.39 O
ATOM 424 CB ASP A 642 2.672 18.178 0.886 1.00 27.51 C
ATOM 425 CG ASP A 642 1.902 17.107 0.132 1.00 31.39 C
ATOM 426 OD1 ASP A 642 2.387 16.654 -0.928 1.00 31.20 O
-ATOM 427 OD2 ASP A 642 0.802 16.733 0.595 1.00 33.90 O
+ATOM 427 OD2 ASP A 642 0.802 16.733 0.595 1.00 33.90 O1-
ATOM 428 N THR A 643 5.780 19.063 2.191 1.00 21.96 N
ATOM 429 CA THR A 643 6.496 20.143 2.861 1.00 21.25 C
ATOM 430 C THR A 643 7.764 20.421 2.057 1.00 21.70 C
ATOM 431 O THR A 643 8.511 19.498 1.728 1.00 20.83 O
ATOM 432 CB THR A 643 6.871 19.763 4.317 1.00 21.19 C
-ATOM 433 OG1 THR A 643 5.676 19.595 5.090 1.00 23.75 O
-ATOM 434 CG2 THR A 643 7.718 20.860 4.963 1.00 21.29 C
+ATOM 433 CG2 THR A 643 7.718 20.860 4.963 1.00 21.29 C
+ATOM 434 OG1 THR A 643 5.676 19.595 5.090 1.00 23.75 O
ATOM 435 N VAL A 644 7.993 21.692 1.733 1.00 20.11 N
ATOM 436 CA VAL A 644 9.159 22.083 0.946 1.00 20.60 C
ATOM 437 C VAL A 644 9.807 23.355 1.480 1.00 20.42 C
@@ -447,7 +448,7 @@ ATOM 446 CB GLU A 645 13.213 24.771 1.042 1.00 20.04 C
ATOM 447 CG GLU A 645 13.988 26.033 1.426 1.00 19.33 C
ATOM 448 CD GLU A 645 15.456 25.972 1.042 1.00 21.50 C
ATOM 449 OE1 GLU A 645 15.905 24.916 0.547 1.00 20.98 O
-ATOM 450 OE2 GLU A 645 16.162 26.982 1.240 1.00 18.05 O
+ATOM 450 OE2 GLU A 645 16.162 26.982 1.240 1.00 18.05 O1-
ATOM 451 N LYS A 646 10.975 27.085 1.716 1.00 17.70 N
ATOM 452 CA LYS A 646 10.374 28.320 1.241 1.00 18.30 C
ATOM 453 C LYS A 646 10.719 29.500 2.125 1.00 18.34 C
@@ -456,7 +457,7 @@ ATOM 455 CB LYS A 646 8.844 28.196 1.142 1.00 17.56 C
ATOM 456 CG LYS A 646 8.163 29.504 0.701 1.00 18.34 C
ATOM 457 CD LYS A 646 6.638 29.400 0.691 1.00 18.41 C
ATOM 458 CE LYS A 646 5.979 30.764 0.463 1.00 18.89 C
-ATOM 459 NZ LYS A 646 6.387 31.444 -0.812 1.00 18.07 N
+ATOM 459 NZ LYS A 646 6.387 31.444 -0.812 1.00 18.07 N1+
ATOM 460 N GLY A 647 11.679 30.300 1.675 1.00 19.27 N
ATOM 461 CA GLY A 647 12.053 31.489 2.413 1.00 20.98 C
ATOM 462 C GLY A 647 12.968 31.341 3.610 1.00 22.90 C
@@ -466,8 +467,8 @@ ATOM 465 CA THR A 648 13.878 32.464 5.567 1.00 21.46 C
ATOM 466 C THR A 648 13.277 33.360 6.646 1.00 22.14 C
ATOM 467 O THR A 648 12.331 34.111 6.397 1.00 23.96 O
ATOM 468 CB THR A 648 15.273 33.027 5.171 1.00 21.62 C
-ATOM 469 OG1 THR A 648 16.147 33.017 6.305 1.00 23.27 O
-ATOM 470 CG2 THR A 648 15.141 34.465 4.663 1.00 21.52 C
+ATOM 469 CG2 THR A 648 15.141 34.465 4.663 1.00 21.52 C
+ATOM 470 OG1 THR A 648 16.147 33.017 6.305 1.00 23.27 O
ATOM 471 N TYR A 649 13.823 33.252 7.853 1.00 22.84 N
ATOM 472 CA TYR A 649 13.417 34.080 8.985 1.00 21.74 C
ATOM 473 C TYR A 649 14.681 34.924 9.115 1.00 21.75 C
@@ -489,7 +490,7 @@ ATOM 488 CG ARG A 650 15.253 38.088 6.177 1.00 38.16 C
ATOM 489 CD ARG A 650 15.638 39.334 5.382 1.00 42.67 C
ATOM 490 NE ARG A 650 16.797 39.069 4.531 1.00 48.25 N
ATOM 491 CZ ARG A 650 16.796 38.220 3.508 1.00 49.25 C
-ATOM 492 NH1 ARG A 650 15.698 37.551 3.199 1.00 49.04 N
+ATOM 492 NH1 ARG A 650 15.698 37.551 3.199 1.00 49.04 N1+
ATOM 493 NH2 ARG A 650 17.899 38.031 2.802 1.00 52.43 N
ATOM 494 N ARG A 651 15.986 37.454 10.739 1.00 22.52 N
ATOM 495 CA ARG A 651 16.686 37.721 11.993 1.00 23.89 C
@@ -500,7 +501,7 @@ ATOM 499 CG ARG A 651 15.022 39.333 13.020 1.00 24.43 C
ATOM 500 CD ARG A 651 14.049 39.575 14.164 1.00 26.72 C
ATOM 501 NE ARG A 651 13.463 40.913 14.097 1.00 26.02 N
ATOM 502 CZ ARG A 651 12.587 41.305 13.178 1.00 28.34 C
-ATOM 503 NH1 ARG A 651 12.179 40.460 12.235 1.00 24.95 N
+ATOM 503 NH1 ARG A 651 12.179 40.460 12.235 1.00 24.95 N1+
ATOM 504 NH2 ARG A 651 12.118 42.547 13.198 1.00 29.86 N
ATOM 505 N GLU A 652 17.243 35.356 12.020 1.00 23.75 N
ATOM 506 CA GLU A 652 18.084 34.194 12.291 1.00 24.55 C
@@ -510,7 +511,7 @@ ATOM 509 CB GLU A 652 17.203 32.992 12.649 1.00 23.99 C
ATOM 510 CG GLU A 652 17.942 31.710 12.986 1.00 24.09 C
ATOM 511 CD GLU A 652 18.819 31.829 14.216 1.00 25.13 C
ATOM 512 OE1 GLU A 652 18.327 32.277 15.276 1.00 23.91 O
-ATOM 513 OE2 GLU A 652 20.004 31.459 14.122 1.00 25.99 O
+ATOM 513 OE2 GLU A 652 20.004 31.459 14.122 1.00 25.99 O1-
ATOM 514 N LYS A 653 20.032 34.585 10.899 1.00 28.76 N
ATOM 515 CA LYS A 653 20.880 34.498 9.713 1.00 29.42 C
ATOM 516 C LYS A 653 21.106 33.110 9.144 1.00 27.43 C
@@ -519,7 +520,7 @@ ATOM 518 CB LYS A 653 22.246 35.131 9.990 1.00 34.07 C
ATOM 519 CG LYS A 653 22.370 36.594 9.596 1.00 41.24 C
ATOM 520 CD LYS A 653 21.530 37.514 10.476 1.00 45.18 C
ATOM 521 CE LYS A 653 21.845 38.979 10.175 1.00 46.99 C
-ATOM 522 NZ LYS A 653 21.082 39.919 11.039 1.00 46.25 N
+ATOM 522 NZ LYS A 653 21.082 39.919 11.039 1.00 46.25 N1+
ATOM 523 N GLY A 654 20.831 32.960 7.850 1.00 26.61 N
ATOM 524 CA GLY A 654 21.039 31.687 7.186 1.00 25.42 C
ATOM 525 C GLY A 654 19.987 30.635 7.468 1.00 24.96 C
@@ -538,7 +539,7 @@ ATOM 537 CB LYS A 656 16.345 26.876 5.378 1.00 17.61 C
ATOM 538 CG LYS A 656 17.650 27.229 4.683 1.00 21.20 C
ATOM 539 CD LYS A 656 18.233 26.041 3.927 1.00 23.91 C
ATOM 540 CE LYS A 656 19.517 26.435 3.220 1.00 24.85 C
-ATOM 541 NZ LYS A 656 20.115 25.289 2.490 1.00 26.88 N
+ATOM 541 NZ LYS A 656 20.115 25.289 2.490 1.00 26.88 N1+
ATOM 542 N VAL A 657 13.278 28.131 6.011 1.00 19.58 N
ATOM 543 CA VAL A 657 11.927 27.839 6.453 1.00 18.14 C
ATOM 544 C VAL A 657 11.336 26.738 5.591 1.00 18.91 C
@@ -575,8 +576,8 @@ ATOM 574 C ASN A 660 2.101 23.711 3.541 1.00 23.84 C
ATOM 575 O ASN A 660 1.398 24.246 4.398 1.00 24.06 O
ATOM 576 CB ASN A 660 3.076 21.957 5.040 1.00 21.36 C
ATOM 577 CG ASN A 660 2.135 20.856 4.571 1.00 25.05 C
-ATOM 578 OD1 ASN A 660 0.966 21.107 4.275 1.00 23.90 O
-ATOM 579 ND2 ASN A 660 2.646 19.631 4.493 1.00 23.75 N
+ATOM 578 ND2 ASN A 660 2.646 19.631 4.493 1.00 23.75 N
+ATOM 579 OD1 ASN A 660 0.966 21.107 4.275 1.00 23.90 O
ATOM 580 N PRO A 661 1.787 23.754 2.233 1.00 24.64 N
ATOM 581 CA PRO A 661 0.596 24.436 1.706 1.00 25.61 C
ATOM 582 C PRO A 661 -0.744 23.915 2.218 1.00 27.05 C
@@ -590,15 +591,15 @@ ATOM 589 C ASN A 662 -2.358 22.535 4.578 1.00 26.50 C
ATOM 590 O ASN A 662 -3.482 22.977 4.816 1.00 26.45 O
ATOM 591 CB ASN A 662 -1.858 20.541 3.158 1.00 30.17 C
ATOM 592 CG ASN A 662 -1.579 20.004 1.767 1.00 34.95 C
-ATOM 593 OD1 ASN A 662 -0.972 18.945 1.606 1.00 38.50 O
-ATOM 594 ND2 ASN A 662 -2.032 20.731 0.751 1.00 36.15 N
+ATOM 593 ND2 ASN A 662 -2.032 20.731 0.751 1.00 36.15 N
+ATOM 594 OD1 ASN A 662 -0.972 18.945 1.606 1.00 38.50 O
ATOM 595 N THR A 663 -1.405 22.442 5.501 1.00 23.79 N
ATOM 596 CA THR A 663 -1.634 22.871 6.877 1.00 22.37 C
ATOM 597 C THR A 663 -1.321 24.358 7.041 1.00 21.76 C
ATOM 598 O THR A 663 -1.761 24.986 8.002 1.00 22.78 O
ATOM 599 CB THR A 663 -0.736 22.096 7.864 1.00 22.72 C
-ATOM 600 OG1 THR A 663 0.639 22.353 7.548 1.00 21.54 O
-ATOM 601 CG2 THR A 663 -1.002 20.597 7.782 1.00 22.53 C
+ATOM 600 CG2 THR A 663 -1.002 20.597 7.782 1.00 22.53 C
+ATOM 601 OG1 THR A 663 0.639 22.353 7.548 1.00 21.54 O
ATOM 602 N MET A 664 -0.560 24.910 6.099 1.00 21.92 N
ATOM 603 CA MET A 664 -0.147 26.314 6.138 1.00 22.92 C
ATOM 604 C MET A 664 0.895 26.551 7.241 1.00 22.79 C
@@ -613,8 +614,8 @@ ATOM 612 C ASN A 665 3.863 25.819 8.273 1.00 20.22 C
ATOM 613 O ASN A 665 4.184 25.382 7.170 1.00 19.95 O
ATOM 614 CB ASN A 665 2.479 24.387 9.743 1.00 19.64 C
ATOM 615 CG ASN A 665 1.251 24.302 10.613 1.00 22.78 C
-ATOM 616 OD1 ASN A 665 0.630 25.320 10.918 1.00 22.57 O
-ATOM 617 ND2 ASN A 665 0.900 23.087 11.037 1.00 22.10 N
+ATOM 616 ND2 ASN A 665 0.900 23.087 11.037 1.00 22.10 N
+ATOM 617 OD1 ASN A 665 0.630 25.320 10.918 1.00 22.57 O
ATOM 618 N VAL A 666 4.689 26.502 9.056 1.00 20.39 N
ATOM 619 CA VAL A 666 6.080 26.730 8.700 1.00 19.02 C
ATOM 620 C VAL A 666 6.909 26.296 9.895 1.00 20.48 C
@@ -653,7 +654,7 @@ ATOM 652 CB LYS A 670 19.365 27.493 13.234 1.00 19.29 C
ATOM 653 CG LYS A 670 18.407 27.864 14.356 1.00 21.81 C
ATOM 654 CD LYS A 670 19.016 27.657 15.740 1.00 23.29 C
ATOM 655 CE LYS A 670 20.152 28.624 16.005 1.00 30.88 C
-ATOM 656 NZ LYS A 670 20.750 28.419 17.362 1.00 33.11 N
+ATOM 656 NZ LYS A 670 20.750 28.419 17.362 1.00 33.11 N1+
ATOM 657 N SER A 671 20.723 27.882 10.509 1.00 18.51 N
ATOM 658 CA SER A 671 21.719 27.499 9.512 1.00 20.59 C
ATOM 659 C SER A 671 22.445 26.213 9.917 1.00 20.28 C
@@ -666,8 +667,8 @@ ATOM 665 C ASN A 672 22.261 23.500 11.654 1.00 20.04 C
ATOM 666 O ASN A 672 22.653 22.406 12.061 1.00 19.36 O
ATOM 667 CB ASN A 672 23.787 24.893 13.069 1.00 19.43 C
ATOM 668 CG ASN A 672 22.739 25.183 14.125 1.00 22.83 C
-ATOM 669 OD1 ASN A 672 21.540 24.971 13.916 1.00 18.43 O
-ATOM 670 ND2 ASN A 672 23.191 25.661 15.280 1.00 21.72 N
+ATOM 669 ND2 ASN A 672 23.191 25.661 15.280 1.00 21.72 N
+ATOM 670 OD1 ASN A 672 21.540 24.971 13.916 1.00 18.43 O
ATOM 671 N GLY A 673 21.030 23.701 11.192 1.00 19.42 N
ATOM 672 CA GLY A 673 20.084 22.601 11.106 1.00 17.58 C
ATOM 673 C GLY A 673 19.197 22.359 12.311 1.00 17.96 C
@@ -680,7 +681,7 @@ ATOM 679 CB GLU A 674 19.346 23.492 15.807 1.00 23.92 C
ATOM 680 CG GLU A 674 20.753 22.955 15.983 1.00 31.15 C
ATOM 681 CD GLU A 674 21.333 23.295 17.338 1.00 36.07 C
ATOM 682 OE1 GLU A 674 21.123 24.435 17.810 1.00 39.48 O
-ATOM 683 OE2 GLU A 674 22.007 22.423 17.925 1.00 39.58 O
+ATOM 683 OE2 GLU A 674 22.007 22.423 17.925 1.00 39.58 O1-
ATOM 684 N PHE A 675 16.262 22.973 15.132 1.00 19.41 N
ATOM 685 CA PHE A 675 14.897 23.485 15.135 1.00 18.81 C
ATOM 686 C PHE A 675 14.843 24.782 15.943 1.00 17.84 C
@@ -718,9 +719,9 @@ ATOM 717 CB TRP A 679 3.536 29.619 14.191 1.00 18.23 C
ATOM 718 CG TRP A 679 4.165 30.701 13.362 1.00 17.92 C
ATOM 719 CD1 TRP A 679 3.591 31.382 12.328 1.00 19.01 C
ATOM 720 CD2 TRP A 679 5.489 31.231 13.508 1.00 17.66 C
-ATOM 721 NE1 TRP A 679 4.473 32.308 11.822 1.00 19.49 N
-ATOM 722 CE2 TRP A 679 5.648 32.234 12.525 1.00 18.45 C
-ATOM 723 CE3 TRP A 679 6.558 30.954 14.375 1.00 19.59 C
+ATOM 721 CE2 TRP A 679 5.648 32.234 12.525 1.00 18.45 C
+ATOM 722 CE3 TRP A 679 6.558 30.954 14.375 1.00 19.59 C
+ATOM 723 NE1 TRP A 679 4.473 32.308 11.822 1.00 19.49 N
ATOM 724 CZ2 TRP A 679 6.835 32.966 12.383 1.00 16.41 C
ATOM 725 CZ3 TRP A 679 7.740 31.682 14.235 1.00 19.01 C
ATOM 726 CH2 TRP A 679 7.866 32.677 13.242 1.00 18.47 C
@@ -732,7 +733,7 @@ ATOM 731 CB LYS A 680 -0.795 28.051 11.533 1.00 22.03 C
ATOM 732 CG LYS A 680 -1.663 27.721 10.315 1.00 21.38 C
ATOM 733 CD LYS A 680 -3.041 27.175 10.697 1.00 22.73 C
ATOM 734 CE LYS A 680 -2.951 25.909 11.543 1.00 21.82 C
-ATOM 735 NZ LYS A 680 -2.122 24.850 10.891 1.00 24.14 N
+ATOM 735 NZ LYS A 680 -2.122 24.850 10.891 1.00 24.14 N1+
ATOM 736 N ILE A 681 0.748 29.938 9.196 1.00 21.73 N
ATOM 737 CA ILE A 681 0.697 31.155 8.398 1.00 22.09 C
ATOM 738 C ILE A 681 -0.764 31.535 8.158 1.00 24.15 C
@@ -747,8 +748,8 @@ ATOM 746 C ASN A 682 -2.462 34.003 6.761 1.00 27.25 C
ATOM 747 O ASN A 682 -1.965 35.124 6.668 1.00 26.84 O
ATOM 748 CB ASN A 682 -2.966 34.209 9.195 1.00 26.29 C
ATOM 749 CG ASN A 682 -4.449 34.545 9.045 1.00 29.27 C
-ATOM 750 OD1 ASN A 682 -4.985 34.555 7.936 1.00 28.12 O
-ATOM 751 ND2 ASN A 682 -5.112 34.832 10.160 1.00 28.48 N
+ATOM 750 ND2 ASN A 682 -5.112 34.832 10.160 1.00 28.48 N
+ATOM 751 OD1 ASN A 682 -4.985 34.555 7.936 1.00 28.12 O
ATOM 752 N PRO A 683 -3.022 33.387 5.709 1.00 28.74 N
ATOM 753 CA PRO A 683 -3.058 34.010 4.382 1.00 29.90 C
ATOM 754 C PRO A 683 -3.835 35.321 4.291 1.00 30.40 C
@@ -763,7 +764,7 @@ ATOM 762 O ASP A 684 -5.392 39.110 5.688 1.00 32.91 O
ATOM 763 CB ASP A 684 -6.866 36.536 5.968 1.00 33.08 C
ATOM 764 CG ASP A 684 -7.685 35.428 5.342 1.00 34.55 C
ATOM 765 OD1 ASP A 684 -7.673 35.316 4.099 1.00 35.62 O
-ATOM 766 OD2 ASP A 684 -8.349 34.680 6.088 1.00 38.21 O
+ATOM 766 OD2 ASP A 684 -8.349 34.680 6.088 1.00 38.21 O1-
ATOM 767 N ALA A 685 -3.729 37.818 6.468 1.00 30.27 N
ATOM 768 CA ALA A 685 -3.005 38.931 7.078 1.00 28.53 C
ATOM 769 C ALA A 685 -1.859 39.398 6.191 1.00 28.60 C
@@ -776,15 +777,15 @@ ATOM 775 O ASP A 686 1.669 40.257 4.785 1.00 27.87 O
ATOM 776 CB ASP A 686 -0.184 42.691 5.832 1.00 30.98 C
ATOM 777 CG ASP A 686 -1.357 43.541 5.386 1.00 35.66 C
ATOM 778 OD1 ASP A 686 -2.009 43.172 4.387 1.00 37.93 O
-ATOM 779 OD2 ASP A 686 -1.623 44.582 6.020 1.00 38.15 O
+ATOM 779 OD2 ASP A 686 -1.623 44.582 6.020 1.00 38.15 O1-
ATOM 780 N ASN A 687 1.181 39.999 6.958 1.00 26.91 N
ATOM 781 CA ASN A 687 2.403 39.242 7.220 1.00 26.72 C
ATOM 782 C ASN A 687 2.357 37.935 6.439 1.00 24.93 C
ATOM 783 O ASN A 687 3.347 37.534 5.825 1.00 23.18 O
ATOM 784 CB ASN A 687 2.551 38.927 8.712 1.00 28.70 C
ATOM 785 CG ASN A 687 3.108 40.096 9.510 1.00 31.56 C
-ATOM 786 OD1 ASN A 687 3.437 41.148 8.955 1.00 29.82 O
-ATOM 787 ND2 ASN A 687 3.223 39.910 10.826 1.00 30.78 N
+ATOM 786 ND2 ASN A 687 3.223 39.910 10.826 1.00 30.78 N
+ATOM 787 OD1 ASN A 687 3.437 41.148 8.955 1.00 29.82 O
ATOM 788 N GLY A 688 1.199 37.280 6.470 1.00 24.25 N
ATOM 789 CA GLY A 688 1.031 36.023 5.762 1.00 24.66 C
ATOM 790 C GLY A 688 1.221 36.177 4.266 1.00 26.24 C
@@ -798,7 +799,7 @@ ATOM 797 CG ARG A 689 -1.694 38.153 1.904 1.00 39.88 C
ATOM 798 CD ARG A 689 -2.620 39.347 1.882 1.00 44.68 C
ATOM 799 NE ARG A 689 -4.014 38.930 1.975 1.00 49.42 N
ATOM 800 CZ ARG A 689 -5.017 39.751 2.264 1.00 53.80 C
-ATOM 801 NH1 ARG A 689 -4.776 41.037 2.491 1.00 54.92 N
+ATOM 801 NH1 ARG A 689 -4.776 41.037 2.491 1.00 54.92 N1+
ATOM 802 NH2 ARG A 689 -6.262 39.288 2.321 1.00 54.99 N
ATOM 803 N ILE A 690 2.806 38.571 2.675 1.00 26.18 N
ATOM 804 CA ILE A 690 4.188 38.933 2.380 1.00 25.99 C
@@ -836,14 +837,14 @@ ATOM 835 CB GLU A 693 4.077 37.671 -2.215 1.00 27.39 C
ATOM 836 CG GLU A 693 2.559 37.699 -2.194 1.00 34.65 C
ATOM 837 CD GLU A 693 2.002 39.114 -2.281 1.00 41.47 C
ATOM 838 OE1 GLU A 693 2.454 39.987 -1.507 1.00 43.74 O
-ATOM 839 OE2 GLU A 693 1.105 39.351 -3.119 1.00 44.98 O
+ATOM 839 OE2 GLU A 693 1.105 39.351 -3.119 1.00 44.98 O1-
ATOM 840 N THR A 694 6.880 36.564 -1.045 1.00 22.07 N
ATOM 841 CA THR A 694 8.323 36.789 -1.047 1.00 20.79 C
ATOM 842 C THR A 694 9.198 35.828 -0.255 1.00 20.74 C
ATOM 843 O THR A 694 10.423 35.867 -0.379 1.00 17.00 O
ATOM 844 CB THR A 694 8.640 38.195 -0.524 1.00 22.93 C
-ATOM 845 OG1 THR A 694 8.381 38.238 0.887 1.00 23.84 O
-ATOM 846 CG2 THR A 694 7.771 39.234 -1.224 1.00 22.41 C
+ATOM 845 CG2 THR A 694 7.771 39.234 -1.224 1.00 22.41 C
+ATOM 846 OG1 THR A 694 8.381 38.238 0.887 1.00 23.84 O
ATOM 847 N GLY A 695 8.588 34.987 0.572 1.00 21.43 N
ATOM 848 CA GLY A 695 9.373 34.054 1.362 1.00 21.27 C
ATOM 849 C GLY A 695 9.974 34.672 2.616 1.00 23.50 C
@@ -856,7 +857,7 @@ ATOM 855 CB GLU A 696 10.326 38.135 3.791 1.00 26.94 C
ATOM 856 CG GLU A 696 11.324 38.508 2.719 1.00 33.88 C
ATOM 857 CD GLU A 696 12.722 38.029 3.047 1.00 37.53 C
ATOM 858 OE1 GLU A 696 13.167 38.248 4.196 1.00 39.47 O
-ATOM 859 OE2 GLU A 696 13.377 37.443 2.157 1.00 40.01 O
+ATOM 859 OE2 GLU A 696 13.377 37.443 2.157 1.00 40.01 O1-
ATOM 860 N LEU A 697 9.793 35.727 6.250 1.00 25.08 N
ATOM 861 CA LEU A 697 8.999 35.444 7.438 1.00 26.48 C
ATOM 862 C LEU A 697 9.354 36.405 8.572 1.00 27.42 C
@@ -865,706 +866,708 @@ ATOM 864 CB LEU A 697 9.239 33.999 7.883 1.00 25.69 C
ATOM 865 CG LEU A 697 8.338 33.405 8.965 1.00 25.34 C
ATOM 866 CD1 LEU A 697 6.892 33.373 8.483 1.00 24.31 C
ATOM 867 CD2 LEU A 697 8.823 31.995 9.300 1.00 24.30 C
-TER 868 LEU A 697
-ATOM 869 N MET B 1 -17.733 35.711 20.312 1.00 57.34 N
-ATOM 870 CA MET B 1 -16.251 35.600 20.210 1.00 57.04 C
-ATOM 871 C MET B 1 -15.596 36.971 20.315 1.00 54.70 C
-ATOM 872 O MET B 1 -15.629 37.756 19.367 1.00 56.32 O
-ATOM 873 CB MET B 1 -15.867 34.941 18.883 1.00 60.60 C
-ATOM 874 CG MET B 1 -14.370 34.828 18.659 1.00 63.89 C
-ATOM 875 SD MET B 1 -13.948 33.619 17.389 1.00 69.94 S
-ATOM 876 CE MET B 1 -14.063 32.073 18.337 1.00 68.26 C
-ATOM 877 N ASN B 2 -15.003 37.253 21.471 1.00 50.91 N
-ATOM 878 CA ASN B 2 -14.340 38.532 21.697 1.00 46.77 C
-ATOM 879 C ASN B 2 -13.249 38.770 20.661 1.00 44.48 C
-ATOM 880 O ASN B 2 -12.145 38.234 20.764 1.00 42.64 O
-ATOM 881 CB ASN B 2 -13.749 38.579 23.108 1.00 47.03 C
-ATOM 882 CG ASN B 2 -13.027 39.880 23.393 1.00 47.53 C
+TER
+ATOM 868 N MET B 1 -17.733 35.711 20.312 1.00 57.34 N
+ATOM 869 CA MET B 1 -16.251 35.600 20.210 1.00 57.04 C
+ATOM 870 C MET B 1 -15.596 36.971 20.315 1.00 54.70 C
+ATOM 871 O MET B 1 -15.629 37.756 19.367 1.00 56.32 O
+ATOM 872 CB MET B 1 -15.867 34.941 18.883 1.00 60.60 C
+ATOM 873 CG MET B 1 -14.370 34.828 18.659 1.00 63.89 C
+ATOM 874 SD MET B 1 -13.948 33.619 17.389 1.00 69.94 S
+ATOM 875 CE MET B 1 -14.063 32.073 18.337 1.00 68.26 C
+ATOM 876 N ASN B 2 -15.003 37.253 21.471 1.00 50.91 N
+ATOM 877 CA ASN B 2 -14.340 38.532 21.697 1.00 46.77 C
+ATOM 878 C ASN B 2 -13.249 38.770 20.661 1.00 44.48 C
+ATOM 879 O ASN B 2 -12.145 38.234 20.764 1.00 42.64 O
+ATOM 880 CB ASN B 2 -13.749 38.579 23.108 1.00 47.03 C
+ATOM 881 CG ASN B 2 -13.027 39.880 23.393 1.00 47.53 C
+ATOM 882 ND2 ASN B 2 -11.980 39.811 24.206 1.00 48.40 N
ATOM 883 OD1 ASN B 2 -13.413 40.939 22.896 1.00 47.45 O
-ATOM 884 ND2 ASN B 2 -11.980 39.811 24.206 1.00 48.40 N
-ATOM 885 N LYS B 3 -13.571 39.584 19.663 1.00 41.51 N
-ATOM 886 CA LYS B 3 -12.641 39.890 18.589 1.00 40.27 C
-ATOM 887 C LYS B 3 -11.505 40.807 19.015 1.00 38.11 C
-ATOM 888 O LYS B 3 -10.542 40.989 18.275 1.00 37.59 O
-ATOM 889 CB LYS B 3 -13.401 40.505 17.414 1.00 42.56 C
-ATOM 890 CG LYS B 3 -14.416 39.552 16.796 1.00 45.19 C
-ATOM 891 CD LYS B 3 -15.212 40.208 15.683 1.00 46.43 C
-ATOM 892 CE LYS B 3 -16.120 39.191 15.008 1.00 48.66 C
-ATOM 893 NZ LYS B 3 -16.998 38.496 15.991 1.00 50.20 N
-ATOM 894 N MET B 4 -11.615 41.381 20.207 1.00 35.23 N
-ATOM 895 CA MET B 4 -10.582 42.276 20.724 1.00 33.69 C
-ATOM 896 C MET B 4 -9.662 41.556 21.706 1.00 30.36 C
-ATOM 897 O MET B 4 -8.792 42.174 22.312 1.00 30.11 O
-ATOM 898 CB MET B 4 -11.230 43.470 21.425 1.00 34.74 C
-ATOM 899 CG MET B 4 -11.899 44.459 20.491 1.00 35.92 C
-ATOM 900 SD MET B 4 -10.689 45.385 19.545 1.00 40.64 S
-ATOM 901 CE MET B 4 -10.090 46.508 20.803 1.00 37.94 C
-ATOM 902 N ALA B 5 -9.860 40.249 21.850 1.00 28.09 N
-ATOM 903 CA ALA B 5 -9.081 39.430 22.775 1.00 26.66 C
-ATOM 904 C ALA B 5 -7.573 39.693 22.768 1.00 24.69 C
-ATOM 905 O ALA B 5 -6.970 39.914 23.820 1.00 25.16 O
-ATOM 906 CB ALA B 5 -9.356 37.946 22.506 1.00 25.81 C
-ATOM 907 N MET B 6 -6.959 39.671 21.592 1.00 23.95 N
-ATOM 908 CA MET B 6 -5.521 39.899 21.505 1.00 22.54 C
-ATOM 909 C MET B 6 -5.121 41.304 21.918 1.00 23.88 C
-ATOM 910 O MET B 6 -4.061 41.506 22.510 1.00 21.19 O
-ATOM 911 CB MET B 6 -5.029 39.601 20.091 1.00 23.60 C
-ATOM 912 CG MET B 6 -5.102 38.121 19.761 1.00 23.98 C
-ATOM 913 SD MET B 6 -4.687 37.771 18.067 1.00 27.08 S
-ATOM 914 CE MET B 6 -2.880 37.649 18.167 1.00 22.63 C
-ATOM 915 N ILE B 7 -5.972 42.275 21.610 1.00 26.35 N
-ATOM 916 CA ILE B 7 -5.687 43.654 21.972 1.00 26.89 C
-ATOM 917 C ILE B 7 -5.838 43.828 23.483 1.00 25.61 C
-ATOM 918 O ILE B 7 -5.050 44.532 24.115 1.00 24.33 O
-ATOM 919 CB ILE B 7 -6.623 44.608 21.214 1.00 30.05 C
-ATOM 920 CG1 ILE B 7 -6.487 44.341 19.713 1.00 31.81 C
-ATOM 921 CG2 ILE B 7 -6.269 46.058 21.521 1.00 30.01 C
-ATOM 922 CD1 ILE B 7 -5.205 44.856 19.119 1.00 39.80 C
-ATOM 923 N ASP B 8 -6.841 43.172 24.061 1.00 25.56 N
-ATOM 924 CA ASP B 8 -7.060 43.246 25.503 1.00 26.39 C
-ATOM 925 C ASP B 8 -5.866 42.622 26.217 1.00 25.58 C
-ATOM 926 O ASP B 8 -5.443 43.096 27.271 1.00 25.25 O
-ATOM 927 CB ASP B 8 -8.336 42.499 25.914 1.00 28.15 C
-ATOM 928 CG ASP B 8 -9.597 43.149 25.376 1.00 29.32 C
-ATOM 929 OD1 ASP B 8 -9.562 44.355 25.057 1.00 30.35 O
-ATOM 930 OD2 ASP B 8 -10.627 42.453 25.286 1.00 30.98 O
-ATOM 931 N LEU B 9 -5.329 41.549 25.644 1.00 24.02 N
-ATOM 932 CA LEU B 9 -4.174 40.891 26.236 1.00 22.41 C
-ATOM 933 C LEU B 9 -3.011 41.876 26.287 1.00 20.21 C
-ATOM 934 O LEU B 9 -2.342 42.007 27.304 1.00 21.89 O
-ATOM 935 CB LEU B 9 -3.760 39.668 25.410 1.00 23.97 C
-ATOM 936 CG LEU B 9 -4.231 38.286 25.862 1.00 27.51 C
-ATOM 937 CD1 LEU B 9 -3.586 37.220 24.974 1.00 29.40 C
-ATOM 938 CD2 LEU B 9 -3.843 38.060 27.317 1.00 26.59 C
-ATOM 939 N ALA B 10 -2.777 42.563 25.177 1.00 20.93 N
-ATOM 940 CA ALA B 10 -1.693 43.532 25.087 1.00 22.29 C
-ATOM 941 C ALA B 10 -1.833 44.625 26.143 1.00 23.34 C
-ATOM 942 O ALA B 10 -0.838 45.073 26.719 1.00 23.07 O
-ATOM 943 CB ALA B 10 -1.663 44.149 23.693 1.00 21.84 C
-ATOM 944 N LYS B 11 -3.066 45.058 26.393 1.00 23.51 N
-ATOM 945 CA LYS B 11 -3.304 46.095 27.388 1.00 21.94 C
-ATOM 946 C LYS B 11 -3.041 45.569 28.794 1.00 21.56 C
-ATOM 947 O LYS B 11 -2.541 46.302 29.647 1.00 19.03 O
-ATOM 948 CB LYS B 11 -4.731 46.635 27.269 1.00 24.62 C
-ATOM 949 CG LYS B 11 -4.958 47.402 25.969 1.00 29.60 C
-ATOM 950 CD LYS B 11 -6.347 47.994 25.886 1.00 32.55 C
-ATOM 951 CE LYS B 11 -6.578 48.648 24.525 1.00 35.24 C
-ATOM 952 NZ LYS B 11 -5.557 49.689 24.223 1.00 36.87 N
-ATOM 953 N LEU B 12 -3.372 44.303 29.044 1.00 20.47 N
-ATOM 954 CA LEU B 12 -3.112 43.731 30.362 1.00 21.64 C
-ATOM 955 C LEU B 12 -1.601 43.704 30.561 1.00 20.47 C
-ATOM 956 O LEU B 12 -1.102 43.969 31.653 1.00 21.41 O
-ATOM 957 CB LEU B 12 -3.656 42.302 30.468 1.00 22.01 C
-ATOM 958 CG LEU B 12 -5.163 42.100 30.621 1.00 24.37 C
-ATOM 959 CD1 LEU B 12 -5.454 40.610 30.772 1.00 24.29 C
-ATOM 960 CD2 LEU B 12 -5.667 42.867 31.845 1.00 26.50 C
-ATOM 961 N PHE B 13 -0.879 43.394 29.489 1.00 18.79 N
-ATOM 962 CA PHE B 13 0.574 43.323 29.544 1.00 18.12 C
-ATOM 963 C PHE B 13 1.235 44.678 29.781 1.00 18.07 C
-ATOM 964 O PHE B 13 2.143 44.794 30.605 1.00 17.56 O
-ATOM 965 CB PHE B 13 1.122 42.695 28.259 1.00 15.58 C
-ATOM 966 CG PHE B 13 2.624 42.726 28.163 1.00 18.20 C
-ATOM 967 CD1 PHE B 13 3.413 42.175 29.173 1.00 17.11 C
-ATOM 968 CD2 PHE B 13 3.251 43.315 27.066 1.00 17.04 C
-ATOM 969 CE1 PHE B 13 4.811 42.211 29.095 1.00 18.15 C
-ATOM 970 CE2 PHE B 13 4.650 43.356 26.975 1.00 17.67 C
-ATOM 971 CZ PHE B 13 5.429 42.803 27.991 1.00 17.99 C
-ATOM 972 N LEU B 14 0.790 45.702 29.063 1.00 18.02 N
-ATOM 973 CA LEU B 14 1.373 47.026 29.234 1.00 19.13 C
-ATOM 974 C LEU B 14 1.127 47.565 30.642 1.00 21.69 C
-ATOM 975 O LEU B 14 1.924 48.346 31.158 1.00 20.80 O
-ATOM 976 CB LEU B 14 0.809 48.007 28.195 1.00 21.19 C
-ATOM 977 CG LEU B 14 1.183 47.757 26.731 1.00 20.96 C
-ATOM 978 CD1 LEU B 14 0.641 48.892 25.879 1.00 22.30 C
-ATOM 979 CD2 LEU B 14 2.698 47.662 26.584 1.00 21.64 C
-ATOM 980 N ALA B 15 0.029 47.143 31.264 1.00 20.84 N
-ATOM 981 CA ALA B 15 -0.290 47.596 32.618 1.00 20.47 C
-ATOM 982 C ALA B 15 0.400 46.703 33.650 1.00 21.99 C
-ATOM 983 O ALA B 15 0.226 46.875 34.857 1.00 22.93 O
-ATOM 984 CB ALA B 15 -1.804 47.576 32.831 1.00 19.33 C
-ATOM 985 N SER B 16 1.184 45.749 33.156 1.00 20.74 N
-ATOM 986 CA SER B 16 1.912 44.807 33.995 1.00 20.55 C
-ATOM 987 C SER B 16 1.014 43.919 34.853 1.00 20.73 C
-ATOM 988 O SER B 16 1.435 43.447 35.902 1.00 19.91 O
-ATOM 989 CB SER B 16 2.913 45.545 34.891 1.00 21.84 C
-ATOM 990 OG SER B 16 3.918 46.182 34.120 1.00 22.24 O
-ATOM 991 N LYS B 17 -0.221 43.694 34.415 1.00 20.00 N
-ATOM 992 CA LYS B 17 -1.132 42.830 35.157 1.00 20.15 C
-ATOM 993 C LYS B 17 -0.783 41.368 34.857 1.00 19.14 C
-ATOM 994 O LYS B 17 -1.122 40.461 35.619 1.00 18.19 O
-ATOM 995 CB LYS B 17 -2.585 43.146 34.784 1.00 21.48 C
-ATOM 996 CG LYS B 17 -3.007 44.558 35.199 1.00 22.80 C
-ATOM 997 CD LYS B 17 -4.457 44.842 34.845 1.00 28.59 C
-ATOM 998 CE LYS B 17 -4.891 46.208 35.358 1.00 31.22 C
-ATOM 999 NZ LYS B 17 -6.311 46.489 35.007 1.00 35.57 N
-ATOM 1000 N ILE B 18 -0.118 41.145 33.728 1.00 19.79 N
-ATOM 1001 CA ILE B 18 0.342 39.806 33.359 1.00 19.21 C
-ATOM 1002 C ILE B 18 1.790 39.993 32.917 1.00 19.54 C
-ATOM 1003 O ILE B 18 2.163 41.077 32.468 1.00 18.99 O
-ATOM 1004 CB ILE B 18 -0.492 39.176 32.212 1.00 20.59 C
-ATOM 1005 CG1 ILE B 18 -0.352 39.992 30.926 1.00 21.50 C
-ATOM 1006 CG2 ILE B 18 -1.951 39.081 32.635 1.00 19.93 C
-ATOM 1007 CD1 ILE B 18 -1.027 39.350 29.723 1.00 23.91 C
-ATOM 1008 N THR B 19 2.605 38.952 33.057 1.00 18.71 N
-ATOM 1009 CA THR B 19 4.022 39.031 32.699 1.00 17.59 C
-ATOM 1010 C THR B 19 4.268 38.880 31.201 1.00 18.96 C
-ATOM 1011 O THR B 19 3.360 38.543 30.443 1.00 18.24 O
-ATOM 1012 CB THR B 19 4.826 37.936 33.416 1.00 16.82 C
+ATOM 884 N LYS B 3 -13.571 39.584 19.663 1.00 41.51 N
+ATOM 885 CA LYS B 3 -12.641 39.890 18.589 1.00 40.27 C
+ATOM 886 C LYS B 3 -11.505 40.807 19.015 1.00 38.11 C
+ATOM 887 O LYS B 3 -10.542 40.989 18.275 1.00 37.59 O
+ATOM 888 CB LYS B 3 -13.401 40.505 17.414 1.00 42.56 C
+ATOM 889 CG LYS B 3 -14.416 39.552 16.796 1.00 45.19 C
+ATOM 890 CD LYS B 3 -15.212 40.208 15.683 1.00 46.43 C
+ATOM 891 CE LYS B 3 -16.120 39.191 15.008 1.00 48.66 C
+ATOM 892 NZ LYS B 3 -16.998 38.496 15.991 1.00 50.20 N1+
+ATOM 893 N MET B 4 -11.615 41.381 20.207 1.00 35.23 N
+ATOM 894 CA MET B 4 -10.582 42.276 20.724 1.00 33.69 C
+ATOM 895 C MET B 4 -9.662 41.556 21.706 1.00 30.36 C
+ATOM 896 O MET B 4 -8.792 42.174 22.312 1.00 30.11 O
+ATOM 897 CB MET B 4 -11.230 43.470 21.425 1.00 34.74 C
+ATOM 898 CG MET B 4 -11.899 44.459 20.491 1.00 35.92 C
+ATOM 899 SD MET B 4 -10.689 45.385 19.545 1.00 40.64 S
+ATOM 900 CE MET B 4 -10.090 46.508 20.803 1.00 37.94 C
+ATOM 901 N ALA B 5 -9.860 40.249 21.850 1.00 28.09 N
+ATOM 902 CA ALA B 5 -9.081 39.430 22.775 1.00 26.66 C
+ATOM 903 C ALA B 5 -7.573 39.693 22.768 1.00 24.69 C
+ATOM 904 O ALA B 5 -6.970 39.914 23.820 1.00 25.16 O
+ATOM 905 CB ALA B 5 -9.356 37.946 22.506 1.00 25.81 C
+ATOM 906 N MET B 6 -6.959 39.671 21.592 1.00 23.95 N
+ATOM 907 CA MET B 6 -5.521 39.899 21.505 1.00 22.54 C
+ATOM 908 C MET B 6 -5.121 41.304 21.918 1.00 23.88 C
+ATOM 909 O MET B 6 -4.061 41.506 22.510 1.00 21.19 O
+ATOM 910 CB MET B 6 -5.029 39.601 20.091 1.00 23.60 C
+ATOM 911 CG MET B 6 -5.102 38.121 19.761 1.00 23.98 C
+ATOM 912 SD MET B 6 -4.687 37.771 18.067 1.00 27.08 S
+ATOM 913 CE MET B 6 -2.880 37.649 18.167 1.00 22.63 C
+ATOM 914 N ILE B 7 -5.972 42.275 21.610 1.00 26.35 N
+ATOM 915 CA ILE B 7 -5.687 43.654 21.972 1.00 26.89 C
+ATOM 916 C ILE B 7 -5.838 43.828 23.483 1.00 25.61 C
+ATOM 917 O ILE B 7 -5.050 44.532 24.115 1.00 24.33 O
+ATOM 918 CB ILE B 7 -6.623 44.608 21.214 1.00 30.05 C
+ATOM 919 CG1 ILE B 7 -6.487 44.341 19.713 1.00 31.81 C
+ATOM 920 CG2 ILE B 7 -6.269 46.058 21.521 1.00 30.01 C
+ATOM 921 CD1 ILE B 7 -5.205 44.856 19.119 1.00 39.80 C
+ATOM 922 N ASP B 8 -6.841 43.172 24.061 1.00 25.56 N
+ATOM 923 CA ASP B 8 -7.060 43.246 25.503 1.00 26.39 C
+ATOM 924 C ASP B 8 -5.866 42.622 26.217 1.00 25.58 C
+ATOM 925 O ASP B 8 -5.443 43.096 27.271 1.00 25.25 O
+ATOM 926 CB ASP B 8 -8.336 42.499 25.914 1.00 28.15 C
+ATOM 927 CG ASP B 8 -9.597 43.149 25.376 1.00 29.32 C
+ATOM 928 OD1 ASP B 8 -9.562 44.355 25.057 1.00 30.35 O
+ATOM 929 OD2 ASP B 8 -10.627 42.453 25.286 1.00 30.98 O1-
+ATOM 930 N LEU B 9 -5.329 41.549 25.644 1.00 24.02 N
+ATOM 931 CA LEU B 9 -4.174 40.891 26.236 1.00 22.41 C
+ATOM 932 C LEU B 9 -3.011 41.876 26.287 1.00 20.21 C
+ATOM 933 O LEU B 9 -2.342 42.007 27.304 1.00 21.89 O
+ATOM 934 CB LEU B 9 -3.760 39.668 25.410 1.00 23.97 C
+ATOM 935 CG LEU B 9 -4.231 38.286 25.862 1.00 27.51 C
+ATOM 936 CD1 LEU B 9 -3.586 37.220 24.974 1.00 29.40 C
+ATOM 937 CD2 LEU B 9 -3.843 38.060 27.317 1.00 26.59 C
+ATOM 938 N ALA B 10 -2.777 42.563 25.177 1.00 20.93 N
+ATOM 939 CA ALA B 10 -1.693 43.532 25.087 1.00 22.29 C
+ATOM 940 C ALA B 10 -1.833 44.625 26.143 1.00 23.34 C
+ATOM 941 O ALA B 10 -0.838 45.073 26.719 1.00 23.07 O
+ATOM 942 CB ALA B 10 -1.663 44.149 23.693 1.00 21.84 C
+ATOM 943 N LYS B 11 -3.066 45.058 26.393 1.00 23.51 N
+ATOM 944 CA LYS B 11 -3.304 46.095 27.388 1.00 21.94 C
+ATOM 945 C LYS B 11 -3.041 45.569 28.794 1.00 21.56 C
+ATOM 946 O LYS B 11 -2.541 46.302 29.647 1.00 19.03 O
+ATOM 947 CB LYS B 11 -4.731 46.635 27.269 1.00 24.62 C
+ATOM 948 CG LYS B 11 -4.958 47.402 25.969 1.00 29.60 C
+ATOM 949 CD LYS B 11 -6.347 47.994 25.886 1.00 32.55 C
+ATOM 950 CE LYS B 11 -6.578 48.648 24.525 1.00 35.24 C
+ATOM 951 NZ LYS B 11 -5.557 49.689 24.223 1.00 36.87 N1+
+ATOM 952 N LEU B 12 -3.372 44.303 29.044 1.00 20.47 N
+ATOM 953 CA LEU B 12 -3.112 43.731 30.362 1.00 21.64 C
+ATOM 954 C LEU B 12 -1.601 43.704 30.561 1.00 20.47 C
+ATOM 955 O LEU B 12 -1.102 43.969 31.653 1.00 21.41 O
+ATOM 956 CB LEU B 12 -3.656 42.302 30.468 1.00 22.01 C
+ATOM 957 CG LEU B 12 -5.163 42.100 30.621 1.00 24.37 C
+ATOM 958 CD1 LEU B 12 -5.454 40.610 30.772 1.00 24.29 C
+ATOM 959 CD2 LEU B 12 -5.667 42.867 31.845 1.00 26.50 C
+ATOM 960 N PHE B 13 -0.879 43.394 29.489 1.00 18.79 N
+ATOM 961 CA PHE B 13 0.574 43.323 29.544 1.00 18.12 C
+ATOM 962 C PHE B 13 1.235 44.678 29.781 1.00 18.07 C
+ATOM 963 O PHE B 13 2.143 44.794 30.605 1.00 17.56 O
+ATOM 964 CB PHE B 13 1.122 42.695 28.259 1.00 15.58 C
+ATOM 965 CG PHE B 13 2.624 42.726 28.163 1.00 18.20 C
+ATOM 966 CD1 PHE B 13 3.413 42.175 29.173 1.00 17.11 C
+ATOM 967 CD2 PHE B 13 3.251 43.315 27.066 1.00 17.04 C
+ATOM 968 CE1 PHE B 13 4.811 42.211 29.095 1.00 18.15 C
+ATOM 969 CE2 PHE B 13 4.650 43.356 26.975 1.00 17.67 C
+ATOM 970 CZ PHE B 13 5.429 42.803 27.991 1.00 17.99 C
+ATOM 971 N LEU B 14 0.790 45.702 29.063 1.00 18.02 N
+ATOM 972 CA LEU B 14 1.373 47.026 29.234 1.00 19.13 C
+ATOM 973 C LEU B 14 1.127 47.565 30.642 1.00 21.69 C
+ATOM 974 O LEU B 14 1.924 48.346 31.158 1.00 20.80 O
+ATOM 975 CB LEU B 14 0.809 48.007 28.195 1.00 21.19 C
+ATOM 976 CG LEU B 14 1.183 47.757 26.731 1.00 20.96 C
+ATOM 977 CD1 LEU B 14 0.641 48.892 25.879 1.00 22.30 C
+ATOM 978 CD2 LEU B 14 2.698 47.662 26.584 1.00 21.64 C
+ATOM 979 N ALA B 15 0.029 47.143 31.264 1.00 20.84 N
+ATOM 980 CA ALA B 15 -0.290 47.596 32.618 1.00 20.47 C
+ATOM 981 C ALA B 15 0.400 46.703 33.650 1.00 21.99 C
+ATOM 982 O ALA B 15 0.226 46.875 34.857 1.00 22.93 O
+ATOM 983 CB ALA B 15 -1.804 47.576 32.831 1.00 19.33 C
+ATOM 984 N SER B 16 1.184 45.749 33.156 1.00 20.74 N
+ATOM 985 CA SER B 16 1.912 44.807 33.995 1.00 20.55 C
+ATOM 986 C SER B 16 1.014 43.919 34.853 1.00 20.73 C
+ATOM 987 O SER B 16 1.435 43.447 35.902 1.00 19.91 O
+ATOM 988 CB SER B 16 2.913 45.545 34.891 1.00 21.84 C
+ATOM 989 OG SER B 16 3.918 46.182 34.120 1.00 22.24 O
+ATOM 990 N LYS B 17 -0.221 43.694 34.415 1.00 20.00 N
+ATOM 991 CA LYS B 17 -1.132 42.830 35.157 1.00 20.15 C
+ATOM 992 C LYS B 17 -0.783 41.368 34.857 1.00 19.14 C
+ATOM 993 O LYS B 17 -1.122 40.461 35.619 1.00 18.19 O
+ATOM 994 CB LYS B 17 -2.585 43.146 34.784 1.00 21.48 C
+ATOM 995 CG LYS B 17 -3.007 44.558 35.199 1.00 22.80 C
+ATOM 996 CD LYS B 17 -4.457 44.842 34.845 1.00 28.59 C
+ATOM 997 CE LYS B 17 -4.891 46.208 35.358 1.00 31.22 C
+ATOM 998 NZ LYS B 17 -6.311 46.489 35.007 1.00 35.57 N1+
+ATOM 999 N ILE B 18 -0.118 41.145 33.728 1.00 19.79 N
+ATOM 1000 CA ILE B 18 0.342 39.806 33.359 1.00 19.21 C
+ATOM 1001 C ILE B 18 1.790 39.993 32.917 1.00 19.54 C
+ATOM 1002 O ILE B 18 2.163 41.077 32.468 1.00 18.99 O
+ATOM 1003 CB ILE B 18 -0.492 39.176 32.212 1.00 20.59 C
+ATOM 1004 CG1 ILE B 18 -0.352 39.992 30.926 1.00 21.50 C
+ATOM 1005 CG2 ILE B 18 -1.951 39.081 32.635 1.00 19.93 C
+ATOM 1006 CD1 ILE B 18 -1.027 39.350 29.723 1.00 23.91 C
+ATOM 1007 N THR B 19 2.605 38.952 33.057 1.00 18.71 N
+ATOM 1008 CA THR B 19 4.022 39.031 32.699 1.00 17.59 C
+ATOM 1009 C THR B 19 4.268 38.880 31.201 1.00 18.96 C
+ATOM 1010 O THR B 19 3.360 38.543 30.443 1.00 18.24 O
+ATOM 1011 CB THR B 19 4.826 37.936 33.416 1.00 16.82 C
+ATOM 1012 CG2 THR B 19 4.561 37.977 34.920 1.00 17.62 C
ATOM 1013 OG1 THR B 19 4.422 36.656 32.916 1.00 17.24 O
-ATOM 1014 CG2 THR B 19 4.561 37.977 34.920 1.00 17.62 C
-ATOM 1015 N ALA B 20 5.504 39.132 30.779 1.00 17.05 N
-ATOM 1016 CA ALA B 20 5.851 38.992 29.373 1.00 16.83 C
-ATOM 1017 C ALA B 20 5.658 37.527 28.980 1.00 17.46 C
-ATOM 1018 O ALA B 20 5.138 37.222 27.900 1.00 19.63 O
-ATOM 1019 CB ALA B 20 7.299 39.421 29.141 1.00 14.80 C
-ATOM 1020 N ILE B 21 6.072 36.618 29.855 1.00 18.70 N
-ATOM 1021 CA ILE B 21 5.921 35.194 29.562 1.00 19.95 C
-ATOM 1022 C ILE B 21 4.445 34.829 29.405 1.00 20.07 C
-ATOM 1023 O ILE B 21 4.065 34.150 28.448 1.00 21.21 O
-ATOM 1024 CB ILE B 21 6.544 34.326 30.672 1.00 20.17 C
-ATOM 1025 CG1 ILE B 21 8.068 34.455 30.630 1.00 17.24 C
-ATOM 1026 CG2 ILE B 21 6.126 32.864 30.495 1.00 21.87 C
-ATOM 1027 CD1 ILE B 21 8.778 33.683 31.726 1.00 20.04 C
-ATOM 1028 N GLU B 22 3.616 35.279 30.342 1.00 19.81 N
-ATOM 1029 CA GLU B 22 2.185 34.991 30.275 1.00 20.59 C
-ATOM 1030 C GLU B 22 1.607 35.561 28.989 1.00 19.97 C
-ATOM 1031 O GLU B 22 0.829 34.904 28.299 1.00 19.73 O
-ATOM 1032 CB GLU B 22 1.460 35.593 31.481 1.00 21.91 C
-ATOM 1033 CG GLU B 22 1.599 34.788 32.773 1.00 21.98 C
-ATOM 1034 CD GLU B 22 1.089 35.550 33.985 1.00 24.48 C
-ATOM 1035 OE1 GLU B 22 0.758 34.907 35.006 1.00 26.89 O
-ATOM 1036 OE2 GLU B 22 1.031 36.796 33.922 1.00 20.53 O
-ATOM 1037 N PHE B 23 1.987 36.793 28.668 1.00 20.21 N
-ATOM 1038 CA PHE B 23 1.505 37.434 27.453 1.00 19.32 C
-ATOM 1039 C PHE B 23 1.909 36.636 26.212 1.00 19.13 C
-ATOM 1040 O PHE B 23 1.076 36.343 25.355 1.00 18.93 O
-ATOM 1041 CB PHE B 23 2.069 38.855 27.340 1.00 18.39 C
-ATOM 1042 CG PHE B 23 1.763 39.522 26.033 1.00 18.24 C
-ATOM 1043 CD1 PHE B 23 0.471 39.950 25.740 1.00 19.86 C
-ATOM 1044 CD2 PHE B 23 2.760 39.694 25.074 1.00 18.78 C
-ATOM 1045 CE1 PHE B 23 0.172 40.537 24.510 1.00 19.63 C
-ATOM 1046 CE2 PHE B 23 2.475 40.279 23.839 1.00 18.81 C
-ATOM 1047 CZ PHE B 23 1.176 40.703 23.555 1.00 22.23 C
-ATOM 1048 N SER B 24 3.189 36.282 26.123 1.00 20.01 N
-ATOM 1049 CA SER B 24 3.696 35.548 24.964 1.00 20.03 C
-ATOM 1050 C SER B 24 3.031 34.185 24.755 1.00 21.50 C
-ATOM 1051 O SER B 24 2.939 33.698 23.626 1.00 20.46 O
-ATOM 1052 CB SER B 24 5.218 35.381 25.063 1.00 20.80 C
-ATOM 1053 OG SER B 24 5.580 34.554 26.155 1.00 25.77 O
-ATOM 1054 N GLU B 25 2.565 33.568 25.835 1.00 20.65 N
-ATOM 1055 CA GLU B 25 1.910 32.275 25.714 1.00 22.38 C
-ATOM 1056 C GLU B 25 0.427 32.456 25.391 1.00 21.50 C
-ATOM 1057 O GLU B 25 -0.095 31.825 24.471 1.00 19.69 O
-ATOM 1058 CB GLU B 25 2.091 31.467 27.007 1.00 23.40 C
-ATOM 1059 CG GLU B 25 3.563 31.246 27.369 1.00 23.47 C
-ATOM 1060 CD GLU B 25 3.765 30.351 28.582 1.00 25.87 C
-ATOM 1061 OE1 GLU B 25 2.862 30.278 29.438 1.00 23.32 O
-ATOM 1062 OE2 GLU B 25 4.844 29.733 28.688 1.00 27.24 O
-ATOM 1063 N ARG B 26 -0.248 33.330 26.130 1.00 20.90 N
-ATOM 1064 CA ARG B 26 -1.672 33.559 25.894 1.00 20.98 C
-ATOM 1065 C ARG B 26 -1.971 34.156 24.518 1.00 21.23 C
-ATOM 1066 O ARG B 26 -3.032 33.903 23.942 1.00 21.87 O
-ATOM 1067 CB ARG B 26 -2.253 34.446 27.003 1.00 21.63 C
-ATOM 1068 CG ARG B 26 -2.250 33.758 28.366 1.00 24.10 C
-ATOM 1069 CD ARG B 26 -2.738 34.665 29.489 1.00 27.25 C
-ATOM 1070 NE ARG B 26 -4.108 35.131 29.278 1.00 31.00 N
-ATOM 1071 CZ ARG B 26 -4.764 35.920 30.126 1.00 32.89 C
-ATOM 1072 NH1 ARG B 26 -4.174 36.329 31.244 1.00 30.16 N
-ATOM 1073 NH2 ARG B 26 -6.008 36.304 29.858 1.00 31.62 N
-ATOM 1074 N ILE B 27 -1.035 34.931 23.979 1.00 20.87 N
-ATOM 1075 CA ILE B 27 -1.236 35.540 22.668 1.00 21.31 C
-ATOM 1076 C ILE B 27 -1.368 34.447 21.601 1.00 21.22 C
-ATOM 1077 O ILE B 27 -2.085 34.620 20.619 1.00 19.56 O
-ATOM 1078 CB ILE B 27 -0.069 36.494 22.301 1.00 24.53 C
-ATOM 1079 CG1 ILE B 27 -0.459 37.375 21.110 1.00 27.74 C
-ATOM 1080 CG2 ILE B 27 1.174 35.697 21.953 1.00 26.12 C
-ATOM 1081 CD1 ILE B 27 -1.575 38.365 21.412 1.00 28.77 C
-ATOM 1082 N CYS B 28 -0.685 33.323 21.801 1.00 20.12 N
-ATOM 1083 CA CYS B 28 -0.753 32.211 20.852 1.00 20.88 C
-ATOM 1084 C CYS B 28 -2.113 31.524 20.948 1.00 21.99 C
-ATOM 1085 O CYS B 28 -2.669 31.095 19.936 1.00 22.90 O
-ATOM 1086 CB CYS B 28 0.353 31.186 21.127 1.00 20.09 C
-ATOM 1087 SG CYS B 28 2.046 31.781 20.835 1.00 19.81 S
-ATOM 1088 N VAL B 29 -2.640 31.410 22.164 1.00 20.97 N
-ATOM 1089 CA VAL B 29 -3.943 30.790 22.361 1.00 23.62 C
-ATOM 1090 C VAL B 29 -5.014 31.656 21.699 1.00 24.12 C
-ATOM 1091 O VAL B 29 -5.845 31.161 20.942 1.00 25.97 O
-ATOM 1092 CB VAL B 29 -4.273 30.633 23.866 1.00 23.93 C
-ATOM 1093 CG1 VAL B 29 -5.698 30.111 24.044 1.00 24.24 C
-ATOM 1094 CG2 VAL B 29 -3.291 29.671 24.511 1.00 24.84 C
-ATOM 1095 N GLU B 30 -4.982 32.956 21.967 1.00 24.26 N
-ATOM 1096 CA GLU B 30 -5.969 33.861 21.385 1.00 25.47 C
-ATOM 1097 C GLU B 30 -5.868 33.953 19.865 1.00 26.03 C
-ATOM 1098 O GLU B 30 -6.889 33.997 19.173 1.00 24.93 O
-ATOM 1099 CB GLU B 30 -5.837 35.259 21.996 1.00 26.02 C
-ATOM 1100 CG GLU B 30 -6.123 35.309 23.486 1.00 28.88 C
-ATOM 1101 CD GLU B 30 -7.426 34.618 23.851 1.00 33.45 C
-ATOM 1102 OE1 GLU B 30 -8.453 34.880 23.188 1.00 33.18 O
-ATOM 1103 OE2 GLU B 30 -7.425 33.812 24.808 1.00 36.46 O
-ATOM 1104 N ARG B 31 -4.646 33.987 19.342 1.00 24.47 N
-ATOM 1105 CA ARG B 31 -4.463 34.072 17.898 1.00 26.81 C
-ATOM 1106 C ARG B 31 -5.094 32.857 17.229 1.00 27.86 C
-ATOM 1107 O ARG B 31 -5.804 32.980 16.229 1.00 28.12 O
-ATOM 1108 CB ARG B 31 -2.977 34.122 17.534 1.00 25.57 C
-ATOM 1109 CG ARG B 31 -2.732 34.391 16.053 1.00 26.85 C
-ATOM 1110 CD ARG B 31 -1.567 33.575 15.521 1.00 26.39 C
-ATOM 1111 NE ARG B 31 -1.206 33.946 14.154 1.00 21.91 N
-ATOM 1112 CZ ARG B 31 -0.652 33.111 13.282 1.00 22.45 C
-ATOM 1113 NH1 ARG B 31 -0.400 31.854 13.633 1.00 20.12 N
-ATOM 1114 NH2 ARG B 31 -0.345 33.531 12.062 1.00 22.27 N
-ATOM 1115 N ARG B 32 -4.826 31.684 17.792 1.00 29.61 N
-ATOM 1116 CA ARG B 32 -5.350 30.436 17.257 1.00 31.14 C
-ATOM 1117 C ARG B 32 -6.876 30.457 17.295 1.00 33.95 C
-ATOM 1118 O ARG B 32 -7.540 29.948 16.393 1.00 34.74 O
-ATOM 1119 CB ARG B 32 -4.809 29.257 18.075 1.00 29.29 C
-ATOM 1120 CG ARG B 32 -5.019 27.889 17.443 1.00 26.99 C
-ATOM 1121 CD ARG B 32 -4.239 26.809 18.195 1.00 27.42 C
-ATOM 1122 NE ARG B 32 -2.801 27.074 18.191 1.00 24.69 N
-ATOM 1123 CZ ARG B 32 -2.069 27.289 19.282 1.00 24.43 C
-ATOM 1124 NH1 ARG B 32 -2.632 27.268 20.485 1.00 23.31 N
-ATOM 1125 NH2 ARG B 32 -0.770 27.536 19.171 1.00 23.23 N
-ATOM 1126 N ARG B 33 -7.423 31.071 18.338 1.00 35.95 N
-ATOM 1127 CA ARG B 33 -8.867 31.160 18.509 1.00 37.96 C
-ATOM 1128 C ARG B 33 -9.521 32.049 17.448 1.00 37.77 C
-ATOM 1129 O ARG B 33 -10.628 31.769 16.993 1.00 38.91 O
-ATOM 1130 CB ARG B 33 -9.182 31.702 19.906 1.00 39.97 C
-ATOM 1131 CG ARG B 33 -10.626 31.542 20.346 1.00 45.19 C
-ATOM 1132 CD ARG B 33 -10.820 32.105 21.748 1.00 47.80 C
-ATOM 1133 NE ARG B 33 -10.687 33.561 21.774 1.00 52.92 N
-ATOM 1134 CZ ARG B 33 -11.581 34.401 21.257 1.00 53.57 C
-ATOM 1135 NH1 ARG B 33 -12.675 33.924 20.681 1.00 55.29 N
-ATOM 1136 NH2 ARG B 33 -11.383 35.713 21.309 1.00 52.22 N
-ATOM 1137 N LEU B 34 -8.833 33.116 17.053 1.00 36.29 N
-ATOM 1138 CA LEU B 34 -9.361 34.046 16.059 1.00 36.42 C
-ATOM 1139 C LEU B 34 -8.925 33.744 14.628 1.00 37.01 C
-ATOM 1140 O LEU B 34 -9.342 34.428 13.692 1.00 36.35 O
-ATOM 1141 CB LEU B 34 -8.944 35.475 16.409 1.00 36.22 C
-ATOM 1142 CG LEU B 34 -9.467 36.030 17.733 1.00 36.96 C
-ATOM 1143 CD1 LEU B 34 -8.805 37.375 18.016 1.00 36.55 C
-ATOM 1144 CD2 LEU B 34 -10.987 36.167 17.668 1.00 36.19 C
-ATOM 1145 N TYR B 35 -8.086 32.729 14.455 1.00 37.11 N
-ATOM 1146 CA TYR B 35 -7.599 32.370 13.126 1.00 37.87 C
-ATOM 1147 C TYR B 35 -8.739 31.986 12.186 1.00 39.73 C
-ATOM 1148 O TYR B 35 -9.522 31.085 12.482 1.00 39.22 O
-ATOM 1149 CB TYR B 35 -6.621 31.202 13.223 1.00 35.94 C
-ATOM 1150 CG TYR B 35 -5.952 30.839 11.913 1.00 34.45 C
-ATOM 1151 CD1 TYR B 35 -4.775 31.469 11.509 1.00 33.64 C
-ATOM 1152 CD2 TYR B 35 -6.480 29.843 11.092 1.00 32.99 C
-ATOM 1153 CE1 TYR B 35 -4.134 31.109 10.320 1.00 31.55 C
-ATOM 1154 CE2 TYR B 35 -5.850 29.478 9.898 1.00 31.39 C
-ATOM 1155 CZ TYR B 35 -4.678 30.112 9.522 1.00 30.70 C
-ATOM 1156 OH TYR B 35 -4.040 29.738 8.359 1.00 28.82 O
-ATOM 1157 N GLY B 36 -8.824 32.675 11.053 1.00 42.84 N
-ATOM 1158 CA GLY B 36 -9.856 32.374 10.075 1.00 47.34 C
-ATOM 1159 C GLY B 36 -11.253 32.851 10.418 1.00 49.95 C
-ATOM 1160 O GLY B 36 -12.210 32.517 9.716 1.00 50.37 O
-ATOM 1161 N VAL B 37 -11.382 33.624 11.491 1.00 51.86 N
-ATOM 1162 CA VAL B 37 -12.685 34.137 11.893 1.00 54.42 C
-ATOM 1163 C VAL B 37 -13.089 35.286 10.981 1.00 56.54 C
-ATOM 1164 O VAL B 37 -12.619 36.415 11.136 1.00 57.40 O
-ATOM 1165 CB VAL B 37 -12.674 34.636 13.357 1.00 54.35 C
-ATOM 1166 CG1 VAL B 37 -13.983 35.341 13.678 1.00 54.35 C
-ATOM 1167 CG2 VAL B 37 -12.474 33.463 14.300 1.00 54.03 C
-ATOM 1168 N LYS B 38 -13.957 34.986 10.021 1.00 59.00 N
-ATOM 1169 CA LYS B 38 -14.436 35.989 9.080 1.00 60.75 C
-ATOM 1170 C LYS B 38 -15.195 37.055 9.860 1.00 60.65 C
-ATOM 1171 O LYS B 38 -15.584 36.829 11.006 1.00 61.37 O
-ATOM 1172 CB LYS B 38 -15.349 35.333 8.042 1.00 62.21 C
-ATOM 1173 CG LYS B 38 -14.680 34.190 7.293 1.00 63.77 C
-ATOM 1174 CD LYS B 38 -15.647 33.477 6.366 1.00 65.45 C
-ATOM 1175 CE LYS B 38 -14.986 32.270 5.712 1.00 65.80 C
-ATOM 1176 NZ LYS B 38 -15.922 31.536 4.814 1.00 66.45 N
-ATOM 1177 N ASP B 39 -15.402 38.211 9.239 1.00 60.48 N
-ATOM 1178 CA ASP B 39 -16.099 39.310 9.896 1.00 60.15 C
-ATOM 1179 C ASP B 39 -15.190 39.849 10.996 1.00 58.84 C
-ATOM 1180 O ASP B 39 -15.610 40.050 12.138 1.00 59.08 O
-ATOM 1181 CB ASP B 39 -17.430 38.822 10.483 1.00 62.00 C
-ATOM 1182 CG ASP B 39 -18.176 39.911 11.232 1.00 64.25 C
-ATOM 1183 OD1 ASP B 39 -18.394 40.997 10.650 1.00 65.75 O
-ATOM 1184 OD2 ASP B 39 -18.549 39.678 12.403 1.00 65.41 O
-ATOM 1185 N LEU B 40 -13.931 40.069 10.634 1.00 56.60 N
-ATOM 1186 CA LEU B 40 -12.930 40.588 11.556 1.00 54.17 C
-ATOM 1187 C LEU B 40 -12.173 41.725 10.882 1.00 51.97 C
-ATOM 1188 O LEU B 40 -11.621 41.557 9.796 1.00 53.24 O
-ATOM 1189 CB LEU B 40 -11.956 39.476 11.961 1.00 55.42 C
-ATOM 1190 CG LEU B 40 -10.756 39.861 12.834 1.00 56.96 C
-ATOM 1191 CD1 LEU B 40 -11.224 40.525 14.124 1.00 56.83 C
-ATOM 1192 CD2 LEU B 40 -9.944 38.612 13.139 1.00 57.75 C
-ATOM 1193 N SER B 41 -12.157 42.883 11.528 1.00 48.88 N
-ATOM 1194 CA SER B 41 -11.475 44.052 10.994 1.00 46.64 C
-ATOM 1195 C SER B 41 -10.026 43.746 10.628 1.00 45.05 C
-ATOM 1196 O SER B 41 -9.295 43.131 11.404 1.00 45.73 O
-ATOM 1197 CB SER B 41 -11.511 45.188 12.019 1.00 47.05 C
-ATOM 1198 OG SER B 41 -10.792 46.318 11.557 1.00 48.87 O
-ATOM 1199 N PRO B 42 -9.595 44.164 9.429 1.00 42.73 N
-ATOM 1200 CA PRO B 42 -8.218 43.919 8.997 1.00 40.61 C
-ATOM 1201 C PRO B 42 -7.240 44.633 9.927 1.00 38.99 C
-ATOM 1202 O PRO B 42 -6.139 44.149 10.184 1.00 35.84 O
-ATOM 1203 CB PRO B 42 -8.196 44.493 7.583 1.00 41.99 C
-ATOM 1204 CG PRO B 42 -9.599 44.258 7.112 1.00 41.98 C
-ATOM 1205 CD PRO B 42 -10.403 44.692 8.316 1.00 42.93 C
-ATOM 1206 N ASN B 43 -7.660 45.791 10.424 1.00 36.86 N
-ATOM 1207 CA ASN B 43 -6.845 46.589 11.328 1.00 36.32 C
-ATOM 1208 C ASN B 43 -6.566 45.789 12.602 1.00 35.90 C
-ATOM 1209 O ASN B 43 -5.441 45.762 13.106 1.00 33.52 O
-ATOM 1210 CB ASN B 43 -7.582 47.884 11.674 1.00 38.99 C
-ATOM 1211 CG ASN B 43 -6.693 48.897 12.356 1.00 41.14 C
+ATOM 1014 N ALA B 20 5.504 39.132 30.779 1.00 17.05 N
+ATOM 1015 CA ALA B 20 5.851 38.992 29.373 1.00 16.83 C
+ATOM 1016 C ALA B 20 5.658 37.527 28.980 1.00 17.46 C
+ATOM 1017 O ALA B 20 5.138 37.222 27.900 1.00 19.63 O
+ATOM 1018 CB ALA B 20 7.299 39.421 29.141 1.00 14.80 C
+ATOM 1019 N ILE B 21 6.072 36.618 29.855 1.00 18.70 N
+ATOM 1020 CA ILE B 21 5.921 35.194 29.562 1.00 19.95 C
+ATOM 1021 C ILE B 21 4.445 34.829 29.405 1.00 20.07 C
+ATOM 1022 O ILE B 21 4.065 34.150 28.448 1.00 21.21 O
+ATOM 1023 CB ILE B 21 6.544 34.326 30.672 1.00 20.17 C
+ATOM 1024 CG1 ILE B 21 8.068 34.455 30.630 1.00 17.24 C
+ATOM 1025 CG2 ILE B 21 6.126 32.864 30.495 1.00 21.87 C
+ATOM 1026 CD1 ILE B 21 8.778 33.683 31.726 1.00 20.04 C
+ATOM 1027 N GLU B 22 3.616 35.279 30.342 1.00 19.81 N
+ATOM 1028 CA GLU B 22 2.185 34.991 30.275 1.00 20.59 C
+ATOM 1029 C GLU B 22 1.607 35.561 28.989 1.00 19.97 C
+ATOM 1030 O GLU B 22 0.829 34.904 28.299 1.00 19.73 O
+ATOM 1031 CB GLU B 22 1.460 35.593 31.481 1.00 21.91 C
+ATOM 1032 CG GLU B 22 1.599 34.788 32.773 1.00 21.98 C
+ATOM 1033 CD GLU B 22 1.089 35.550 33.985 1.00 24.48 C
+ATOM 1034 OE1 GLU B 22 0.758 34.907 35.006 1.00 26.89 O
+ATOM 1035 OE2 GLU B 22 1.031 36.796 33.922 1.00 20.53 O1-
+ATOM 1036 N PHE B 23 1.987 36.793 28.668 1.00 20.21 N
+ATOM 1037 CA PHE B 23 1.505 37.434 27.453 1.00 19.32 C
+ATOM 1038 C PHE B 23 1.909 36.636 26.212 1.00 19.13 C
+ATOM 1039 O PHE B 23 1.076 36.343 25.355 1.00 18.93 O
+ATOM 1040 CB PHE B 23 2.069 38.855 27.340 1.00 18.39 C
+ATOM 1041 CG PHE B 23 1.763 39.522 26.033 1.00 18.24 C
+ATOM 1042 CD1 PHE B 23 0.471 39.950 25.740 1.00 19.86 C
+ATOM 1043 CD2 PHE B 23 2.760 39.694 25.074 1.00 18.78 C
+ATOM 1044 CE1 PHE B 23 0.172 40.537 24.510 1.00 19.63 C
+ATOM 1045 CE2 PHE B 23 2.475 40.279 23.839 1.00 18.81 C
+ATOM 1046 CZ PHE B 23 1.176 40.703 23.555 1.00 22.23 C
+ATOM 1047 N SER B 24 3.189 36.282 26.123 1.00 20.01 N
+ATOM 1048 CA SER B 24 3.696 35.548 24.964 1.00 20.03 C
+ATOM 1049 C SER B 24 3.031 34.185 24.755 1.00 21.50 C
+ATOM 1050 O SER B 24 2.939 33.698 23.626 1.00 20.46 O
+ATOM 1051 CB SER B 24 5.218 35.381 25.063 1.00 20.80 C
+ATOM 1052 OG SER B 24 5.580 34.554 26.155 1.00 25.77 O
+ATOM 1053 N GLU B 25 2.565 33.568 25.835 1.00 20.65 N
+ATOM 1054 CA GLU B 25 1.910 32.275 25.714 1.00 22.38 C
+ATOM 1055 C GLU B 25 0.427 32.456 25.391 1.00 21.50 C
+ATOM 1056 O GLU B 25 -0.095 31.825 24.471 1.00 19.69 O
+ATOM 1057 CB GLU B 25 2.091 31.467 27.007 1.00 23.40 C
+ATOM 1058 CG GLU B 25 3.563 31.246 27.369 1.00 23.47 C
+ATOM 1059 CD GLU B 25 3.765 30.351 28.582 1.00 25.87 C
+ATOM 1060 OE1 GLU B 25 2.862 30.278 29.438 1.00 23.32 O
+ATOM 1061 OE2 GLU B 25 4.844 29.733 28.688 1.00 27.24 O1-
+ATOM 1062 N ARG B 26 -0.248 33.330 26.130 1.00 20.90 N
+ATOM 1063 CA ARG B 26 -1.672 33.559 25.894 1.00 20.98 C
+ATOM 1064 C ARG B 26 -1.971 34.156 24.518 1.00 21.23 C
+ATOM 1065 O ARG B 26 -3.032 33.903 23.942 1.00 21.87 O
+ATOM 1066 CB ARG B 26 -2.253 34.446 27.003 1.00 21.63 C
+ATOM 1067 CG ARG B 26 -2.250 33.758 28.366 1.00 24.10 C
+ATOM 1068 CD ARG B 26 -2.738 34.665 29.489 1.00 27.25 C
+ATOM 1069 NE ARG B 26 -4.108 35.131 29.278 1.00 31.00 N
+ATOM 1070 CZ ARG B 26 -4.764 35.920 30.126 1.00 32.89 C
+ATOM 1071 NH1 ARG B 26 -4.174 36.329 31.244 1.00 30.16 N1+
+ATOM 1072 NH2 ARG B 26 -6.008 36.304 29.858 1.00 31.62 N
+ATOM 1073 N ILE B 27 -1.035 34.931 23.979 1.00 20.87 N
+ATOM 1074 CA ILE B 27 -1.236 35.540 22.668 1.00 21.31 C
+ATOM 1075 C ILE B 27 -1.368 34.447 21.601 1.00 21.22 C
+ATOM 1076 O ILE B 27 -2.085 34.620 20.619 1.00 19.56 O
+ATOM 1077 CB ILE B 27 -0.069 36.494 22.301 1.00 24.53 C
+ATOM 1078 CG1 ILE B 27 -0.459 37.375 21.110 1.00 27.74 C
+ATOM 1079 CG2 ILE B 27 1.174 35.697 21.953 1.00 26.12 C
+ATOM 1080 CD1 ILE B 27 -1.575 38.365 21.412 1.00 28.77 C
+ATOM 1081 N CYS B 28 -0.685 33.323 21.801 1.00 20.12 N
+ATOM 1082 CA CYS B 28 -0.753 32.211 20.852 1.00 20.88 C
+ATOM 1083 C CYS B 28 -2.113 31.524 20.948 1.00 21.99 C
+ATOM 1084 O CYS B 28 -2.669 31.095 19.936 1.00 22.90 O
+ATOM 1085 CB CYS B 28 0.353 31.186 21.127 1.00 20.09 C
+ATOM 1086 SG CYS B 28 2.046 31.781 20.835 1.00 19.81 S
+ATOM 1087 N VAL B 29 -2.640 31.410 22.164 1.00 20.97 N
+ATOM 1088 CA VAL B 29 -3.943 30.790 22.361 1.00 23.62 C
+ATOM 1089 C VAL B 29 -5.014 31.656 21.699 1.00 24.12 C
+ATOM 1090 O VAL B 29 -5.845 31.161 20.942 1.00 25.97 O
+ATOM 1091 CB VAL B 29 -4.273 30.633 23.866 1.00 23.93 C
+ATOM 1092 CG1 VAL B 29 -5.698 30.111 24.044 1.00 24.24 C
+ATOM 1093 CG2 VAL B 29 -3.291 29.671 24.511 1.00 24.84 C
+ATOM 1094 N GLU B 30 -4.982 32.956 21.967 1.00 24.26 N
+ATOM 1095 CA GLU B 30 -5.969 33.861 21.385 1.00 25.47 C
+ATOM 1096 C GLU B 30 -5.868 33.953 19.865 1.00 26.03 C
+ATOM 1097 O GLU B 30 -6.889 33.997 19.173 1.00 24.93 O
+ATOM 1098 CB GLU B 30 -5.837 35.259 21.996 1.00 26.02 C
+ATOM 1099 CG GLU B 30 -6.123 35.309 23.486 1.00 28.88 C
+ATOM 1100 CD GLU B 30 -7.426 34.618 23.851 1.00 33.45 C
+ATOM 1101 OE1 GLU B 30 -8.453 34.880 23.188 1.00 33.18 O
+ATOM 1102 OE2 GLU B 30 -7.425 33.812 24.808 1.00 36.46 O1-
+ATOM 1103 N ARG B 31 -4.646 33.987 19.342 1.00 24.47 N
+ATOM 1104 CA ARG B 31 -4.463 34.072 17.898 1.00 26.81 C
+ATOM 1105 C ARG B 31 -5.094 32.857 17.229 1.00 27.86 C
+ATOM 1106 O ARG B 31 -5.804 32.980 16.229 1.00 28.12 O
+ATOM 1107 CB ARG B 31 -2.977 34.122 17.534 1.00 25.57 C
+ATOM 1108 CG ARG B 31 -2.732 34.391 16.053 1.00 26.85 C
+ATOM 1109 CD ARG B 31 -1.567 33.575 15.521 1.00 26.39 C
+ATOM 1110 NE ARG B 31 -1.206 33.946 14.154 1.00 21.91 N
+ATOM 1111 CZ ARG B 31 -0.652 33.111 13.282 1.00 22.45 C
+ATOM 1112 NH1 ARG B 31 -0.400 31.854 13.633 1.00 20.12 N1+
+ATOM 1113 NH2 ARG B 31 -0.345 33.531 12.062 1.00 22.27 N
+ATOM 1114 N ARG B 32 -4.826 31.684 17.792 1.00 29.61 N
+ATOM 1115 CA ARG B 32 -5.350 30.436 17.257 1.00 31.14 C
+ATOM 1116 C ARG B 32 -6.876 30.457 17.295 1.00 33.95 C
+ATOM 1117 O ARG B 32 -7.540 29.948 16.393 1.00 34.74 O
+ATOM 1118 CB ARG B 32 -4.809 29.257 18.075 1.00 29.29 C
+ATOM 1119 CG ARG B 32 -5.019 27.889 17.443 1.00 26.99 C
+ATOM 1120 CD ARG B 32 -4.239 26.809 18.195 1.00 27.42 C
+ATOM 1121 NE ARG B 32 -2.801 27.074 18.191 1.00 24.69 N
+ATOM 1122 CZ ARG B 32 -2.069 27.289 19.282 1.00 24.43 C
+ATOM 1123 NH1 ARG B 32 -2.632 27.268 20.485 1.00 23.31 N1+
+ATOM 1124 NH2 ARG B 32 -0.770 27.536 19.171 1.00 23.23 N
+ATOM 1125 N ARG B 33 -7.423 31.071 18.338 1.00 35.95 N
+ATOM 1126 CA ARG B 33 -8.867 31.160 18.509 1.00 37.96 C
+ATOM 1127 C ARG B 33 -9.521 32.049 17.448 1.00 37.77 C
+ATOM 1128 O ARG B 33 -10.628 31.769 16.993 1.00 38.91 O
+ATOM 1129 CB ARG B 33 -9.182 31.702 19.906 1.00 39.97 C
+ATOM 1130 CG ARG B 33 -10.626 31.542 20.346 1.00 45.19 C
+ATOM 1131 CD ARG B 33 -10.820 32.105 21.748 1.00 47.80 C
+ATOM 1132 NE ARG B 33 -10.687 33.561 21.774 1.00 52.92 N
+ATOM 1133 CZ ARG B 33 -11.581 34.401 21.257 1.00 53.57 C
+ATOM 1134 NH1 ARG B 33 -12.675 33.924 20.681 1.00 55.29 N1+
+ATOM 1135 NH2 ARG B 33 -11.383 35.713 21.309 1.00 52.22 N
+ATOM 1136 N LEU B 34 -8.833 33.116 17.053 1.00 36.29 N
+ATOM 1137 CA LEU B 34 -9.361 34.046 16.059 1.00 36.42 C
+ATOM 1138 C LEU B 34 -8.925 33.744 14.628 1.00 37.01 C
+ATOM 1139 O LEU B 34 -9.342 34.428 13.692 1.00 36.35 O
+ATOM 1140 CB LEU B 34 -8.944 35.475 16.409 1.00 36.22 C
+ATOM 1141 CG LEU B 34 -9.467 36.030 17.733 1.00 36.96 C
+ATOM 1142 CD1 LEU B 34 -8.805 37.375 18.016 1.00 36.55 C
+ATOM 1143 CD2 LEU B 34 -10.987 36.167 17.668 1.00 36.19 C
+ATOM 1144 N TYR B 35 -8.086 32.729 14.455 1.00 37.11 N
+ATOM 1145 CA TYR B 35 -7.599 32.370 13.126 1.00 37.87 C
+ATOM 1146 C TYR B 35 -8.739 31.986 12.186 1.00 39.73 C
+ATOM 1147 O TYR B 35 -9.522 31.085 12.482 1.00 39.22 O
+ATOM 1148 CB TYR B 35 -6.621 31.202 13.223 1.00 35.94 C
+ATOM 1149 CG TYR B 35 -5.952 30.839 11.913 1.00 34.45 C
+ATOM 1150 CD1 TYR B 35 -4.775 31.469 11.509 1.00 33.64 C
+ATOM 1151 CD2 TYR B 35 -6.480 29.843 11.092 1.00 32.99 C
+ATOM 1152 CE1 TYR B 35 -4.134 31.109 10.320 1.00 31.55 C
+ATOM 1153 CE2 TYR B 35 -5.850 29.478 9.898 1.00 31.39 C
+ATOM 1154 CZ TYR B 35 -4.678 30.112 9.522 1.00 30.70 C
+ATOM 1155 OH TYR B 35 -4.040 29.738 8.359 1.00 28.82 O
+ATOM 1156 N GLY B 36 -8.824 32.675 11.053 1.00 42.84 N
+ATOM 1157 CA GLY B 36 -9.856 32.374 10.075 1.00 47.34 C
+ATOM 1158 C GLY B 36 -11.253 32.851 10.418 1.00 49.95 C
+ATOM 1159 O GLY B 36 -12.210 32.517 9.716 1.00 50.37 O
+ATOM 1160 N VAL B 37 -11.382 33.624 11.491 1.00 51.86 N
+ATOM 1161 CA VAL B 37 -12.685 34.137 11.893 1.00 54.42 C
+ATOM 1162 C VAL B 37 -13.089 35.286 10.981 1.00 56.54 C
+ATOM 1163 O VAL B 37 -12.619 36.415 11.136 1.00 57.40 O
+ATOM 1164 CB VAL B 37 -12.674 34.636 13.357 1.00 54.35 C
+ATOM 1165 CG1 VAL B 37 -13.983 35.341 13.678 1.00 54.35 C
+ATOM 1166 CG2 VAL B 37 -12.474 33.463 14.300 1.00 54.03 C
+ATOM 1167 N LYS B 38 -13.957 34.986 10.021 1.00 59.00 N
+ATOM 1168 CA LYS B 38 -14.436 35.989 9.080 1.00 60.75 C
+ATOM 1169 C LYS B 38 -15.195 37.055 9.860 1.00 60.65 C
+ATOM 1170 O LYS B 38 -15.584 36.829 11.006 1.00 61.37 O
+ATOM 1171 CB LYS B 38 -15.349 35.333 8.042 1.00 62.21 C
+ATOM 1172 CG LYS B 38 -14.680 34.190 7.293 1.00 63.77 C
+ATOM 1173 CD LYS B 38 -15.647 33.477 6.366 1.00 65.45 C
+ATOM 1174 CE LYS B 38 -14.986 32.270 5.712 1.00 65.80 C
+ATOM 1175 NZ LYS B 38 -15.922 31.536 4.814 1.00 66.45 N1+
+ATOM 1176 N ASP B 39 -15.402 38.211 9.239 1.00 60.48 N
+ATOM 1177 CA ASP B 39 -16.099 39.310 9.896 1.00 60.15 C
+ATOM 1178 C ASP B 39 -15.190 39.849 10.996 1.00 58.84 C
+ATOM 1179 O ASP B 39 -15.610 40.050 12.138 1.00 59.08 O
+ATOM 1180 CB ASP B 39 -17.430 38.822 10.483 1.00 62.00 C
+ATOM 1181 CG ASP B 39 -18.176 39.911 11.232 1.00 64.25 C
+ATOM 1182 OD1 ASP B 39 -18.394 40.997 10.650 1.00 65.75 O
+ATOM 1183 OD2 ASP B 39 -18.549 39.678 12.403 1.00 65.41 O1-
+ATOM 1184 N LEU B 40 -13.931 40.069 10.634 1.00 56.60 N
+ATOM 1185 CA LEU B 40 -12.930 40.588 11.556 1.00 54.17 C
+ATOM 1186 C LEU B 40 -12.173 41.725 10.882 1.00 51.97 C
+ATOM 1187 O LEU B 40 -11.621 41.557 9.796 1.00 53.24 O
+ATOM 1188 CB LEU B 40 -11.956 39.476 11.961 1.00 55.42 C
+ATOM 1189 CG LEU B 40 -10.756 39.861 12.834 1.00 56.96 C
+ATOM 1190 CD1 LEU B 40 -11.224 40.525 14.124 1.00 56.83 C
+ATOM 1191 CD2 LEU B 40 -9.944 38.612 13.139 1.00 57.75 C
+ATOM 1192 N SER B 41 -12.157 42.883 11.528 1.00 48.88 N
+ATOM 1193 CA SER B 41 -11.475 44.052 10.994 1.00 46.64 C
+ATOM 1194 C SER B 41 -10.026 43.746 10.628 1.00 45.05 C
+ATOM 1195 O SER B 41 -9.295 43.131 11.404 1.00 45.73 O
+ATOM 1196 CB SER B 41 -11.511 45.188 12.019 1.00 47.05 C
+ATOM 1197 OG SER B 41 -10.792 46.318 11.557 1.00 48.87 O
+ATOM 1198 N PRO B 42 -9.595 44.164 9.429 1.00 42.73 N
+ATOM 1199 CA PRO B 42 -8.218 43.919 8.997 1.00 40.61 C
+ATOM 1200 C PRO B 42 -7.240 44.633 9.927 1.00 38.99 C
+ATOM 1201 O PRO B 42 -6.139 44.149 10.184 1.00 35.84 O
+ATOM 1202 CB PRO B 42 -8.196 44.493 7.583 1.00 41.99 C
+ATOM 1203 CG PRO B 42 -9.599 44.258 7.112 1.00 41.98 C
+ATOM 1204 CD PRO B 42 -10.403 44.692 8.316 1.00 42.93 C
+ATOM 1205 N ASN B 43 -7.660 45.791 10.424 1.00 36.86 N
+ATOM 1206 CA ASN B 43 -6.845 46.589 11.328 1.00 36.32 C
+ATOM 1207 C ASN B 43 -6.566 45.789 12.602 1.00 35.90 C
+ATOM 1208 O ASN B 43 -5.441 45.762 13.106 1.00 33.52 O
+ATOM 1209 CB ASN B 43 -7.582 47.884 11.674 1.00 38.99 C
+ATOM 1210 CG ASN B 43 -6.693 48.897 12.356 1.00 41.14 C
+ATOM 1211 ND2 ASN B 43 -7.058 49.283 13.575 1.00 42.88 N
ATOM 1212 OD1 ASN B 43 -5.689 49.333 11.793 1.00 43.99 O
-ATOM 1213 ND2 ASN B 43 -7.058 49.283 13.575 1.00 42.88 N
-ATOM 1214 N ILE B 44 -7.602 45.138 13.115 1.00 30.99 N
-ATOM 1215 CA ILE B 44 -7.482 44.332 14.322 1.00 30.55 C
-ATOM 1216 C ILE B 44 -6.722 43.044 14.013 1.00 29.45 C
-ATOM 1217 O ILE B 44 -5.889 42.598 14.802 1.00 28.47 O
-ATOM 1218 CB ILE B 44 -8.877 43.994 14.888 1.00 30.44 C
-ATOM 1219 CG1 ILE B 44 -9.590 45.291 15.280 1.00 31.74 C
-ATOM 1220 CG2 ILE B 44 -8.752 43.069 16.089 1.00 30.69 C
-ATOM 1221 CD1 ILE B 44 -11.023 45.097 15.716 1.00 32.75 C
-ATOM 1222 N LEU B 45 -7.010 42.456 12.858 1.00 28.17 N
-ATOM 1223 CA LEU B 45 -6.346 41.229 12.443 1.00 27.76 C
-ATOM 1224 C LEU B 45 -4.840 41.422 12.353 1.00 27.01 C
-ATOM 1225 O LEU B 45 -4.074 40.697 12.985 1.00 27.61 O
-ATOM 1226 CB LEU B 45 -6.863 40.770 11.081 1.00 29.78 C
-ATOM 1227 CG LEU B 45 -6.090 39.594 10.473 1.00 31.60 C
-ATOM 1228 CD1 LEU B 45 -6.175 38.388 11.398 1.00 30.95 C
-ATOM 1229 CD2 LEU B 45 -6.658 39.260 9.103 1.00 33.74 C
-ATOM 1230 N ASN B 46 -4.416 42.406 11.566 1.00 23.88 N
-ATOM 1231 CA ASN B 46 -2.995 42.659 11.392 1.00 24.71 C
-ATOM 1232 C ASN B 46 -2.308 43.140 12.665 1.00 24.42 C
-ATOM 1233 O ASN B 46 -1.131 42.856 12.880 1.00 21.98 O
-ATOM 1234 CB ASN B 46 -2.770 43.647 10.247 1.00 24.87 C
-ATOM 1235 CG ASN B 46 -3.100 43.040 8.895 1.00 28.97 C
+ATOM 1213 N ILE B 44 -7.602 45.138 13.115 1.00 30.99 N
+ATOM 1214 CA ILE B 44 -7.482 44.332 14.322 1.00 30.55 C
+ATOM 1215 C ILE B 44 -6.722 43.044 14.013 1.00 29.45 C
+ATOM 1216 O ILE B 44 -5.889 42.598 14.802 1.00 28.47 O
+ATOM 1217 CB ILE B 44 -8.877 43.994 14.888 1.00 30.44 C
+ATOM 1218 CG1 ILE B 44 -9.590 45.291 15.280 1.00 31.74 C
+ATOM 1219 CG2 ILE B 44 -8.752 43.069 16.089 1.00 30.69 C
+ATOM 1220 CD1 ILE B 44 -11.023 45.097 15.716 1.00 32.75 C
+ATOM 1221 N LEU B 45 -7.010 42.456 12.858 1.00 28.17 N
+ATOM 1222 CA LEU B 45 -6.346 41.229 12.443 1.00 27.76 C
+ATOM 1223 C LEU B 45 -4.840 41.422 12.353 1.00 27.01 C
+ATOM 1224 O LEU B 45 -4.074 40.697 12.985 1.00 27.61 O
+ATOM 1225 CB LEU B 45 -6.863 40.770 11.081 1.00 29.78 C
+ATOM 1226 CG LEU B 45 -6.090 39.594 10.473 1.00 31.60 C
+ATOM 1227 CD1 LEU B 45 -6.175 38.388 11.398 1.00 30.95 C
+ATOM 1228 CD2 LEU B 45 -6.658 39.260 9.103 1.00 33.74 C
+ATOM 1229 N ASN B 46 -4.416 42.406 11.566 1.00 23.88 N
+ATOM 1230 CA ASN B 46 -2.995 42.659 11.392 1.00 24.71 C
+ATOM 1231 C ASN B 46 -2.308 43.140 12.665 1.00 24.42 C
+ATOM 1232 O ASN B 46 -1.131 42.856 12.880 1.00 21.98 O
+ATOM 1233 CB ASN B 46 -2.770 43.647 10.247 1.00 24.87 C
+ATOM 1234 CG ASN B 46 -3.100 43.040 8.895 1.00 28.97 C
+ATOM 1235 ND2 ASN B 46 -3.967 43.705 8.138 1.00 26.80 N
ATOM 1236 OD1 ASN B 46 -2.581 41.978 8.536 1.00 29.11 O
-ATOM 1237 ND2 ASN B 46 -3.967 43.705 8.138 1.00 26.80 N
-ATOM 1238 N CYS B 47 -3.035 43.860 13.512 1.00 23.64 N
-ATOM 1239 CA CYS B 47 -2.444 44.318 14.758 1.00 23.25 C
-ATOM 1240 C CYS B 47 -2.061 43.084 15.569 1.00 21.28 C
-ATOM 1241 O CYS B 47 -0.977 43.020 16.148 1.00 20.94 O
-ATOM 1242 CB CYS B 47 -3.430 45.173 15.553 1.00 22.79 C
-ATOM 1243 SG CYS B 47 -2.708 45.827 17.078 1.00 25.91 S
-ATOM 1244 N GLY B 48 -2.958 42.103 15.599 1.00 20.00 N
-ATOM 1245 CA GLY B 48 -2.689 40.879 16.331 1.00 19.88 C
-ATOM 1246 C GLY B 48 -1.480 40.128 15.793 1.00 21.99 C
-ATOM 1247 O GLY B 48 -0.669 39.616 16.568 1.00 21.66 O
-ATOM 1248 N GLU B 49 -1.360 40.050 14.468 1.00 21.68 N
-ATOM 1249 CA GLU B 49 -0.239 39.351 13.849 1.00 21.98 C
-ATOM 1250 C GLU B 49 1.075 40.000 14.256 1.00 22.51 C
-ATOM 1251 O GLU B 49 2.064 39.315 14.522 1.00 20.65 O
-ATOM 1252 CB GLU B 49 -0.371 39.360 12.322 1.00 22.74 C
-ATOM 1253 CG GLU B 49 -1.464 38.440 11.795 1.00 24.48 C
-ATOM 1254 CD GLU B 49 -1.188 36.972 12.097 1.00 26.62 C
-ATOM 1255 OE1 GLU B 49 -0.245 36.407 11.502 1.00 26.25 O
-ATOM 1256 OE2 GLU B 49 -1.910 36.385 12.933 1.00 24.20 O
-ATOM 1257 N GLU B 50 1.095 41.327 14.304 1.00 22.56 N
-ATOM 1258 CA GLU B 50 2.311 42.014 14.701 1.00 21.70 C
-ATOM 1259 C GLU B 50 2.590 41.797 16.189 1.00 20.95 C
-ATOM 1260 O GLU B 50 3.746 41.693 16.594 1.00 20.45 O
-ATOM 1261 CB GLU B 50 2.222 43.501 14.343 1.00 23.31 C
-ATOM 1262 CG GLU B 50 2.431 43.723 12.845 1.00 26.36 C
-ATOM 1263 CD GLU B 50 2.561 45.184 12.450 1.00 28.71 C
-ATOM 1264 OE1 GLU B 50 3.160 45.967 13.217 1.00 29.84 O
-ATOM 1265 OE2 GLU B 50 2.079 45.540 11.354 1.00 30.02 O
-ATOM 1266 N LEU B 51 1.538 41.713 17.002 1.00 19.36 N
-ATOM 1267 CA LEU B 51 1.728 41.465 18.428 1.00 19.49 C
-ATOM 1268 C LEU B 51 2.299 40.046 18.564 1.00 19.99 C
-ATOM 1269 O LEU B 51 3.218 39.801 19.343 1.00 20.50 O
-ATOM 1270 CB LEU B 51 0.394 41.571 19.183 1.00 18.74 C
-ATOM 1271 CG LEU B 51 -0.266 42.953 19.295 1.00 17.71 C
-ATOM 1272 CD1 LEU B 51 -1.611 42.821 19.983 1.00 18.56 C
-ATOM 1273 CD2 LEU B 51 0.636 43.904 20.072 1.00 18.30 C
-ATOM 1274 N PHE B 52 1.750 39.123 17.780 1.00 20.48 N
-ATOM 1275 CA PHE B 52 2.183 37.727 17.772 1.00 20.12 C
-ATOM 1276 C PHE B 52 3.675 37.621 17.426 1.00 21.51 C
-ATOM 1277 O PHE B 52 4.426 36.890 18.075 1.00 20.51 O
-ATOM 1278 CB PHE B 52 1.350 36.951 16.747 1.00 19.20 C
-ATOM 1279 CG PHE B 52 1.781 35.522 16.554 1.00 19.61 C
-ATOM 1280 CD1 PHE B 52 1.464 34.548 17.494 1.00 18.03 C
-ATOM 1281 CD2 PHE B 52 2.479 35.145 15.408 1.00 19.55 C
-ATOM 1282 CE1 PHE B 52 1.832 33.214 17.294 1.00 17.84 C
-ATOM 1283 CE2 PHE B 52 2.851 33.816 15.200 1.00 21.13 C
-ATOM 1284 CZ PHE B 52 2.525 32.850 16.145 1.00 18.78 C
-ATOM 1285 N MET B 53 4.105 38.352 16.402 1.00 22.14 N
-ATOM 1286 CA MET B 53 5.507 38.316 16.004 1.00 21.95 C
-ATOM 1287 C MET B 53 6.405 39.019 17.018 1.00 21.27 C
-ATOM 1288 O MET B 53 7.550 38.623 17.214 1.00 19.91 O
-ATOM 1289 CB MET B 53 5.686 38.937 14.614 1.00 21.63 C
-ATOM 1290 CG MET B 53 5.076 38.107 13.491 1.00 25.68 C
-ATOM 1291 SD MET B 53 5.618 36.364 13.515 1.00 30.63 S
-ATOM 1292 CE MET B 53 7.356 36.536 13.139 1.00 28.12 C
-ATOM 1293 N ALA B 54 5.893 40.063 17.663 1.00 21.75 N
-ATOM 1294 CA ALA B 54 6.686 40.772 18.665 1.00 20.65 C
-ATOM 1295 C ALA B 54 6.953 39.793 19.802 1.00 19.22 C
-ATOM 1296 O ALA B 54 8.071 39.699 20.312 1.00 16.64 O
-ATOM 1297 CB ALA B 54 5.926 41.986 19.187 1.00 20.00 C
-ATOM 1298 N ALA B 55 5.919 39.054 20.192 1.00 17.82 N
-ATOM 1299 CA ALA B 55 6.062 38.082 21.271 1.00 19.46 C
-ATOM 1300 C ALA B 55 7.054 36.979 20.900 1.00 17.61 C
-ATOM 1301 O ALA B 55 7.802 36.514 21.747 1.00 18.83 O
-ATOM 1302 CB ALA B 55 4.705 37.475 21.623 1.00 17.30 C
-ATOM 1303 N GLU B 56 7.068 36.572 19.634 1.00 19.75 N
-ATOM 1304 CA GLU B 56 7.980 35.518 19.183 1.00 20.56 C
-ATOM 1305 C GLU B 56 9.450 35.900 19.398 1.00 22.50 C
-ATOM 1306 O GLU B 56 10.298 35.033 19.612 1.00 22.91 O
-ATOM 1307 CB GLU B 56 7.736 35.218 17.701 1.00 21.64 C
-ATOM 1308 CG GLU B 56 8.529 34.037 17.131 1.00 22.16 C
-ATOM 1309 CD GLU B 56 8.238 32.727 17.844 1.00 23.10 C
-ATOM 1310 OE1 GLU B 56 7.150 32.601 18.443 1.00 21.73 O
-ATOM 1311 OE2 GLU B 56 9.094 31.817 17.795 1.00 23.54 O
-ATOM 1312 N ARG B 57 9.744 37.197 19.342 1.00 22.35 N
-ATOM 1313 CA ARG B 57 11.110 37.690 19.527 1.00 21.99 C
-ATOM 1314 C ARG B 57 11.506 37.843 20.997 1.00 21.83 C
-ATOM 1315 O ARG B 57 12.658 38.162 21.306 1.00 21.33 O
-ATOM 1316 CB ARG B 57 11.285 39.045 18.826 1.00 23.44 C
-ATOM 1317 CG ARG B 57 11.195 38.993 17.308 1.00 25.38 C
-ATOM 1318 CD ARG B 57 11.561 40.338 16.695 1.00 25.98 C
-ATOM 1319 NE ARG B 57 10.482 41.322 16.761 1.00 24.88 N
-ATOM 1320 CZ ARG B 57 9.457 41.362 15.916 1.00 25.60 C
-ATOM 1321 NH1 ARG B 57 9.368 40.472 14.940 1.00 26.04 N
-ATOM 1322 NH2 ARG B 57 8.527 42.302 16.032 1.00 26.46 N
-ATOM 1323 N PHE B 58 10.556 37.627 21.901 1.00 21.08 N
-ATOM 1324 CA PHE B 58 10.828 37.757 23.331 1.00 21.89 C
-ATOM 1325 C PHE B 58 11.514 36.525 23.915 1.00 21.70 C
-ATOM 1326 O PHE B 58 11.131 35.394 23.626 1.00 21.83 O
-ATOM 1327 CB PHE B 58 9.522 38.025 24.099 1.00 21.90 C
-ATOM 1328 CG PHE B 58 9.633 37.799 25.585 1.00 21.52 C
-ATOM 1329 CD1 PHE B 58 10.504 38.561 26.357 1.00 22.01 C
-ATOM 1330 CD2 PHE B 58 8.889 36.797 26.206 1.00 23.33 C
-ATOM 1331 CE1 PHE B 58 10.641 38.330 27.729 1.00 23.00 C
-ATOM 1332 CE2 PHE B 58 9.015 36.555 27.578 1.00 23.53 C
-ATOM 1333 CZ PHE B 58 9.895 37.323 28.341 1.00 22.74 C
-ATOM 1334 N GLU B 59 12.537 36.757 24.729 1.00 21.11 N
-ATOM 1335 CA GLU B 59 13.276 35.680 25.388 1.00 22.91 C
-ATOM 1336 C GLU B 59 13.744 36.182 26.754 1.00 23.33 C
-ATOM 1337 O GLU B 59 14.570 37.090 26.843 1.00 24.96 O
-ATOM 1338 CB GLU B 59 14.485 35.252 24.543 1.00 21.52 C
-ATOM 1339 CG GLU B 59 15.447 34.307 25.263 1.00 21.47 C
-ATOM 1340 CD GLU B 59 14.760 33.055 25.787 1.00 21.63 C
-ATOM 1341 OE1 GLU B 59 14.243 32.270 24.963 1.00 22.04 O
-ATOM 1342 OE2 GLU B 59 14.736 32.861 27.021 1.00 19.42 O
-ATOM 1343 N PRO B 60 13.221 35.592 27.838 1.00 22.84 N
-ATOM 1344 CA PRO B 60 13.602 36.006 29.191 1.00 24.55 C
-ATOM 1345 C PRO B 60 15.051 35.751 29.607 1.00 25.49 C
-ATOM 1346 O PRO B 60 15.571 36.455 30.471 1.00 25.24 O
-ATOM 1347 CB PRO B 60 12.611 35.248 30.074 1.00 23.89 C
-ATOM 1348 CG PRO B 60 12.365 33.990 29.290 1.00 25.19 C
-ATOM 1349 CD PRO B 60 12.194 34.538 27.882 1.00 21.85 C
-ATOM 1350 N ASP B 61 15.703 34.757 29.011 1.00 26.14 N
-ATOM 1351 CA ASP B 61 17.084 34.458 29.384 1.00 27.53 C
-ATOM 1352 C ASP B 61 18.058 35.567 28.988 1.00 27.88 C
-ATOM 1353 O ASP B 61 17.965 36.136 27.903 1.00 24.27 O
-ATOM 1354 CB ASP B 61 17.541 33.128 28.769 1.00 30.41 C
-ATOM 1355 CG ASP B 61 16.762 31.934 29.305 1.00 33.81 C
-ATOM 1356 OD1 ASP B 61 16.271 32.011 30.453 1.00 34.09 O
-ATOM 1357 OD2 ASP B 61 16.650 30.915 28.585 1.00 35.12 O
-ATOM 1358 N ALA B 62 18.996 35.866 29.882 1.00 29.03 N
-ATOM 1359 CA ALA B 62 19.987 36.909 29.638 1.00 29.79 C
-ATOM 1360 C ALA B 62 20.890 36.581 28.453 1.00 29.36 C
-ATOM 1361 O ALA B 62 21.496 37.472 27.864 1.00 29.67 O
-ATOM 1362 CB ALA B 62 20.833 37.126 30.889 1.00 29.00 C
-ATOM 1363 N ASP B 63 20.978 35.302 28.104 1.00 30.36 N
-ATOM 1364 CA ASP B 63 21.822 34.886 26.993 1.00 30.26 C
-ATOM 1365 C ASP B 63 21.052 34.827 25.672 1.00 28.18 C
-ATOM 1366 O ASP B 63 21.470 34.155 24.735 1.00 27.63 O
-ATOM 1367 CB ASP B 63 22.451 33.521 27.298 1.00 34.65 C
-ATOM 1368 CG ASP B 63 21.433 32.392 27.308 1.00 38.98 C
-ATOM 1369 OD1 ASP B 63 20.218 32.678 27.339 1.00 40.55 O
-ATOM 1370 OD2 ASP B 63 21.850 31.213 27.292 1.00 42.42 O
-ATOM 1371 N ARG B 64 19.932 35.541 25.600 1.00 25.12 N
-ATOM 1372 CA ARG B 64 19.112 35.566 24.389 1.00 22.93 C
-ATOM 1373 C ARG B 64 19.941 35.977 23.176 1.00 22.66 C
-ATOM 1374 O ARG B 64 21.007 36.569 23.324 1.00 23.13 O
-ATOM 1375 CB ARG B 64 17.958 36.557 24.559 1.00 21.73 C
-ATOM 1376 CG ARG B 64 18.406 38.018 24.648 1.00 21.88 C
-ATOM 1377 CD ARG B 64 17.224 38.947 24.883 1.00 19.75 C
-ATOM 1378 NE ARG B 64 16.599 38.722 26.187 1.00 23.87 N
-ATOM 1379 CZ ARG B 64 17.101 39.132 27.348 1.00 23.81 C
-ATOM 1380 NH1 ARG B 64 18.249 39.801 27.388 1.00 24.38 N
-ATOM 1381 NH2 ARG B 64 16.455 38.868 28.474 1.00 23.82 N
-ATOM 1382 N ALA B 65 19.446 35.666 21.980 1.00 22.22 N
-ATOM 1383 CA ALA B 65 20.142 36.027 20.747 1.00 21.67 C
-ATOM 1384 C ALA B 65 20.131 37.553 20.626 1.00 21.95 C
-ATOM 1385 O ALA B 65 19.276 38.222 21.210 1.00 20.51 O
-ATOM 1386 CB ALA B 65 19.444 35.394 19.541 1.00 20.77 C
-ATOM 1387 N ASN B 66 21.066 38.106 19.860 1.00 22.40 N
-ATOM 1388 CA ASN B 66 21.139 39.554 19.728 1.00 21.03 C
-ATOM 1389 C ASN B 66 19.878 40.171 19.118 1.00 20.53 C
-ATOM 1390 O ASN B 66 19.569 41.331 19.382 1.00 20.76 O
-ATOM 1391 CB ASN B 66 22.394 39.948 18.935 1.00 22.07 C
-ATOM 1392 CG ASN B 66 22.318 39.568 17.467 1.00 25.16 C
+ATOM 1237 N CYS B 47 -3.035 43.860 13.512 1.00 23.64 N
+ATOM 1238 CA CYS B 47 -2.444 44.318 14.758 1.00 23.25 C
+ATOM 1239 C CYS B 47 -2.061 43.084 15.569 1.00 21.28 C
+ATOM 1240 O CYS B 47 -0.977 43.020 16.148 1.00 20.94 O
+ATOM 1241 CB CYS B 47 -3.430 45.173 15.553 1.00 22.79 C
+ATOM 1242 SG CYS B 47 -2.708 45.827 17.078 1.00 25.91 S
+ATOM 1243 N GLY B 48 -2.958 42.103 15.599 1.00 20.00 N
+ATOM 1244 CA GLY B 48 -2.689 40.879 16.331 1.00 19.88 C
+ATOM 1245 C GLY B 48 -1.480 40.128 15.793 1.00 21.99 C
+ATOM 1246 O GLY B 48 -0.669 39.616 16.568 1.00 21.66 O
+ATOM 1247 N GLU B 49 -1.360 40.050 14.468 1.00 21.68 N
+ATOM 1248 CA GLU B 49 -0.239 39.351 13.849 1.00 21.98 C
+ATOM 1249 C GLU B 49 1.075 40.000 14.256 1.00 22.51 C
+ATOM 1250 O GLU B 49 2.064 39.315 14.522 1.00 20.65 O
+ATOM 1251 CB GLU B 49 -0.371 39.360 12.322 1.00 22.74 C
+ATOM 1252 CG GLU B 49 -1.464 38.440 11.795 1.00 24.48 C
+ATOM 1253 CD GLU B 49 -1.188 36.972 12.097 1.00 26.62 C
+ATOM 1254 OE1 GLU B 49 -0.245 36.407 11.502 1.00 26.25 O
+ATOM 1255 OE2 GLU B 49 -1.910 36.385 12.933 1.00 24.20 O1-
+ATOM 1256 N GLU B 50 1.095 41.327 14.304 1.00 22.56 N
+ATOM 1257 CA GLU B 50 2.311 42.014 14.701 1.00 21.70 C
+ATOM 1258 C GLU B 50 2.590 41.797 16.189 1.00 20.95 C
+ATOM 1259 O GLU B 50 3.746 41.693 16.594 1.00 20.45 O
+ATOM 1260 CB GLU B 50 2.222 43.501 14.343 1.00 23.31 C
+ATOM 1261 CG GLU B 50 2.431 43.723 12.845 1.00 26.36 C
+ATOM 1262 CD GLU B 50 2.561 45.184 12.450 1.00 28.71 C
+ATOM 1263 OE1 GLU B 50 3.160 45.967 13.217 1.00 29.84 O
+ATOM 1264 OE2 GLU B 50 2.079 45.540 11.354 1.00 30.02 O1-
+ATOM 1265 N LEU B 51 1.538 41.713 17.002 1.00 19.36 N
+ATOM 1266 CA LEU B 51 1.728 41.465 18.428 1.00 19.49 C
+ATOM 1267 C LEU B 51 2.299 40.046 18.564 1.00 19.99 C
+ATOM 1268 O LEU B 51 3.218 39.801 19.343 1.00 20.50 O
+ATOM 1269 CB LEU B 51 0.394 41.571 19.183 1.00 18.74 C
+ATOM 1270 CG LEU B 51 -0.266 42.953 19.295 1.00 17.71 C
+ATOM 1271 CD1 LEU B 51 -1.611 42.821 19.983 1.00 18.56 C
+ATOM 1272 CD2 LEU B 51 0.636 43.904 20.072 1.00 18.30 C
+ATOM 1273 N PHE B 52 1.750 39.123 17.780 1.00 20.48 N
+ATOM 1274 CA PHE B 52 2.183 37.727 17.772 1.00 20.12 C
+ATOM 1275 C PHE B 52 3.675 37.621 17.426 1.00 21.51 C
+ATOM 1276 O PHE B 52 4.426 36.890 18.075 1.00 20.51 O
+ATOM 1277 CB PHE B 52 1.350 36.951 16.747 1.00 19.20 C
+ATOM 1278 CG PHE B 52 1.781 35.522 16.554 1.00 19.61 C
+ATOM 1279 CD1 PHE B 52 1.464 34.548 17.494 1.00 18.03 C
+ATOM 1280 CD2 PHE B 52 2.479 35.145 15.408 1.00 19.55 C
+ATOM 1281 CE1 PHE B 52 1.832 33.214 17.294 1.00 17.84 C
+ATOM 1282 CE2 PHE B 52 2.851 33.816 15.200 1.00 21.13 C
+ATOM 1283 CZ PHE B 52 2.525 32.850 16.145 1.00 18.78 C
+ATOM 1284 N MET B 53 4.105 38.352 16.402 1.00 22.14 N
+ATOM 1285 CA MET B 53 5.507 38.316 16.004 1.00 21.95 C
+ATOM 1286 C MET B 53 6.405 39.019 17.018 1.00 21.27 C
+ATOM 1287 O MET B 53 7.550 38.623 17.214 1.00 19.91 O
+ATOM 1288 CB MET B 53 5.686 38.937 14.614 1.00 21.63 C
+ATOM 1289 CG MET B 53 5.076 38.107 13.491 1.00 25.68 C
+ATOM 1290 SD MET B 53 5.618 36.364 13.515 1.00 30.63 S
+ATOM 1291 CE MET B 53 7.356 36.536 13.139 1.00 28.12 C
+ATOM 1292 N ALA B 54 5.893 40.063 17.663 1.00 21.75 N
+ATOM 1293 CA ALA B 54 6.686 40.772 18.665 1.00 20.65 C
+ATOM 1294 C ALA B 54 6.953 39.793 19.802 1.00 19.22 C
+ATOM 1295 O ALA B 54 8.071 39.699 20.312 1.00 16.64 O
+ATOM 1296 CB ALA B 54 5.926 41.986 19.187 1.00 20.00 C
+ATOM 1297 N ALA B 55 5.919 39.054 20.192 1.00 17.82 N
+ATOM 1298 CA ALA B 55 6.062 38.082 21.271 1.00 19.46 C
+ATOM 1299 C ALA B 55 7.054 36.979 20.900 1.00 17.61 C
+ATOM 1300 O ALA B 55 7.802 36.514 21.747 1.00 18.83 O
+ATOM 1301 CB ALA B 55 4.705 37.475 21.623 1.00 17.30 C
+ATOM 1302 N GLU B 56 7.068 36.572 19.634 1.00 19.75 N
+ATOM 1303 CA GLU B 56 7.980 35.518 19.183 1.00 20.56 C
+ATOM 1304 C GLU B 56 9.450 35.900 19.398 1.00 22.50 C
+ATOM 1305 O GLU B 56 10.298 35.033 19.612 1.00 22.91 O
+ATOM 1306 CB GLU B 56 7.736 35.218 17.701 1.00 21.64 C
+ATOM 1307 CG GLU B 56 8.529 34.037 17.131 1.00 22.16 C
+ATOM 1308 CD GLU B 56 8.238 32.727 17.844 1.00 23.10 C
+ATOM 1309 OE1 GLU B 56 7.150 32.601 18.443 1.00 21.73 O
+ATOM 1310 OE2 GLU B 56 9.094 31.817 17.795 1.00 23.54 O1-
+ATOM 1311 N ARG B 57 9.744 37.197 19.342 1.00 22.35 N
+ATOM 1312 CA ARG B 57 11.110 37.690 19.527 1.00 21.99 C
+ATOM 1313 C ARG B 57 11.506 37.843 20.997 1.00 21.83 C
+ATOM 1314 O ARG B 57 12.658 38.162 21.306 1.00 21.33 O
+ATOM 1315 CB ARG B 57 11.285 39.045 18.826 1.00 23.44 C
+ATOM 1316 CG ARG B 57 11.195 38.993 17.308 1.00 25.38 C
+ATOM 1317 CD ARG B 57 11.561 40.338 16.695 1.00 25.98 C
+ATOM 1318 NE ARG B 57 10.482 41.322 16.761 1.00 24.88 N
+ATOM 1319 CZ ARG B 57 9.457 41.362 15.916 1.00 25.60 C
+ATOM 1320 NH1 ARG B 57 9.368 40.472 14.940 1.00 26.04 N1+
+ATOM 1321 NH2 ARG B 57 8.527 42.302 16.032 1.00 26.46 N
+ATOM 1322 N PHE B 58 10.556 37.627 21.901 1.00 21.08 N
+ATOM 1323 CA PHE B 58 10.828 37.757 23.331 1.00 21.89 C
+ATOM 1324 C PHE B 58 11.514 36.525 23.915 1.00 21.70 C
+ATOM 1325 O PHE B 58 11.131 35.394 23.626 1.00 21.83 O
+ATOM 1326 CB PHE B 58 9.522 38.025 24.099 1.00 21.90 C
+ATOM 1327 CG PHE B 58 9.633 37.799 25.585 1.00 21.52 C
+ATOM 1328 CD1 PHE B 58 10.504 38.561 26.357 1.00 22.01 C
+ATOM 1329 CD2 PHE B 58 8.889 36.797 26.206 1.00 23.33 C
+ATOM 1330 CE1 PHE B 58 10.641 38.330 27.729 1.00 23.00 C
+ATOM 1331 CE2 PHE B 58 9.015 36.555 27.578 1.00 23.53 C
+ATOM 1332 CZ PHE B 58 9.895 37.323 28.341 1.00 22.74 C
+ATOM 1333 N GLU B 59 12.537 36.757 24.729 1.00 21.11 N
+ATOM 1334 CA GLU B 59 13.276 35.680 25.388 1.00 22.91 C
+ATOM 1335 C GLU B 59 13.744 36.182 26.754 1.00 23.33 C
+ATOM 1336 O GLU B 59 14.570 37.090 26.843 1.00 24.96 O
+ATOM 1337 CB GLU B 59 14.485 35.252 24.543 1.00 21.52 C
+ATOM 1338 CG GLU B 59 15.447 34.307 25.263 1.00 21.47 C
+ATOM 1339 CD GLU B 59 14.760 33.055 25.787 1.00 21.63 C
+ATOM 1340 OE1 GLU B 59 14.243 32.270 24.963 1.00 22.04 O
+ATOM 1341 OE2 GLU B 59 14.736 32.861 27.021 1.00 19.42 O1-
+ATOM 1342 N PRO B 60 13.221 35.592 27.838 1.00 22.84 N
+ATOM 1343 CA PRO B 60 13.602 36.006 29.191 1.00 24.55 C
+ATOM 1344 C PRO B 60 15.051 35.751 29.607 1.00 25.49 C
+ATOM 1345 O PRO B 60 15.571 36.455 30.471 1.00 25.24 O
+ATOM 1346 CB PRO B 60 12.611 35.248 30.074 1.00 23.89 C
+ATOM 1347 CG PRO B 60 12.365 33.990 29.290 1.00 25.19 C
+ATOM 1348 CD PRO B 60 12.194 34.538 27.882 1.00 21.85 C
+ATOM 1349 N ASP B 61 15.703 34.757 29.011 1.00 26.14 N
+ATOM 1350 CA ASP B 61 17.084 34.458 29.384 1.00 27.53 C
+ATOM 1351 C ASP B 61 18.058 35.567 28.988 1.00 27.88 C
+ATOM 1352 O ASP B 61 17.965 36.136 27.903 1.00 24.27 O
+ATOM 1353 CB ASP B 61 17.541 33.128 28.769 1.00 30.41 C
+ATOM 1354 CG ASP B 61 16.762 31.934 29.305 1.00 33.81 C
+ATOM 1355 OD1 ASP B 61 16.271 32.011 30.453 1.00 34.09 O
+ATOM 1356 OD2 ASP B 61 16.650 30.915 28.585 1.00 35.12 O1-
+ATOM 1357 N ALA B 62 18.996 35.866 29.882 1.00 29.03 N
+ATOM 1358 CA ALA B 62 19.987 36.909 29.638 1.00 29.79 C
+ATOM 1359 C ALA B 62 20.890 36.581 28.453 1.00 29.36 C
+ATOM 1360 O ALA B 62 21.496 37.472 27.864 1.00 29.67 O
+ATOM 1361 CB ALA B 62 20.833 37.126 30.889 1.00 29.00 C
+ATOM 1362 N ASP B 63 20.978 35.302 28.104 1.00 30.36 N
+ATOM 1363 CA ASP B 63 21.822 34.886 26.993 1.00 30.26 C
+ATOM 1364 C ASP B 63 21.052 34.827 25.672 1.00 28.18 C
+ATOM 1365 O ASP B 63 21.470 34.155 24.735 1.00 27.63 O
+ATOM 1366 CB ASP B 63 22.451 33.521 27.298 1.00 34.65 C
+ATOM 1367 CG ASP B 63 21.433 32.392 27.308 1.00 38.98 C
+ATOM 1368 OD1 ASP B 63 20.218 32.678 27.339 1.00 40.55 O
+ATOM 1369 OD2 ASP B 63 21.850 31.213 27.292 1.00 42.42 O1-
+ATOM 1370 N ARG B 64 19.932 35.541 25.600 1.00 25.12 N
+ATOM 1371 CA ARG B 64 19.112 35.566 24.389 1.00 22.93 C
+ATOM 1372 C ARG B 64 19.941 35.977 23.176 1.00 22.66 C
+ATOM 1373 O ARG B 64 21.007 36.569 23.324 1.00 23.13 O
+ATOM 1374 CB ARG B 64 17.958 36.557 24.559 1.00 21.73 C
+ATOM 1375 CG ARG B 64 18.406 38.018 24.648 1.00 21.88 C
+ATOM 1376 CD ARG B 64 17.224 38.947 24.883 1.00 19.75 C
+ATOM 1377 NE ARG B 64 16.599 38.722 26.187 1.00 23.87 N
+ATOM 1378 CZ ARG B 64 17.101 39.132 27.348 1.00 23.81 C
+ATOM 1379 NH1 ARG B 64 18.249 39.801 27.388 1.00 24.38 N1+
+ATOM 1380 NH2 ARG B 64 16.455 38.868 28.474 1.00 23.82 N
+ATOM 1381 N ALA B 65 19.446 35.666 21.980 1.00 22.22 N
+ATOM 1382 CA ALA B 65 20.142 36.027 20.747 1.00 21.67 C
+ATOM 1383 C ALA B 65 20.131 37.553 20.626 1.00 21.95 C
+ATOM 1384 O ALA B 65 19.276 38.222 21.210 1.00 20.51 O
+ATOM 1385 CB ALA B 65 19.444 35.394 19.541 1.00 20.77 C
+ATOM 1386 N ASN B 66 21.066 38.106 19.860 1.00 22.40 N
+ATOM 1387 CA ASN B 66 21.139 39.554 19.728 1.00 21.03 C
+ATOM 1388 C ASN B 66 19.878 40.171 19.118 1.00 20.53 C
+ATOM 1389 O ASN B 66 19.569 41.331 19.382 1.00 20.76 O
+ATOM 1390 CB ASN B 66 22.394 39.948 18.935 1.00 22.07 C
+ATOM 1391 CG ASN B 66 22.318 39.568 17.467 1.00 25.16 C
+ATOM 1392 ND2 ASN B 66 22.983 40.351 16.622 1.00 25.59 N
ATOM 1393 OD1 ASN B 66 21.691 38.578 17.096 1.00 27.32 O
-ATOM 1394 ND2 ASN B 66 22.983 40.351 16.622 1.00 25.59 N
-ATOM 1395 N TYR B 67 19.137 39.395 18.331 1.00 18.72 N
-ATOM 1396 CA TYR B 67 17.913 39.903 17.708 1.00 18.84 C
-ATOM 1397 C TYR B 67 16.680 39.715 18.591 1.00 17.42 C
-ATOM 1398 O TYR B 67 15.587 40.182 18.256 1.00 17.45 O
-ATOM 1399 CB TYR B 67 17.688 39.236 16.336 1.00 19.78 C
-ATOM 1400 CG TYR B 67 17.368 37.750 16.380 1.00 19.86 C
-ATOM 1401 CD1 TYR B 67 16.070 37.300 16.624 1.00 20.57 C
-ATOM 1402 CD2 TYR B 67 18.365 36.797 16.162 1.00 18.31 C
-ATOM 1403 CE1 TYR B 67 15.771 35.933 16.649 1.00 21.80 C
-ATOM 1404 CE2 TYR B 67 18.080 35.433 16.183 1.00 18.64 C
-ATOM 1405 CZ TYR B 67 16.784 35.008 16.428 1.00 20.96 C
-ATOM 1406 OH TYR B 67 16.505 33.660 16.465 1.00 19.87 O
-ATOM 1407 N GLU B 68 16.849 39.033 19.718 1.00 17.92 N
-ATOM 1408 CA GLU B 68 15.729 38.811 20.627 1.00 18.67 C
-ATOM 1409 C GLU B 68 15.642 39.964 21.625 1.00 20.66 C
-ATOM 1410 O GLU B 68 16.601 40.720 21.785 1.00 19.00 O
-ATOM 1411 CB GLU B 68 15.889 37.469 21.354 1.00 18.92 C
-ATOM 1412 CG GLU B 68 15.845 36.263 20.411 1.00 17.53 C
-ATOM 1413 CD GLU B 68 15.958 34.927 21.139 1.00 20.07 C
-ATOM 1414 OE1 GLU B 68 16.898 34.755 21.943 1.00 21.24 O
-ATOM 1415 OE2 GLU B 68 15.109 34.044 20.899 1.00 21.44 O
-ATOM 1416 N ILE B 69 14.494 40.102 22.285 1.00 19.31 N
-ATOM 1417 CA ILE B 69 14.298 41.176 23.252 1.00 19.32 C
-ATOM 1418 C ILE B 69 13.858 40.684 24.624 1.00 20.56 C
-ATOM 1419 O ILE B 69 13.352 39.568 24.760 1.00 18.15 O
-ATOM 1420 CB ILE B 69 13.250 42.178 22.743 1.00 18.72 C
-ATOM 1421 CG1 ILE B 69 11.916 41.460 22.506 1.00 18.37 C
-ATOM 1422 CG2 ILE B 69 13.737 42.817 21.453 1.00 18.46 C
-ATOM 1423 CD1 ILE B 69 10.806 42.357 21.973 1.00 21.03 C
-ATOM 1424 N ASP B 70 14.061 41.528 25.636 1.00 19.51 N
-ATOM 1425 CA ASP B 70 13.670 41.207 27.005 1.00 19.94 C
-ATOM 1426 C ASP B 70 12.255 41.738 27.239 1.00 20.58 C
-ATOM 1427 O ASP B 70 11.634 42.263 26.311 1.00 19.23 O
-ATOM 1428 CB ASP B 70 14.660 41.819 28.007 1.00 23.23 C
-ATOM 1429 CG ASP B 70 14.738 43.337 27.920 1.00 21.85 C
-ATOM 1430 OD1 ASP B 70 14.149 43.930 27.001 1.00 24.20 O
-ATOM 1431 OD2 ASP B 70 15.406 43.940 28.782 1.00 28.24 O
-ATOM 1432 N ASP B 71 11.732 41.609 28.454 1.00 20.73 N
-ATOM 1433 CA ASP B 71 10.373 42.081 28.687 1.00 24.39 C
-ATOM 1434 C ASP B 71 10.209 43.589 28.532 1.00 23.97 C
-ATOM 1435 O ASP B 71 9.158 44.049 28.087 1.00 24.50 O
-ATOM 1436 CB ASP B 71 9.831 41.620 30.051 1.00 26.94 C
-ATOM 1437 CG ASP B 71 10.747 41.954 31.208 1.00 32.37 C
-ATOM 1438 OD1 ASP B 71 11.680 42.768 31.035 1.00 34.93 O
-ATOM 1439 OD2 ASP B 71 10.517 41.396 32.307 1.00 33.92 O
-ATOM 1440 N ASN B 72 11.234 44.361 28.881 1.00 23.78 N
-ATOM 1441 CA ASN B 72 11.140 45.813 28.733 1.00 23.38 C
-ATOM 1442 C ASN B 72 11.007 46.143 27.250 1.00 22.01 C
-ATOM 1443 O ASN B 72 10.187 46.972 26.859 1.00 22.54 O
-ATOM 1444 CB ASN B 72 12.380 46.506 29.300 1.00 25.34 C
-ATOM 1445 CG ASN B 72 12.534 46.298 30.792 1.00 28.55 C
+ATOM 1394 N TYR B 67 19.137 39.395 18.331 1.00 18.72 N
+ATOM 1395 CA TYR B 67 17.913 39.903 17.708 1.00 18.84 C
+ATOM 1396 C TYR B 67 16.680 39.715 18.591 1.00 17.42 C
+ATOM 1397 O TYR B 67 15.587 40.182 18.256 1.00 17.45 O
+ATOM 1398 CB TYR B 67 17.688 39.236 16.336 1.00 19.78 C
+ATOM 1399 CG TYR B 67 17.368 37.750 16.380 1.00 19.86 C
+ATOM 1400 CD1 TYR B 67 16.070 37.300 16.624 1.00 20.57 C
+ATOM 1401 CD2 TYR B 67 18.365 36.797 16.162 1.00 18.31 C
+ATOM 1402 CE1 TYR B 67 15.771 35.933 16.649 1.00 21.80 C
+ATOM 1403 CE2 TYR B 67 18.080 35.433 16.183 1.00 18.64 C
+ATOM 1404 CZ TYR B 67 16.784 35.008 16.428 1.00 20.96 C
+ATOM 1405 OH TYR B 67 16.505 33.660 16.465 1.00 19.87 O
+ATOM 1406 N GLU B 68 16.849 39.033 19.718 1.00 17.92 N
+ATOM 1407 CA GLU B 68 15.729 38.811 20.627 1.00 18.67 C
+ATOM 1408 C GLU B 68 15.642 39.964 21.625 1.00 20.66 C
+ATOM 1409 O GLU B 68 16.601 40.720 21.785 1.00 19.00 O
+ATOM 1410 CB GLU B 68 15.889 37.469 21.354 1.00 18.92 C
+ATOM 1411 CG GLU B 68 15.845 36.263 20.411 1.00 17.53 C
+ATOM 1412 CD GLU B 68 15.958 34.927 21.139 1.00 20.07 C
+ATOM 1413 OE1 GLU B 68 16.898 34.755 21.943 1.00 21.24 O
+ATOM 1414 OE2 GLU B 68 15.109 34.044 20.899 1.00 21.44 O1-
+ATOM 1415 N ILE B 69 14.494 40.102 22.285 1.00 19.31 N
+ATOM 1416 CA ILE B 69 14.298 41.176 23.252 1.00 19.32 C
+ATOM 1417 C ILE B 69 13.858 40.684 24.624 1.00 20.56 C
+ATOM 1418 O ILE B 69 13.352 39.568 24.760 1.00 18.15 O
+ATOM 1419 CB ILE B 69 13.250 42.178 22.743 1.00 18.72 C
+ATOM 1420 CG1 ILE B 69 11.916 41.460 22.506 1.00 18.37 C
+ATOM 1421 CG2 ILE B 69 13.737 42.817 21.453 1.00 18.46 C
+ATOM 1422 CD1 ILE B 69 10.806 42.357 21.973 1.00 21.03 C
+ATOM 1423 N ASP B 70 14.061 41.528 25.636 1.00 19.51 N
+ATOM 1424 CA ASP B 70 13.670 41.207 27.005 1.00 19.94 C
+ATOM 1425 C ASP B 70 12.255 41.738 27.239 1.00 20.58 C
+ATOM 1426 O ASP B 70 11.634 42.263 26.311 1.00 19.23 O
+ATOM 1427 CB ASP B 70 14.660 41.819 28.007 1.00 23.23 C
+ATOM 1428 CG ASP B 70 14.738 43.337 27.920 1.00 21.85 C
+ATOM 1429 OD1 ASP B 70 14.149 43.930 27.001 1.00 24.20 O
+ATOM 1430 OD2 ASP B 70 15.406 43.940 28.782 1.00 28.24 O1-
+ATOM 1431 N ASP B 71 11.732 41.609 28.454 1.00 20.73 N
+ATOM 1432 CA ASP B 71 10.373 42.081 28.687 1.00 24.39 C
+ATOM 1433 C ASP B 71 10.209 43.589 28.532 1.00 23.97 C
+ATOM 1434 O ASP B 71 9.158 44.049 28.087 1.00 24.50 O
+ATOM 1435 CB ASP B 71 9.831 41.620 30.051 1.00 26.94 C
+ATOM 1436 CG ASP B 71 10.747 41.954 31.208 1.00 32.37 C
+ATOM 1437 OD1 ASP B 71 11.680 42.768 31.035 1.00 34.93 O
+ATOM 1438 OD2 ASP B 71 10.517 41.396 32.307 1.00 33.92 O1-
+ATOM 1439 N ASN B 72 11.234 44.361 28.881 1.00 23.78 N
+ATOM 1440 CA ASN B 72 11.140 45.813 28.733 1.00 23.38 C
+ATOM 1441 C ASN B 72 11.007 46.143 27.250 1.00 22.01 C
+ATOM 1442 O ASN B 72 10.187 46.972 26.859 1.00 22.54 O
+ATOM 1443 CB ASN B 72 12.380 46.506 29.300 1.00 25.34 C
+ATOM 1444 CG ASN B 72 12.534 46.298 30.792 1.00 28.55 C
+ATOM 1445 ND2 ASN B 72 13.774 46.151 31.242 1.00 33.35 N
ATOM 1446 OD1 ASN B 72 11.554 46.286 31.535 1.00 30.40 O
-ATOM 1447 ND2 ASN B 72 13.774 46.151 31.242 1.00 33.35 N
-ATOM 1448 N GLY B 73 11.821 45.483 26.430 1.00 20.12 N
-ATOM 1449 CA GLY B 73 11.775 45.699 24.995 1.00 20.44 C
-ATOM 1450 C GLY B 73 10.437 45.278 24.411 1.00 21.40 C
-ATOM 1451 O GLY B 73 9.919 45.917 23.487 1.00 20.71 O
-ATOM 1452 N LEU B 74 9.866 44.201 24.942 1.00 19.81 N
-ATOM 1453 CA LEU B 74 8.572 43.733 24.453 1.00 20.47 C
-ATOM 1454 C LEU B 74 7.507 44.776 24.794 1.00 20.69 C
-ATOM 1455 O LEU B 74 6.606 45.043 23.999 1.00 20.22 O
-ATOM 1456 CB LEU B 74 8.207 42.386 25.088 1.00 18.43 C
-ATOM 1457 CG LEU B 74 6.890 41.763 24.608 1.00 19.91 C
-ATOM 1458 CD1 LEU B 74 6.928 41.547 23.095 1.00 18.72 C
-ATOM 1459 CD2 LEU B 74 6.663 40.441 25.324 1.00 20.20 C
-ATOM 1460 N LYS B 75 7.610 45.368 25.981 1.00 22.12 N
-ATOM 1461 CA LYS B 75 6.649 46.391 26.375 1.00 23.72 C
-ATOM 1462 C LYS B 75 6.698 47.564 25.398 1.00 22.94 C
-ATOM 1463 O LYS B 75 5.664 48.055 24.951 1.00 19.97 O
-ATOM 1464 CB LYS B 75 6.938 46.880 27.793 1.00 26.09 C
-ATOM 1465 CG LYS B 75 6.017 46.265 28.835 1.00 29.34 C
-ATOM 1466 CD LYS B 75 6.374 46.734 30.226 1.00 32.39 C
-ATOM 1467 CE LYS B 75 5.329 46.292 31.241 1.00 31.81 C
-ATOM 1468 NZ LYS B 75 5.141 44.823 31.258 1.00 29.78 N
-ATOM 1469 N VAL B 76 7.906 48.002 25.061 1.00 22.65 N
-ATOM 1470 CA VAL B 76 8.076 49.105 24.125 1.00 22.20 C
-ATOM 1471 C VAL B 76 7.453 48.770 22.764 1.00 23.02 C
-ATOM 1472 O VAL B 76 6.727 49.586 22.183 1.00 23.00 O
-ATOM 1473 CB VAL B 76 9.569 49.441 23.933 1.00 21.71 C
-ATOM 1474 CG1 VAL B 76 9.724 50.564 22.913 1.00 22.13 C
-ATOM 1475 CG2 VAL B 76 10.185 49.838 25.266 1.00 20.67 C
-ATOM 1476 N GLU B 77 7.730 47.570 22.258 1.00 22.07 N
-ATOM 1477 CA GLU B 77 7.186 47.148 20.972 1.00 21.16 C
-ATOM 1478 C GLU B 77 5.666 47.028 20.950 1.00 20.62 C
-ATOM 1479 O GLU B 77 5.019 47.463 19.992 1.00 18.69 O
-ATOM 1480 CB GLU B 77 7.777 45.800 20.539 1.00 24.94 C
-ATOM 1481 CG GLU B 77 8.985 45.910 19.639 1.00 28.49 C
-ATOM 1482 CD GLU B 77 9.114 44.734 18.677 1.00 27.16 C
-ATOM 1483 OE1 GLU B 77 8.241 44.570 17.797 1.00 28.07 O
-ATOM 1484 OE2 GLU B 77 10.094 43.978 18.797 1.00 26.86 O
-ATOM 1485 N VAL B 78 5.105 46.412 21.987 1.00 18.51 N
-ATOM 1486 CA VAL B 78 3.659 46.230 22.081 1.00 19.21 C
-ATOM 1487 C VAL B 78 2.948 47.580 22.055 1.00 22.04 C
-ATOM 1488 O VAL B 78 1.938 47.745 21.367 1.00 23.27 O
-ATOM 1489 CB VAL B 78 3.276 45.465 23.373 1.00 21.22 C
-ATOM 1490 CG1 VAL B 78 1.771 45.530 23.604 1.00 19.82 C
-ATOM 1491 CG2 VAL B 78 3.727 44.011 23.261 1.00 18.22 C
-ATOM 1492 N ARG B 79 3.478 48.543 22.803 1.00 23.18 N
-ATOM 1493 CA ARG B 79 2.894 49.882 22.848 1.00 23.88 C
-ATOM 1494 C ARG B 79 2.980 50.507 21.459 1.00 23.67 C
-ATOM 1495 O ARG B 79 2.016 51.094 20.966 1.00 23.59 O
-ATOM 1496 CB ARG B 79 3.650 50.759 23.850 1.00 25.36 C
-ATOM 1497 CG ARG B 79 3.079 52.169 23.997 1.00 32.14 C
-ATOM 1498 CD ARG B 79 3.856 52.980 25.034 1.00 36.84 C
-ATOM 1499 NE ARG B 79 3.692 52.471 26.396 1.00 43.91 N
-ATOM 1500 CZ ARG B 79 2.541 52.463 27.066 1.00 45.74 C
-ATOM 1501 NH1 ARG B 79 1.435 52.936 26.505 1.00 46.57 N
-ATOM 1502 NH2 ARG B 79 2.497 51.992 28.305 1.00 46.24 N
-ATOM 1503 N SER B 80 4.146 50.371 20.837 1.00 23.13 N
-ATOM 1504 CA SER B 80 4.376 50.919 19.509 1.00 23.50 C
-ATOM 1505 C SER B 80 3.416 50.309 18.491 1.00 23.89 C
-ATOM 1506 O SER B 80 2.917 51.003 17.605 1.00 22.80 O
-ATOM 1507 CB SER B 80 5.822 50.663 19.084 1.00 25.21 C
-ATOM 1508 OG SER B 80 6.066 51.175 17.791 1.00 28.27 O
-ATOM 1509 N ILE B 81 3.148 49.012 18.632 1.00 24.89 N
-ATOM 1510 CA ILE B 81 2.248 48.316 17.720 1.00 26.17 C
-ATOM 1511 C ILE B 81 0.812 48.813 17.874 1.00 26.75 C
-ATOM 1512 O ILE B 81 0.124 49.070 16.884 1.00 25.71 O
-ATOM 1513 CB ILE B 81 2.258 46.782 17.963 1.00 26.29 C
-ATOM 1514 CG1 ILE B 81 3.628 46.194 17.622 1.00 28.25 C
-ATOM 1515 CG2 ILE B 81 1.185 46.114 17.123 1.00 27.13 C
-ATOM 1516 CD1 ILE B 81 3.709 44.704 17.786 1.00 33.64 C
-ATOM 1517 N LEU B 82 0.356 48.943 19.114 1.00 24.62 N
-ATOM 1518 CA LEU B 82 -1.004 49.405 19.353 1.00 27.52 C
-ATOM 1519 C LEU B 82 -1.199 50.824 18.823 1.00 28.53 C
-ATOM 1520 O LEU B 82 -2.228 51.133 18.227 1.00 28.27 O
-ATOM 1521 CB LEU B 82 -1.338 49.351 20.849 1.00 26.96 C
-ATOM 1522 CG LEU B 82 -1.373 47.960 21.497 1.00 27.37 C
-ATOM 1523 CD1 LEU B 82 -1.776 48.088 22.967 1.00 27.95 C
-ATOM 1524 CD2 LEU B 82 -2.362 47.067 20.757 1.00 28.08 C
-ATOM 1525 N GLU B 83 -0.208 51.683 19.029 1.00 29.69 N
-ATOM 1526 CA GLU B 83 -0.313 53.056 18.554 1.00 34.56 C
-ATOM 1527 C GLU B 83 -0.348 53.085 17.033 1.00 35.24 C
-ATOM 1528 O GLU B 83 -1.108 53.845 16.434 1.00 36.22 O
-ATOM 1529 CB GLU B 83 0.859 53.893 19.063 1.00 35.90 C
-ATOM 1530 CG GLU B 83 0.965 53.930 20.574 1.00 42.15 C
-ATOM 1531 CD GLU B 83 1.986 54.940 21.060 1.00 45.91 C
-ATOM 1532 OE1 GLU B 83 3.027 55.104 20.387 1.00 47.85 O
-ATOM 1533 OE2 GLU B 83 1.752 55.558 22.121 1.00 48.82 O
-ATOM 1534 N LYS B 84 0.476 52.245 16.417 1.00 35.64 N
-ATOM 1535 CA LYS B 84 0.547 52.152 14.964 1.00 36.00 C
-ATOM 1536 C LYS B 84 -0.835 51.883 14.379 1.00 34.75 C
-ATOM 1537 O LYS B 84 -1.237 52.501 13.397 1.00 33.97 O
-ATOM 1538 CB LYS B 84 1.508 51.027 14.570 1.00 37.77 C
-ATOM 1539 CG LYS B 84 1.594 50.742 13.082 1.00 41.59 C
-ATOM 1540 CD LYS B 84 2.605 49.636 12.827 1.00 43.44 C
-ATOM 1541 CE LYS B 84 2.718 49.294 11.359 1.00 46.46 C
-ATOM 1542 NZ LYS B 84 3.768 48.254 11.149 1.00 49.60 N
-ATOM 1543 N PHE B 85 -1.561 50.959 14.995 1.00 33.01 N
-ATOM 1544 CA PHE B 85 -2.894 50.601 14.534 1.00 33.10 C
-ATOM 1545 C PHE B 85 -3.968 51.439 15.217 1.00 34.48 C
-ATOM 1546 O PHE B 85 -5.162 51.200 15.040 1.00 33.29 O
-ATOM 1547 CB PHE B 85 -3.139 49.110 14.783 1.00 31.44 C
-ATOM 1548 CG PHE B 85 -2.358 48.210 13.863 1.00 31.09 C
-ATOM 1549 CD1 PHE B 85 -2.840 47.908 12.592 1.00 30.99 C
-ATOM 1550 CD2 PHE B 85 -1.124 47.701 14.249 1.00 30.55 C
-ATOM 1551 CE1 PHE B 85 -2.105 47.112 11.717 1.00 31.66 C
-ATOM 1552 CE2 PHE B 85 -0.377 46.903 13.381 1.00 32.15 C
-ATOM 1553 CZ PHE B 85 -0.869 46.608 12.112 1.00 31.87 C
-ATOM 1554 N LYS B 86 -3.532 52.427 15.993 1.00 36.45 N
-ATOM 1555 CA LYS B 86 -4.453 53.307 16.701 1.00 39.11 C
-ATOM 1556 C LYS B 86 -5.468 52.509 17.513 1.00 39.10 C
-ATOM 1557 O LYS B 86 -6.672 52.759 17.444 1.00 39.41 O
-ATOM 1558 CB LYS B 86 -5.185 54.215 15.704 1.00 41.49 C
-ATOM 1559 CG LYS B 86 -4.283 55.207 14.986 1.00 44.36 C
-ATOM 1560 CD LYS B 86 -5.068 56.021 13.968 1.00 47.67 C
-ATOM 1561 CE LYS B 86 -4.219 57.130 13.361 1.00 48.94 C
-ATOM 1562 NZ LYS B 86 -3.009 56.606 12.669 1.00 50.34 N
-ATOM 1563 N LEU B 87 -4.974 51.543 18.279 1.00 38.36 N
-ATOM 1564 CA LEU B 87 -5.834 50.715 19.111 1.00 37.74 C
-ATOM 1565 C LEU B 87 -5.451 50.868 20.576 1.00 38.43 C
-ATOM 1566 O LEU B 87 -4.473 51.595 20.854 1.00 38.22 O
-ATOM 1567 CB LEU B 87 -5.716 49.246 18.698 1.00 37.82 C
-ATOM 1568 CG LEU B 87 -6.345 48.866 17.358 1.00 38.40 C
-ATOM 1569 CD1 LEU B 87 -6.032 47.410 17.036 1.00 37.36 C
-ATOM 1570 CD2 LEU B 87 -7.853 49.090 17.425 1.00 36.99 C
\ No newline at end of file
+ATOM 1447 N GLY B 73 11.821 45.483 26.430 1.00 20.12 N
+ATOM 1448 CA GLY B 73 11.775 45.699 24.995 1.00 20.44 C
+ATOM 1449 C GLY B 73 10.437 45.278 24.411 1.00 21.40 C
+ATOM 1450 O GLY B 73 9.919 45.917 23.487 1.00 20.71 O
+ATOM 1451 N LEU B 74 9.866 44.201 24.942 1.00 19.81 N
+ATOM 1452 CA LEU B 74 8.572 43.733 24.453 1.00 20.47 C
+ATOM 1453 C LEU B 74 7.507 44.776 24.794 1.00 20.69 C
+ATOM 1454 O LEU B 74 6.606 45.043 23.999 1.00 20.22 O
+ATOM 1455 CB LEU B 74 8.207 42.386 25.088 1.00 18.43 C
+ATOM 1456 CG LEU B 74 6.890 41.763 24.608 1.00 19.91 C
+ATOM 1457 CD1 LEU B 74 6.928 41.547 23.095 1.00 18.72 C
+ATOM 1458 CD2 LEU B 74 6.663 40.441 25.324 1.00 20.20 C
+ATOM 1459 N LYS B 75 7.610 45.368 25.981 1.00 22.12 N
+ATOM 1460 CA LYS B 75 6.649 46.391 26.375 1.00 23.72 C
+ATOM 1461 C LYS B 75 6.698 47.564 25.398 1.00 22.94 C
+ATOM 1462 O LYS B 75 5.664 48.055 24.951 1.00 19.97 O
+ATOM 1463 CB LYS B 75 6.938 46.880 27.793 1.00 26.09 C
+ATOM 1464 CG LYS B 75 6.017 46.265 28.835 1.00 29.34 C
+ATOM 1465 CD LYS B 75 6.374 46.734 30.226 1.00 32.39 C
+ATOM 1466 CE LYS B 75 5.329 46.292 31.241 1.00 31.81 C
+ATOM 1467 NZ LYS B 75 5.141 44.823 31.258 1.00 29.78 N1+
+ATOM 1468 N VAL B 76 7.906 48.002 25.061 1.00 22.65 N
+ATOM 1469 CA VAL B 76 8.076 49.105 24.125 1.00 22.20 C
+ATOM 1470 C VAL B 76 7.453 48.770 22.764 1.00 23.02 C
+ATOM 1471 O VAL B 76 6.727 49.586 22.183 1.00 23.00 O
+ATOM 1472 CB VAL B 76 9.569 49.441 23.933 1.00 21.71 C
+ATOM 1473 CG1 VAL B 76 9.724 50.564 22.913 1.00 22.13 C
+ATOM 1474 CG2 VAL B 76 10.185 49.838 25.266 1.00 20.67 C
+ATOM 1475 N GLU B 77 7.730 47.570 22.258 1.00 22.07 N
+ATOM 1476 CA GLU B 77 7.186 47.148 20.972 1.00 21.16 C
+ATOM 1477 C GLU B 77 5.666 47.028 20.950 1.00 20.62 C
+ATOM 1478 O GLU B 77 5.019 47.463 19.992 1.00 18.69 O
+ATOM 1479 CB GLU B 77 7.777 45.800 20.539 1.00 24.94 C
+ATOM 1480 CG GLU B 77 8.985 45.910 19.639 1.00 28.49 C
+ATOM 1481 CD GLU B 77 9.114 44.734 18.677 1.00 27.16 C
+ATOM 1482 OE1 GLU B 77 8.241 44.570 17.797 1.00 28.07 O
+ATOM 1483 OE2 GLU B 77 10.094 43.978 18.797 1.00 26.86 O1-
+ATOM 1484 N VAL B 78 5.105 46.412 21.987 1.00 18.51 N
+ATOM 1485 CA VAL B 78 3.659 46.230 22.081 1.00 19.21 C
+ATOM 1486 C VAL B 78 2.948 47.580 22.055 1.00 22.04 C
+ATOM 1487 O VAL B 78 1.938 47.745 21.367 1.00 23.27 O
+ATOM 1488 CB VAL B 78 3.276 45.465 23.373 1.00 21.22 C
+ATOM 1489 CG1 VAL B 78 1.771 45.530 23.604 1.00 19.82 C
+ATOM 1490 CG2 VAL B 78 3.727 44.011 23.261 1.00 18.22 C
+ATOM 1491 N ARG B 79 3.478 48.543 22.803 1.00 23.18 N
+ATOM 1492 CA ARG B 79 2.894 49.882 22.848 1.00 23.88 C
+ATOM 1493 C ARG B 79 2.980 50.507 21.459 1.00 23.67 C
+ATOM 1494 O ARG B 79 2.016 51.094 20.966 1.00 23.59 O
+ATOM 1495 CB ARG B 79 3.650 50.759 23.850 1.00 25.36 C
+ATOM 1496 CG ARG B 79 3.079 52.169 23.997 1.00 32.14 C
+ATOM 1497 CD ARG B 79 3.856 52.980 25.034 1.00 36.84 C
+ATOM 1498 NE ARG B 79 3.692 52.471 26.396 1.00 43.91 N
+ATOM 1499 CZ ARG B 79 2.541 52.463 27.066 1.00 45.74 C
+ATOM 1500 NH1 ARG B 79 1.435 52.936 26.505 1.00 46.57 N1+
+ATOM 1501 NH2 ARG B 79 2.497 51.992 28.305 1.00 46.24 N
+ATOM 1502 N SER B 80 4.146 50.371 20.837 1.00 23.13 N
+ATOM 1503 CA SER B 80 4.376 50.919 19.509 1.00 23.50 C
+ATOM 1504 C SER B 80 3.416 50.309 18.491 1.00 23.89 C
+ATOM 1505 O SER B 80 2.917 51.003 17.605 1.00 22.80 O
+ATOM 1506 CB SER B 80 5.822 50.663 19.084 1.00 25.21 C
+ATOM 1507 OG SER B 80 6.066 51.175 17.791 1.00 28.27 O
+ATOM 1508 N ILE B 81 3.148 49.012 18.632 1.00 24.89 N
+ATOM 1509 CA ILE B 81 2.248 48.316 17.720 1.00 26.17 C
+ATOM 1510 C ILE B 81 0.812 48.813 17.874 1.00 26.75 C
+ATOM 1511 O ILE B 81 0.124 49.070 16.884 1.00 25.71 O
+ATOM 1512 CB ILE B 81 2.258 46.782 17.963 1.00 26.29 C
+ATOM 1513 CG1 ILE B 81 3.628 46.194 17.622 1.00 28.25 C
+ATOM 1514 CG2 ILE B 81 1.185 46.114 17.123 1.00 27.13 C
+ATOM 1515 CD1 ILE B 81 3.709 44.704 17.786 1.00 33.64 C
+ATOM 1516 N LEU B 82 0.356 48.943 19.114 1.00 24.62 N
+ATOM 1517 CA LEU B 82 -1.004 49.405 19.353 1.00 27.52 C
+ATOM 1518 C LEU B 82 -1.199 50.824 18.823 1.00 28.53 C
+ATOM 1519 O LEU B 82 -2.228 51.133 18.227 1.00 28.27 O
+ATOM 1520 CB LEU B 82 -1.338 49.351 20.849 1.00 26.96 C
+ATOM 1521 CG LEU B 82 -1.373 47.960 21.497 1.00 27.37 C
+ATOM 1522 CD1 LEU B 82 -1.776 48.088 22.967 1.00 27.95 C
+ATOM 1523 CD2 LEU B 82 -2.362 47.067 20.757 1.00 28.08 C
+ATOM 1524 N GLU B 83 -0.208 51.683 19.029 1.00 29.69 N
+ATOM 1525 CA GLU B 83 -0.313 53.056 18.554 1.00 34.56 C
+ATOM 1526 C GLU B 83 -0.348 53.085 17.033 1.00 35.24 C
+ATOM 1527 O GLU B 83 -1.108 53.845 16.434 1.00 36.22 O
+ATOM 1528 CB GLU B 83 0.859 53.893 19.063 1.00 35.90 C
+ATOM 1529 CG GLU B 83 0.965 53.930 20.574 1.00 42.15 C
+ATOM 1530 CD GLU B 83 1.986 54.940 21.060 1.00 45.91 C
+ATOM 1531 OE1 GLU B 83 3.027 55.104 20.387 1.00 47.85 O
+ATOM 1532 OE2 GLU B 83 1.752 55.558 22.121 1.00 48.82 O1-
+ATOM 1533 N LYS B 84 0.476 52.245 16.417 1.00 35.64 N
+ATOM 1534 CA LYS B 84 0.547 52.152 14.964 1.00 36.00 C
+ATOM 1535 C LYS B 84 -0.835 51.883 14.379 1.00 34.75 C
+ATOM 1536 O LYS B 84 -1.237 52.501 13.397 1.00 33.97 O
+ATOM 1537 CB LYS B 84 1.508 51.027 14.570 1.00 37.77 C
+ATOM 1538 CG LYS B 84 1.594 50.742 13.082 1.00 41.59 C
+ATOM 1539 CD LYS B 84 2.605 49.636 12.827 1.00 43.44 C
+ATOM 1540 CE LYS B 84 2.718 49.294 11.359 1.00 46.46 C
+ATOM 1541 NZ LYS B 84 3.768 48.254 11.149 1.00 49.60 N1+
+ATOM 1542 N PHE B 85 -1.561 50.959 14.995 1.00 33.01 N
+ATOM 1543 CA PHE B 85 -2.894 50.601 14.534 1.00 33.10 C
+ATOM 1544 C PHE B 85 -3.968 51.439 15.217 1.00 34.48 C
+ATOM 1545 O PHE B 85 -5.162 51.200 15.040 1.00 33.29 O
+ATOM 1546 CB PHE B 85 -3.139 49.110 14.783 1.00 31.44 C
+ATOM 1547 CG PHE B 85 -2.358 48.210 13.863 1.00 31.09 C
+ATOM 1548 CD1 PHE B 85 -2.840 47.908 12.592 1.00 30.99 C
+ATOM 1549 CD2 PHE B 85 -1.124 47.701 14.249 1.00 30.55 C
+ATOM 1550 CE1 PHE B 85 -2.105 47.112 11.717 1.00 31.66 C
+ATOM 1551 CE2 PHE B 85 -0.377 46.903 13.381 1.00 32.15 C
+ATOM 1552 CZ PHE B 85 -0.869 46.608 12.112 1.00 31.87 C
+ATOM 1553 N LYS B 86 -3.532 52.427 15.993 1.00 36.45 N
+ATOM 1554 CA LYS B 86 -4.453 53.307 16.701 1.00 39.11 C
+ATOM 1555 C LYS B 86 -5.468 52.509 17.513 1.00 39.10 C
+ATOM 1556 O LYS B 86 -6.672 52.759 17.444 1.00 39.41 O
+ATOM 1557 CB LYS B 86 -5.185 54.215 15.704 1.00 41.49 C
+ATOM 1558 CG LYS B 86 -4.283 55.207 14.986 1.00 44.36 C
+ATOM 1559 CD LYS B 86 -5.068 56.021 13.968 1.00 47.67 C
+ATOM 1560 CE LYS B 86 -4.219 57.130 13.361 1.00 48.94 C
+ATOM 1561 NZ LYS B 86 -3.009 56.606 12.669 1.00 50.34 N1+
+ATOM 1562 N LEU B 87 -4.974 51.543 18.279 1.00 38.36 N
+ATOM 1563 CA LEU B 87 -5.834 50.715 19.111 1.00 37.74 C
+ATOM 1564 C LEU B 87 -5.451 50.868 20.576 1.00 38.43 C
+ATOM 1565 O LEU B 87 -4.473 51.595 20.854 1.00 38.22 O
+ATOM 1566 CB LEU B 87 -5.716 49.246 18.698 1.00 37.82 C
+ATOM 1567 CG LEU B 87 -6.345 48.866 17.358 1.00 38.40 C
+ATOM 1568 CD1 LEU B 87 -6.032 47.410 17.036 1.00 37.36 C
+ATOM 1569 CD2 LEU B 87 -7.853 49.090 17.425 1.00 36.99 C
+TER
+END
diff --git a/3_Kinematics/data/cutpoint_pertuber.pdb b/3_Kinematics/data/cutpoint_pertuber.pdb
new file mode 100644
index 0000000..9ff8801
--- /dev/null
+++ b/3_Kinematics/data/cutpoint_pertuber.pdb
@@ -0,0 +1,113 @@
+HEADER 03-AUG-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 03-AUG-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.26+release.b308454c455
+ATOM 1 N ALA A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA ALA A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C ALA A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O ALA A 1 1.251 2.390 0.000 1.00 0.00 O
+ATOM 5 CB ALA A 1 1.988 -0.773 -1.199 1.00 0.00 C
+ATOM 6 1H ALA A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 7 2H ALA A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 8 3H ALA A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 9 HA ALA A 1 1.797 -0.490 0.913 1.00 0.00 H
+ATOM 10 1HB ALA A 1 3.078 -0.764 -1.185 1.00 0.00 H
+ATOM 11 2HB ALA A 1 1.633 -1.802 -1.154 1.00 0.00 H
+ATOM 12 3HB ALA A 1 1.633 -0.307 -2.117 1.00 0.00 H
+ATOM 13 N ALA A 2 3.332 1.536 0.000 1.00 0.00 N
+ATOM 14 CA ALA A 2 3.988 2.839 0.000 1.00 0.00 C
+ATOM 15 C ALA A 2 5.504 2.693 0.000 1.00 0.00 C
+ATOM 16 O ALA A 2 6.030 1.580 0.000 1.00 0.00 O
+ATOM 17 CB ALA A 2 3.535 3.659 1.199 1.00 0.00 C
+ATOM 18 H ALA A 2 3.899 0.700 0.000 1.00 0.00 H
+ATOM 19 HA ALA A 2 3.702 3.361 -0.913 1.00 0.00 H
+ATOM 20 1HB ALA A 2 4.033 4.629 1.185 1.00 0.00 H
+ATOM 21 2HB ALA A 2 2.456 3.805 1.154 1.00 0.00 H
+ATOM 22 3HB ALA A 2 3.792 3.133 2.117 1.00 0.00 H
+ATOM 23 N ALA A 3 6.202 3.823 0.000 1.00 0.00 N
+ATOM 24 CA ALA A 3 7.660 3.823 0.000 1.00 0.00 C
+ATOM 25 C ALA A 3 8.211 5.243 0.000 1.00 0.00 C
+ATOM 26 O ALA A 3 7.453 6.213 -0.000 1.00 0.00 O
+ATOM 27 CB ALA A 3 8.190 3.050 -1.199 1.00 0.00 C
+ATOM 28 H ALA A 3 5.710 4.705 0.000 1.00 0.00 H
+ATOM 29 HA ALA A 3 7.999 3.333 0.913 1.00 0.00 H
+ATOM 30 1HB ALA A 3 9.280 3.059 -1.185 1.00 0.00 H
+ATOM 31 2HB ALA A 3 7.835 2.021 -1.154 1.00 0.00 H
+ATOM 32 3HB ALA A 3 7.835 3.516 -2.117 1.00 0.00 H
+ATOM 33 N ALA A 4 9.534 5.359 0.000 1.00 0.00 N
+ATOM 34 CA ALA A 4 10.190 6.661 -0.000 1.00 0.00 C
+ATOM 35 C ALA A 4 11.706 6.515 0.000 1.00 0.00 C
+ATOM 36 O ALA A 4 12.232 5.403 0.000 1.00 0.00 O
+ATOM 37 CB ALA A 4 9.737 7.482 1.199 1.00 0.00 C
+ATOM 38 H ALA A 4 10.101 4.523 0.000 1.00 0.00 H
+ATOM 39 HA ALA A 4 9.904 7.184 -0.913 1.00 0.00 H
+ATOM 40 1HB ALA A 4 10.235 8.452 1.185 1.00 0.00 H
+ATOM 41 2HB ALA A 4 8.658 7.628 1.154 1.00 0.00 H
+ATOM 42 3HB ALA A 4 9.994 6.956 2.117 1.00 0.00 H
+ATOM 43 N ALA A 5 12.404 7.646 0.000 1.00 0.00 N
+ATOM 44 CA ALA A 5 13.862 7.646 0.000 1.00 0.00 C
+ATOM 45 C ALA A 5 14.413 9.066 0.000 1.00 0.00 C
+ATOM 46 O ALA A 5 13.655 10.036 -0.000 1.00 0.00 O
+ATOM 47 CB ALA A 5 14.392 6.873 -1.199 1.00 0.00 C
+ATOM 48 H ALA A 5 11.912 8.528 -0.000 1.00 0.00 H
+ATOM 49 HA ALA A 5 14.201 7.156 0.913 1.00 0.00 H
+ATOM 50 1HB ALA A 5 15.482 6.882 -1.185 1.00 0.00 H
+ATOM 51 2HB ALA A 5 14.037 5.843 -1.154 1.00 0.00 H
+ATOM 52 3HB ALA A 5 14.037 7.339 -2.117 1.00 0.00 H
+ATOM 53 N ALA A 6 20.070 10.608 4.818 1.00 0.00 N
+ATOM 54 CA ALA A 6 20.616 10.183 3.535 1.00 0.00 C
+ATOM 55 C ALA A 6 20.072 11.035 2.396 1.00 0.00 C
+ATOM 56 O ALA A 6 19.275 11.947 2.615 1.00 0.00 O
+ATOM 57 CB ALA A 6 20.310 8.713 3.290 1.00 0.00 C
+ATOM 58 H ALA A 6 19.419 11.380 4.845 1.00 0.00 H
+ATOM 59 HA ALA A 6 21.697 10.318 3.566 1.00 0.00 H
+ATOM 60 1HB ALA A 6 20.725 8.411 2.328 1.00 0.00 H
+ATOM 61 2HB ALA A 6 20.756 8.111 4.082 1.00 0.00 H
+ATOM 62 3HB ALA A 6 19.232 8.562 3.283 1.00 0.00 H
+ATOM 63 N ALA A 7 20.507 10.732 1.177 1.00 0.00 N
+ATOM 64 CA ALA A 7 20.064 11.469 0.000 1.00 0.00 C
+ATOM 65 C ALA A 7 20.615 12.889 0.000 1.00 0.00 C
+ATOM 66 O ALA A 7 19.857 13.859 -0.000 1.00 0.00 O
+ATOM 67 CB ALA A 7 18.544 11.491 -0.070 1.00 0.00 C
+ATOM 68 H ALA A 7 21.162 9.971 1.064 1.00 0.00 H
+ATOM 69 HA ALA A 7 20.451 10.961 -0.883 1.00 0.00 H
+ATOM 70 1HB ALA A 7 18.229 12.045 -0.954 1.00 0.00 H
+ATOM 71 2HB ALA A 7 18.168 10.470 -0.129 1.00 0.00 H
+ATOM 72 3HB ALA A 7 18.146 11.974 0.821 1.00 0.00 H
+ATOM 73 N ALA A 8 21.939 13.005 0.000 1.00 0.00 N
+ATOM 74 CA ALA A 8 22.594 14.307 -0.000 1.00 0.00 C
+ATOM 75 C ALA A 8 24.110 14.161 0.000 1.00 0.00 C
+ATOM 76 O ALA A 8 24.636 13.048 0.000 1.00 0.00 O
+ATOM 77 CB ALA A 8 22.141 15.128 1.199 1.00 0.00 C
+ATOM 78 H ALA A 8 22.506 12.169 0.000 1.00 0.00 H
+ATOM 79 HA ALA A 8 22.308 14.830 -0.913 1.00 0.00 H
+ATOM 80 1HB ALA A 8 22.639 16.098 1.185 1.00 0.00 H
+ATOM 81 2HB ALA A 8 21.062 15.274 1.154 1.00 0.00 H
+ATOM 82 3HB ALA A 8 22.398 14.602 2.117 1.00 0.00 H
+ATOM 83 N ALA A 9 24.808 15.292 0.000 1.00 0.00 N
+ATOM 84 CA ALA A 9 26.266 15.292 0.000 1.00 0.00 C
+ATOM 85 C ALA A 9 26.817 16.712 0.000 1.00 0.00 C
+ATOM 86 O ALA A 9 26.059 17.682 -0.000 1.00 0.00 O
+ATOM 87 CB ALA A 9 26.796 14.519 -1.199 1.00 0.00 C
+ATOM 88 H ALA A 9 24.316 16.174 -0.000 1.00 0.00 H
+ATOM 89 HA ALA A 9 26.605 14.802 0.913 1.00 0.00 H
+ATOM 90 1HB ALA A 9 27.886 14.528 -1.185 1.00 0.00 H
+ATOM 91 2HB ALA A 9 26.441 13.489 -1.154 1.00 0.00 H
+ATOM 92 3HB ALA A 9 26.441 14.985 -2.117 1.00 0.00 H
+ATOM 93 N ALA A 10 28.141 16.828 0.000 1.00 0.00 N
+ATOM 94 CA ALA A 10 28.796 18.130 -0.000 1.00 0.00 C
+ATOM 95 C ALA A 10 30.312 17.984 0.000 1.00 0.00 C
+ATOM 96 O ALA A 10 30.892 17.747 -1.023 1.00 0.00 O
+ATOM 97 OXT ALA A 10 30.926 18.107 1.023 1.00 0.00 O
+ATOM 98 CB ALA A 10 28.343 18.951 1.199 1.00 0.00 C
+ATOM 99 H ALA A 10 28.708 15.992 0.000 1.00 0.00 H
+ATOM 100 HA ALA A 10 28.510 18.653 -0.913 1.00 0.00 H
+ATOM 101 1HB ALA A 10 28.841 19.921 1.185 1.00 0.00 H
+ATOM 102 2HB ALA A 10 27.264 19.096 1.154 1.00 0.00 H
+ATOM 103 3HB ALA A 10 28.600 18.425 2.117 1.00 0.00 H
+TER
diff --git a/3_Kinematics/data/cutpoint_raw.pdb b/3_Kinematics/data/cutpoint_raw.pdb
new file mode 100644
index 0000000..fb12bf5
--- /dev/null
+++ b/3_Kinematics/data/cutpoint_raw.pdb
@@ -0,0 +1,113 @@
+HEADER 03-AUG-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 03-AUG-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.26+release.b308454c455
+ATOM 1 N ALA A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA ALA A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C ALA A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O ALA A 1 1.251 2.390 0.000 1.00 0.00 O
+ATOM 5 CB ALA A 1 1.988 -0.773 -1.199 1.00 0.00 C
+ATOM 6 1H ALA A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 7 2H ALA A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 8 3H ALA A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 9 HA ALA A 1 1.797 -0.490 0.913 1.00 0.00 H
+ATOM 10 1HB ALA A 1 3.078 -0.764 -1.185 1.00 0.00 H
+ATOM 11 2HB ALA A 1 1.633 -1.802 -1.154 1.00 0.00 H
+ATOM 12 3HB ALA A 1 1.633 -0.307 -2.117 1.00 0.00 H
+ATOM 13 N ALA A 2 3.332 1.536 0.000 1.00 0.00 N
+ATOM 14 CA ALA A 2 3.988 2.839 0.000 1.00 0.00 C
+ATOM 15 C ALA A 2 5.504 2.693 0.000 1.00 0.00 C
+ATOM 16 O ALA A 2 6.030 1.580 0.000 1.00 0.00 O
+ATOM 17 CB ALA A 2 3.535 3.659 1.199 1.00 0.00 C
+ATOM 18 H ALA A 2 3.899 0.700 0.000 1.00 0.00 H
+ATOM 19 HA ALA A 2 3.702 3.361 -0.913 1.00 0.00 H
+ATOM 20 1HB ALA A 2 4.033 4.629 1.185 1.00 0.00 H
+ATOM 21 2HB ALA A 2 2.456 3.805 1.154 1.00 0.00 H
+ATOM 22 3HB ALA A 2 3.792 3.133 2.117 1.00 0.00 H
+ATOM 23 N ALA A 3 6.202 3.823 0.000 1.00 0.00 N
+ATOM 24 CA ALA A 3 7.660 3.823 0.000 1.00 0.00 C
+ATOM 25 C ALA A 3 8.211 5.243 0.000 1.00 0.00 C
+ATOM 26 O ALA A 3 7.453 6.213 -0.000 1.00 0.00 O
+ATOM 27 CB ALA A 3 8.190 3.050 -1.199 1.00 0.00 C
+ATOM 28 H ALA A 3 5.710 4.705 0.000 1.00 0.00 H
+ATOM 29 HA ALA A 3 7.999 3.333 0.913 1.00 0.00 H
+ATOM 30 1HB ALA A 3 9.280 3.059 -1.185 1.00 0.00 H
+ATOM 31 2HB ALA A 3 7.835 2.021 -1.154 1.00 0.00 H
+ATOM 32 3HB ALA A 3 7.835 3.516 -2.117 1.00 0.00 H
+ATOM 33 N ALA A 4 9.534 5.359 0.000 1.00 0.00 N
+ATOM 34 CA ALA A 4 10.190 6.661 -0.000 1.00 0.00 C
+ATOM 35 C ALA A 4 11.706 6.515 0.000 1.00 0.00 C
+ATOM 36 O ALA A 4 12.232 5.403 0.000 1.00 0.00 O
+ATOM 37 CB ALA A 4 9.737 7.482 1.199 1.00 0.00 C
+ATOM 38 H ALA A 4 10.101 4.523 0.000 1.00 0.00 H
+ATOM 39 HA ALA A 4 9.904 7.184 -0.913 1.00 0.00 H
+ATOM 40 1HB ALA A 4 10.235 8.452 1.185 1.00 0.00 H
+ATOM 41 2HB ALA A 4 8.658 7.628 1.154 1.00 0.00 H
+ATOM 42 3HB ALA A 4 9.994 6.956 2.117 1.00 0.00 H
+ATOM 43 N ALA A 5 12.404 7.646 0.000 1.00 0.00 N
+ATOM 44 CA ALA A 5 13.862 7.646 0.000 1.00 0.00 C
+ATOM 45 C ALA A 5 14.413 9.066 0.000 1.00 0.00 C
+ATOM 46 O ALA A 5 13.655 10.036 -0.000 1.00 0.00 O
+ATOM 47 CB ALA A 5 14.392 6.873 -1.199 1.00 0.00 C
+ATOM 48 H ALA A 5 11.912 8.528 -0.000 1.00 0.00 H
+ATOM 49 HA ALA A 5 14.201 7.156 0.913 1.00 0.00 H
+ATOM 50 1HB ALA A 5 15.482 6.882 -1.185 1.00 0.00 H
+ATOM 51 2HB ALA A 5 14.037 5.843 -1.154 1.00 0.00 H
+ATOM 52 3HB ALA A 5 14.037 7.339 -2.117 1.00 0.00 H
+ATOM 53 N ALA A 6 15.737 9.182 0.000 1.00 0.00 N
+ATOM 54 CA ALA A 6 16.392 10.484 -0.000 1.00 0.00 C
+ATOM 55 C ALA A 6 17.908 10.338 0.000 1.00 0.00 C
+ATOM 56 O ALA A 6 18.434 9.226 0.000 1.00 0.00 O
+ATOM 57 CB ALA A 6 15.939 11.305 1.199 1.00 0.00 C
+ATOM 58 H ALA A 6 16.303 8.346 0.000 1.00 0.00 H
+ATOM 59 HA ALA A 6 16.106 11.007 -0.913 1.00 0.00 H
+ATOM 60 1HB ALA A 6 16.437 12.275 1.185 1.00 0.00 H
+ATOM 61 2HB ALA A 6 14.860 11.451 1.154 1.00 0.00 H
+ATOM 62 3HB ALA A 6 16.196 10.779 2.117 1.00 0.00 H
+ATOM 63 N ALA A 7 18.606 11.469 0.000 1.00 0.00 N
+ATOM 64 CA ALA A 7 20.064 11.469 0.000 1.00 0.00 C
+ATOM 65 C ALA A 7 20.615 12.889 0.000 1.00 0.00 C
+ATOM 66 O ALA A 7 19.857 13.859 -0.000 1.00 0.00 O
+ATOM 67 CB ALA A 7 20.594 10.696 -1.199 1.00 0.00 C
+ATOM 68 H ALA A 7 18.114 12.351 -0.000 1.00 0.00 H
+ATOM 69 HA ALA A 7 20.403 10.979 0.913 1.00 0.00 H
+ATOM 70 1HB ALA A 7 21.684 10.705 -1.185 1.00 0.00 H
+ATOM 71 2HB ALA A 7 20.239 9.666 -1.154 1.00 0.00 H
+ATOM 72 3HB ALA A 7 20.239 11.162 -2.117 1.00 0.00 H
+ATOM 73 N ALA A 8 21.939 13.005 0.000 1.00 0.00 N
+ATOM 74 CA ALA A 8 22.594 14.307 -0.000 1.00 0.00 C
+ATOM 75 C ALA A 8 24.110 14.161 0.000 1.00 0.00 C
+ATOM 76 O ALA A 8 24.636 13.048 0.000 1.00 0.00 O
+ATOM 77 CB ALA A 8 22.141 15.128 1.199 1.00 0.00 C
+ATOM 78 H ALA A 8 22.506 12.169 0.000 1.00 0.00 H
+ATOM 79 HA ALA A 8 22.308 14.830 -0.913 1.00 0.00 H
+ATOM 80 1HB ALA A 8 22.639 16.098 1.185 1.00 0.00 H
+ATOM 81 2HB ALA A 8 21.062 15.274 1.154 1.00 0.00 H
+ATOM 82 3HB ALA A 8 22.398 14.602 2.117 1.00 0.00 H
+ATOM 83 N ALA A 9 24.808 15.292 0.000 1.00 0.00 N
+ATOM 84 CA ALA A 9 26.266 15.292 0.000 1.00 0.00 C
+ATOM 85 C ALA A 9 26.817 16.712 0.000 1.00 0.00 C
+ATOM 86 O ALA A 9 26.059 17.682 -0.000 1.00 0.00 O
+ATOM 87 CB ALA A 9 26.796 14.519 -1.199 1.00 0.00 C
+ATOM 88 H ALA A 9 24.316 16.174 -0.000 1.00 0.00 H
+ATOM 89 HA ALA A 9 26.605 14.802 0.913 1.00 0.00 H
+ATOM 90 1HB ALA A 9 27.886 14.528 -1.185 1.00 0.00 H
+ATOM 91 2HB ALA A 9 26.441 13.489 -1.154 1.00 0.00 H
+ATOM 92 3HB ALA A 9 26.441 14.985 -2.117 1.00 0.00 H
+ATOM 93 N ALA A 10 28.141 16.828 0.000 1.00 0.00 N
+ATOM 94 CA ALA A 10 28.796 18.130 -0.000 1.00 0.00 C
+ATOM 95 C ALA A 10 30.312 17.984 0.000 1.00 0.00 C
+ATOM 96 O ALA A 10 30.892 17.747 -1.023 1.00 0.00 O
+ATOM 97 OXT ALA A 10 30.926 18.107 1.023 1.00 0.00 O
+ATOM 98 CB ALA A 10 28.343 18.951 1.199 1.00 0.00 C
+ATOM 99 H ALA A 10 28.708 15.992 0.000 1.00 0.00 H
+ATOM 100 HA ALA A 10 28.510 18.653 -0.913 1.00 0.00 H
+ATOM 101 1HB ALA A 10 28.841 19.921 1.185 1.00 0.00 H
+ATOM 102 2HB ALA A 10 27.264 19.096 1.154 1.00 0.00 H
+ATOM 103 3HB ALA A 10 28.600 18.425 2.117 1.00 0.00 H
+TER
diff --git a/3_Kinematics/data/example.pdb b/3_Kinematics/data/example.pdb
index 695673b..567838c 100644
--- a/3_Kinematics/data/example.pdb
+++ b/3_Kinematics/data/example.pdb
@@ -1,12 +1,12 @@
-HEADER 27-APR-21 XXXX
+HEADER 03-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 27-APR-21
+REMARK 220 DATE OF DATA COLLECTION : 03-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.26+release.b308454c455
ATOM 1 N LYS A 1 0.000 0.000 0.000 1.00 0.00 N
ATOM 2 CA LYS A 1 1.458 0.000 0.000 1.00 0.00 C
ATOM 3 C LYS A 1 2.009 1.420 0.000 1.00 0.00 C
diff --git a/3_Kinematics/data/example_5_1.pdb b/3_Kinematics/data/example_5_1.pdb
deleted file mode 100644
index e07a0f8..0000000
--- a/3_Kinematics/data/example_5_1.pdb
+++ /dev/null
@@ -1,92 +0,0 @@
-HEADER 26-APR-21 XXXX
-EXPDTA THEORETICAL MODEL
-REMARK 220
-REMARK 220 EXPERIMENTAL DETAILS
-REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 26-APR-21
-REMARK 220
-REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
-ATOM 1 N LYS A 1 0.000 0.000 0.000 1.00 0.00 N
-ATOM 2 CA LYS A 1 1.458 0.000 0.000 1.00 0.00 C
-ATOM 3 C LYS A 1 2.009 1.420 0.000 1.00 0.00 C
-ATOM 4 O LYS A 1 1.251 2.390 -0.000 1.00 0.00 O
-ATOM 5 CB LYS A 1 1.994 -0.772 -1.207 1.00 0.00 C
-ATOM 6 CG LYS A 1 0.915 -1.351 -2.113 1.00 0.00 C
-ATOM 7 CD LYS A 1 -0.477 -1.020 -1.595 1.00 0.00 C
-ATOM 8 CE LYS A 1 -0.412 -0.201 -0.315 1.00 0.00 C
-ATOM 9 NZ LYS A 1 0.990 0.067 0.105 1.00 0.00 N
-ATOM 10 1H LYS A 1 -0.334 -0.943 -0.000 1.00 0.00 H
-ATOM 11 2H LYS A 1 -0.334 0.471 0.816 1.00 0.00 H
-ATOM 12 3H LYS A 1 -0.334 0.471 -0.816 1.00 0.00 H
-ATOM 13 HA LYS A 1 1.804 -0.492 0.910 1.00 0.00 H
-ATOM 14 1HB LYS A 1 2.620 -0.114 -1.811 1.00 0.00 H
-ATOM 15 2HB LYS A 1 2.620 -1.596 -0.863 1.00 0.00 H
-ATOM 16 1HG LYS A 1 1.026 -0.943 -3.118 1.00 0.00 H
-ATOM 17 2HG LYS A 1 1.026 -2.434 -2.164 1.00 0.00 H
-ATOM 18 1HD LYS A 1 -1.022 -0.454 -2.352 1.00 0.00 H
-ATOM 19 2HD LYS A 1 -1.021 -1.944 -1.397 1.00 0.00 H
-ATOM 20 1HE LYS A 1 -0.922 0.750 -0.465 1.00 0.00 H
-ATOM 21 2HE LYS A 1 -0.921 -0.738 0.486 1.00 0.00 H
-ATOM 22 1HZ LYS A 1 0.990 0.611 0.956 1.00 0.00 H
-ATOM 23 2HZ LYS A 1 1.467 -0.809 0.265 1.00 0.00 H
-ATOM 24 3HZ LYS A 1 1.467 0.581 -0.622 1.00 0.00 H
-ATOM 25 N PRO A 2 3.332 1.536 0.000 1.00 0.00 N
-ATOM 26 CA PRO A 2 3.988 2.839 0.000 1.00 0.00 C
-ATOM 27 C PRO A 2 5.504 2.693 0.000 1.00 0.00 C
-ATOM 28 O PRO A 2 6.030 1.580 0.000 1.00 0.00 O
-ATOM 29 CB PRO A 2 3.482 3.479 1.297 1.00 0.00 C
-ATOM 30 CG PRO A 2 3.249 2.323 2.209 1.00 0.00 C
-ATOM 31 CD PRO A 2 2.790 1.215 1.299 1.00 0.00 C
-ATOM 32 HA PRO A 2 3.654 3.411 -0.878 1.00 0.00 H
-ATOM 33 1HB PRO A 2 4.231 4.185 1.685 1.00 0.00 H
-ATOM 34 2HB PRO A 2 2.567 4.057 1.099 1.00 0.00 H
-ATOM 35 1HG PRO A 2 4.175 2.072 2.748 1.00 0.00 H
-ATOM 36 2HG PRO A 2 2.499 2.584 2.970 1.00 0.00 H
-ATOM 37 1HD PRO A 2 3.190 0.255 1.659 1.00 0.00 H
-ATOM 38 2HD PRO A 2 1.691 1.192 1.273 1.00 0.00 H
-ATOM 39 N ALA A 3 6.202 3.823 0.000 1.00 0.00 N
-ATOM 40 CA ALA A 3 7.660 3.823 0.000 1.00 0.00 C
-ATOM 41 C ALA A 3 8.211 5.243 0.000 1.00 0.00 C
-ATOM 42 O ALA A 3 7.453 6.213 -0.000 1.00 0.00 O
-ATOM 43 CB ALA A 3 8.190 3.050 -1.199 1.00 0.00 C
-ATOM 44 H ALA A 3 5.710 4.705 -0.000 1.00 0.00 H
-ATOM 45 HA ALA A 3 7.999 3.333 0.913 1.00 0.00 H
-ATOM 46 1HB ALA A 3 9.280 3.059 -1.185 1.00 0.00 H
-ATOM 47 2HB ALA A 3 7.835 2.021 -1.154 1.00 0.00 H
-ATOM 48 3HB ALA A 3 7.835 3.516 -2.117 1.00 0.00 H
-ATOM 49 N LEU A 4 9.534 5.359 0.000 1.00 0.00 N
-ATOM 50 CA LEU A 4 10.190 6.661 -0.000 1.00 0.00 C
-ATOM 51 C LEU A 4 11.706 6.515 0.000 1.00 0.00 C
-ATOM 52 O LEU A 4 12.232 5.403 0.000 1.00 0.00 O
-ATOM 53 CB LEU A 4 9.748 7.477 1.222 1.00 0.00 C
-ATOM 54 CG LEU A 4 8.748 6.785 2.157 1.00 0.00 C
-ATOM 55 CD1 LEU A 4 8.425 5.397 1.620 1.00 0.00 C
-ATOM 56 CD2 LEU A 4 9.336 6.705 3.559 1.00 0.00 C
-ATOM 57 H LEU A 4 10.101 4.523 0.000 1.00 0.00 H
-ATOM 58 HA LEU A 4 9.896 7.196 -0.903 1.00 0.00 H
-ATOM 59 1HB LEU A 4 10.630 7.729 1.808 1.00 0.00 H
-ATOM 60 2HB LEU A 4 9.291 8.403 0.875 1.00 0.00 H
-ATOM 61 HG LEU A 4 7.820 7.356 2.185 1.00 0.00 H
-ATOM 62 1HD1 LEU A 4 7.715 4.906 2.284 1.00 0.00 H
-ATOM 63 2HD1 LEU A 4 7.989 5.485 0.625 1.00 0.00 H
-ATOM 64 3HD1 LEU A 4 9.339 4.807 1.565 1.00 0.00 H
-ATOM 65 1HD2 LEU A 4 8.625 6.214 4.224 1.00 0.00 H
-ATOM 66 2HD2 LEU A 4 10.263 6.133 3.533 1.00 0.00 H
-ATOM 67 3HD2 LEU A 4 9.540 7.711 3.925 1.00 0.00 H
-ATOM 68 N ASN A 5 12.404 7.646 0.000 1.00 0.00 N
-ATOM 69 CA ASN A 5 13.862 7.646 0.000 1.00 0.00 C
-ATOM 70 C ASN A 5 14.413 9.066 0.000 1.00 0.00 C
-ATOM 71 O ASN A 5 14.462 9.691 1.023 1.00 0.00 O
-ATOM 72 OXT ASN A 5 14.798 9.560 -1.023 1.00 0.00 O
-ATOM 73 CB ASN A 5 14.396 6.866 -1.187 1.00 0.00 C
-ATOM 74 CG ASN A 5 13.300 6.301 -2.048 1.00 0.00 C
-ATOM 75 OD1 ASN A 5 12.112 6.488 -1.763 1.00 0.00 O
-ATOM 76 ND2 ASN A 5 13.676 5.613 -3.095 1.00 0.00 N
-ATOM 77 H ASN A 5 11.912 8.528 -0.000 1.00 0.00 H
-ATOM 78 HA ASN A 5 14.208 7.165 0.916 1.00 0.00 H
-ATOM 79 1HB ASN A 5 15.023 7.517 -1.798 1.00 0.00 H
-ATOM 80 2HB ASN A 5 15.022 6.047 -0.833 1.00 0.00 H
-ATOM 81 1HD2 ASN A 5 12.990 5.213 -3.704 1.00 0.00 H
-ATOM 82 2HD2 ASN A 5 14.649 5.486 -3.287 1.00 0.00 H
-TER
diff --git a/3_Kinematics/data/example_5_1_change.pdb b/3_Kinematics/data/example_5_1_change.pdb
deleted file mode 100644
index e8c3d39..0000000
--- a/3_Kinematics/data/example_5_1_change.pdb
+++ /dev/null
@@ -1,92 +0,0 @@
-HEADER 27-APR-21 XXXX
-EXPDTA THEORETICAL MODEL
-REMARK 220
-REMARK 220 EXPERIMENTAL DETAILS
-REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 27-APR-21
-REMARK 220
-REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
-ATOM 1 N LYS A 1 0.000 5.131 -3.592 1.00 0.00 N
-ATOM 2 CA LYS A 1 1.458 5.131 -3.592 1.00 0.00 C
-ATOM 3 C LYS A 1 2.009 4.645 -2.258 1.00 0.00 C
-ATOM 4 O LYS A 1 1.251 4.313 -1.346 1.00 0.00 O
-ATOM 5 CB LYS A 1 1.994 6.529 -3.905 1.00 0.00 C
-ATOM 6 CG LYS A 1 0.915 7.578 -4.139 1.00 0.00 C
-ATOM 7 CD LYS A 1 -0.477 6.979 -4.006 1.00 0.00 C
-ATOM 8 CE LYS A 1 -0.412 5.495 -3.674 1.00 0.00 C
-ATOM 9 NZ LYS A 1 0.990 5.009 -3.565 1.00 0.00 N
-ATOM 10 1H LYS A 1 -0.334 5.453 -4.478 1.00 0.00 H
-ATOM 11 2H LYS A 1 -0.334 4.202 -3.429 1.00 0.00 H
-ATOM 12 3H LYS A 1 -0.334 5.736 -2.870 1.00 0.00 H
-ATOM 13 HA LYS A 1 1.804 4.444 -4.366 1.00 0.00 H
-ATOM 14 1HB LYS A 1 2.620 6.871 -3.081 1.00 0.00 H
-ATOM 15 2HB LYS A 1 2.620 6.488 -4.796 1.00 0.00 H
-ATOM 16 1HG LYS A 1 1.026 8.383 -3.412 1.00 0.00 H
-ATOM 17 2HG LYS A 1 1.026 7.997 -5.139 1.00 0.00 H
-ATOM 18 1HD LYS A 1 -1.022 7.496 -3.214 1.00 0.00 H
-ATOM 19 2HD LYS A 1 -1.021 7.108 -4.941 1.00 0.00 H
-ATOM 20 1HE LYS A 1 -0.922 5.311 -2.729 1.00 0.00 H
-ATOM 21 2HE LYS A 1 -0.921 4.926 -4.452 1.00 0.00 H
-ATOM 22 1HZ LYS A 1 0.990 4.023 -3.345 1.00 0.00 H
-ATOM 23 2HZ LYS A 1 1.467 5.158 -4.444 1.00 0.00 H
-ATOM 24 3HZ LYS A 1 1.467 5.517 -2.834 1.00 0.00 H
-ATOM 25 N PRO A 2 3.332 4.605 -2.149 1.00 0.00 N
-ATOM 26 CA PRO A 2 3.988 4.160 -0.925 1.00 0.00 C
-ATOM 27 C PRO A 2 5.504 4.210 -1.062 1.00 0.00 C
-ATOM 28 O PRO A 2 6.030 4.590 -2.108 1.00 0.00 O
-ATOM 29 CB PRO A 2 3.482 2.722 -0.767 1.00 0.00 C
-ATOM 30 CG PRO A 2 3.249 2.261 -2.165 1.00 0.00 C
-ATOM 31 CD PRO A 2 2.790 3.495 -2.895 1.00 0.00 C
-ATOM 32 HA PRO A 2 3.654 4.789 -0.087 1.00 0.00 H
-ATOM 33 1HB PRO A 2 4.231 2.116 -0.236 1.00 0.00 H
-ATOM 34 2HB PRO A 2 2.567 2.710 -0.156 1.00 0.00 H
-ATOM 35 1HG PRO A 2 4.175 1.840 -2.585 1.00 0.00 H
-ATOM 36 2HG PRO A 2 2.499 1.456 -2.180 1.00 0.00 H
-ATOM 37 1HD PRO A 2 3.190 3.485 -3.920 1.00 0.00 H
-ATOM 38 2HD PRO A 2 1.691 3.526 -2.908 1.00 0.00 H
-ATOM 39 N ALA A 3 6.202 3.823 0.000 1.00 0.00 N
-ATOM 40 CA ALA A 3 7.660 3.823 0.000 1.00 0.00 C
-ATOM 41 C ALA A 3 8.211 5.243 0.000 1.00 0.00 C
-ATOM 42 O ALA A 3 7.453 6.213 -0.000 1.00 0.00 O
-ATOM 43 CB ALA A 3 8.190 3.050 -1.199 1.00 0.00 C
-ATOM 44 H ALA A 3 5.710 3.521 0.829 1.00 0.00 H
-ATOM 45 HA ALA A 3 7.999 3.333 0.913 1.00 0.00 H
-ATOM 46 1HB ALA A 3 9.280 3.059 -1.185 1.00 0.00 H
-ATOM 47 2HB ALA A 3 7.835 2.021 -1.154 1.00 0.00 H
-ATOM 48 3HB ALA A 3 7.835 3.516 -2.117 1.00 0.00 H
-ATOM 49 N LEU A 4 9.534 5.359 0.000 1.00 0.00 N
-ATOM 50 CA LEU A 4 10.190 6.661 -0.000 1.00 0.00 C
-ATOM 51 C LEU A 4 11.706 6.515 0.000 1.00 0.00 C
-ATOM 52 O LEU A 4 12.232 5.403 0.000 1.00 0.00 O
-ATOM 53 CB LEU A 4 9.748 7.477 1.222 1.00 0.00 C
-ATOM 54 CG LEU A 4 8.748 6.785 2.157 1.00 0.00 C
-ATOM 55 CD1 LEU A 4 8.425 5.397 1.620 1.00 0.00 C
-ATOM 56 CD2 LEU A 4 9.336 6.705 3.559 1.00 0.00 C
-ATOM 57 H LEU A 4 10.101 4.523 0.000 1.00 0.00 H
-ATOM 58 HA LEU A 4 9.896 7.196 -0.903 1.00 0.00 H
-ATOM 59 1HB LEU A 4 10.630 7.729 1.808 1.00 0.00 H
-ATOM 60 2HB LEU A 4 9.291 8.403 0.875 1.00 0.00 H
-ATOM 61 HG LEU A 4 7.820 7.356 2.185 1.00 0.00 H
-ATOM 62 1HD1 LEU A 4 7.715 4.906 2.284 1.00 0.00 H
-ATOM 63 2HD1 LEU A 4 7.989 5.485 0.625 1.00 0.00 H
-ATOM 64 3HD1 LEU A 4 9.339 4.807 1.565 1.00 0.00 H
-ATOM 65 1HD2 LEU A 4 8.625 6.214 4.224 1.00 0.00 H
-ATOM 66 2HD2 LEU A 4 10.263 6.133 3.533 1.00 0.00 H
-ATOM 67 3HD2 LEU A 4 9.540 7.711 3.925 1.00 0.00 H
-ATOM 68 N ASN A 5 12.404 7.646 0.000 1.00 0.00 N
-ATOM 69 CA ASN A 5 13.862 7.646 0.000 1.00 0.00 C
-ATOM 70 C ASN A 5 14.413 9.066 0.000 1.00 0.00 C
-ATOM 71 O ASN A 5 14.462 9.691 1.023 1.00 0.00 O
-ATOM 72 OXT ASN A 5 14.798 9.560 -1.023 1.00 0.00 O
-ATOM 73 CB ASN A 5 14.396 6.866 -1.187 1.00 0.00 C
-ATOM 74 CG ASN A 5 13.300 6.301 -2.048 1.00 0.00 C
-ATOM 75 OD1 ASN A 5 12.112 6.488 -1.763 1.00 0.00 O
-ATOM 76 ND2 ASN A 5 13.676 5.613 -3.095 1.00 0.00 N
-ATOM 77 H ASN A 5 11.912 8.528 -0.000 1.00 0.00 H
-ATOM 78 HA ASN A 5 14.208 7.165 0.916 1.00 0.00 H
-ATOM 79 1HB ASN A 5 15.023 7.517 -1.798 1.00 0.00 H
-ATOM 80 2HB ASN A 5 15.022 6.047 -0.833 1.00 0.00 H
-ATOM 81 1HD2 ASN A 5 12.990 5.213 -3.704 1.00 0.00 H
-ATOM 82 2HD2 ASN A 5 14.649 5.486 -3.287 1.00 0.00 H
-TER
diff --git a/3_Kinematics/data/example_change.pdb b/3_Kinematics/data/example_change.pdb
index 1896a7c..f26f708 100644
--- a/3_Kinematics/data/example_change.pdb
+++ b/3_Kinematics/data/example_change.pdb
@@ -1,12 +1,12 @@
-HEADER 27-APR-21 XXXX
+HEADER 03-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 27-APR-21
+REMARK 220 DATE OF DATA COLLECTION : 03-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.26+release.b308454c455
ATOM 1 N LYS A 1 0.000 0.000 0.000 1.00 0.00 N
ATOM 2 CA LYS A 1 1.458 0.000 0.000 1.00 0.00 C
ATOM 3 C LYS A 1 2.009 1.420 0.000 1.00 0.00 C
diff --git a/3_Kinematics/imgs/.DS_Store b/3_Kinematics/imgs/.DS_Store
index 5008ddf..005d25f 100644
Binary files a/3_Kinematics/imgs/.DS_Store and b/3_Kinematics/imgs/.DS_Store differ
diff --git a/3_Kinematics/imgs/cut_chage_phi.jpg b/3_Kinematics/imgs/cut_chage_phi.jpg
new file mode 100644
index 0000000..dbe3ab2
Binary files /dev/null and b/3_Kinematics/imgs/cut_chage_phi.jpg differ
diff --git a/3_Kinematics/imgs/foldtree.jpg b/3_Kinematics/imgs/foldtree.jpg
deleted file mode 100644
index d1ba217..0000000
Binary files a/3_Kinematics/imgs/foldtree.jpg and /dev/null differ
diff --git a/3_Kinematics/imgs/more_foldtree.jpg b/3_Kinematics/imgs/more_foldtree.jpg
new file mode 100644
index 0000000..90b5af8
Binary files /dev/null and b/3_Kinematics/imgs/more_foldtree.jpg differ
diff --git a/3_Kinematics/imgs/phi_change.jpg b/3_Kinematics/imgs/phi_change.jpg
new file mode 100644
index 0000000..709fc23
Binary files /dev/null and b/3_Kinematics/imgs/phi_change.jpg differ
diff --git a/3_Kinematics/imgs/phi_change.png b/3_Kinematics/imgs/phi_change.png
deleted file mode 100644
index 650d0c1..0000000
Binary files a/3_Kinematics/imgs/phi_change.png and /dev/null differ
diff --git a/3_Kinematics/imgs/set_cutpoint.jpg b/3_Kinematics/imgs/set_cutpoint.jpg
new file mode 100644
index 0000000..cb94bdf
Binary files /dev/null and b/3_Kinematics/imgs/set_cutpoint.jpg differ
diff --git a/3_Kinematics/imgs/set_jump.jpg b/3_Kinematics/imgs/set_jump.jpg
new file mode 100644
index 0000000..d05b96d
Binary files /dev/null and b/3_Kinematics/imgs/set_jump.jpg differ
diff --git a/3_Kinematics/imgs/two_jump2.jpg b/3_Kinematics/imgs/two_jump2.jpg
new file mode 100644
index 0000000..2aa51f3
Binary files /dev/null and b/3_Kinematics/imgs/two_jump2.jpg differ
diff --git a/4_MCMC/.ipynb_checkpoints/4_0_Metropolis_Monte_Carlo-checkpoint.ipynb b/4_MCMC/.ipynb_checkpoints/4_0_Metropolis_Monte_Carlo-checkpoint.ipynb
index 6f1db2a..59f6984 100644
--- a/4_MCMC/.ipynb_checkpoints/4_0_Metropolis_Monte_Carlo-checkpoint.ipynb
+++ b/4_MCMC/.ipynb_checkpoints/4_0_Metropolis_Monte_Carlo-checkpoint.ipynb
@@ -2,10 +2,10 @@
"cells": [
{
"cell_type": "markdown",
- "id": "limited-surrey",
+ "id": "c04a3ab0-5a64-4cfe-a241-33b60e20b668",
"metadata": {},
"source": [
- "## Rosetta & Metropolis Monte Carlo\n",
+ "## Metropolis Monte Carlo in Rosetta\n",
"\n",
"@Author: 吴炜坤\n",
"\n",
@@ -14,548 +14,158 @@
},
{
"cell_type": "markdown",
- "id": "cellular-amazon",
+ "id": "0b9d87e0-b27f-4649-b716-89884b716b11",
"metadata": {},
"source": [
- "在Rosetta中，蛋白质的构象采样使用的是梅特罗波利斯算法（Metropolis algorithm），Metropolis算法属于马尔可夫链蒙特卡罗算法的一种改进版本。本章节中，将从构象空间到马尔科夫链“细致平衡”的逐一进行介绍，尽可能以通俗易懂的方式来帮助同学们理解Metropolis算法。"
+ "在Rosetta中，具体如何对蛋白质的构象进行采样和优化的呢？这种简短章节将会介绍Metropolis算法的工作方式，以便于初学者理解计算的过程。\n",
+ "如果读者想进一步了解更多细节可以查看本章节下的延展阅读。"
]
},
{
"cell_type": "markdown",
- "id": "moderate-discipline",
+ "id": "8da28aff-465e-45b0-9821-b5a93701131a",
"metadata": {},
"source": [
- "### 一、构象空间与状态概率\n",
- "蛋白质通常是一条(或多条)由N个氨基酸组成的多肽链，现在假定这个多肽都是由丙氨酸组成，因此只需要考虑它的主链二面角(2N-2个自由度)变化既能描述这个蛋白质的构象变化。此处为了方便可视化，只考虑2个丙氨酸组成的主链构象空间。此时刻画出来就是一张有边界的二维分布图(如下)。其中绿色的点代表不同骨架状态，这些所有可能存在的构象(微观态)就共同组成了这个多肽结构的构象空间(相空间)。\n",
- "\n",
- "
\n",
+ "(图片来源: Leman J K, Weitzner B D, Lewis S M, et al. Macromolecular modeling and design in Rosetta: recent methods and frameworks[J]. Nature methods, 2020, 17(7): 665-680.)"
]
},
{
@@ -269,13 +292,14 @@
"在之前的章节中，我们提及过Rosetta中Pose有两种原子模型以及有粗粒化的打分函数。在粗粒化的原子模型和力场下，蛋白折叠的能量面平滑了许多，让我们对主链构象的搜索有了更大的移动空间。\n",
"\n",
"
\n",
+ "(图片来源: Leman J K, Weitzner B D, Lewis S M, et al. Macromolecular modeling and design in Rosetta: recent methods and frameworks[J]. Nature methods, 2020, 17(7): 665-680.)"
]
},
{
@@ -269,13 +292,14 @@
"在之前的章节中，我们提及过Rosetta中Pose有两种原子模型以及有粗粒化的打分函数。在粗粒化的原子模型和力场下，蛋白折叠的能量面平滑了许多，让我们对主链构象的搜索有了更大的移动空间。\n",
"\n",
"
\n",
+ "(图片来源: Leman J K, Weitzner B D, Lewis S M, et al. Macromolecular modeling and design in Rosetta: recent methods and frameworks[J]. Nature methods, 2020, 17(7): 665-680.)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "sensitive-moscow",
+ "metadata": {},
+ "source": [
+ "#### 课后习题: \n",
+ "1. 尝试利用丙氨基酸二肽作为初始结构，使用Metropolis+Minimization进行构象搜索，观察所得到的的构象分布情况是否有变化？\n",
+ "2. 使用模拟退火的方法进行构象搜索，观察所得到的的构象分布情况是否有变化？"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "id": "placed-jimmy",
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ }
+ ],
+ "metadata": {
+ "kernelspec": {
+ "display_name": "Python 3",
+ "language": "python",
+ "name": "python3"
+ },
+ "language_info": {
+ "codemirror_mode": {
+ "name": "ipython",
+ "version": 3
+ },
+ "file_extension": ".py",
+ "mimetype": "text/x-python",
+ "name": "python",
+ "nbconvert_exporter": "python",
+ "pygments_lexer": "ipython3",
+ "version": "3.7.10"
+ }
+ },
+ "nbformat": 4,
+ "nbformat_minor": 5
+}
diff --git a/4_MCMC/data/centroid_mcmc.pdb b/4_MCMC/data/centroid_mcmc.pdb
new file mode 100644
index 0000000..2c03d50
--- /dev/null
+++ b/4_MCMC/data/centroid_mcmc.pdb
@@ -0,0 +1,152 @@
+HEADER 03-AUG-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 03-AUG-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.26+release.b308454c455
+ATOM 1 N SER A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA SER A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C SER A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O SER A 1 1.438 2.318 -0.619 1.00 0.00 O
+ATOM 5 CB SER A 1 1.980 -0.769 -1.198 1.00 0.00 C
+ATOM 6 CEN SER A 1 2.005 -0.963 -1.706 1.00 0.00 X
+ATOM 7 H SER A 1 -0.500 -0.433 -0.750 1.00 0.00 H
+ATOM 8 N ALA A 2 3.122 1.618 0.698 1.00 0.00 N
+ATOM 9 CA ALA A 2 3.753 2.930 0.780 1.00 0.00 C
+ATOM 10 C ALA A 2 4.459 3.285 -0.522 1.00 0.00 C
+ATOM 11 O ALA A 2 4.564 4.457 -0.883 1.00 0.00 O
+ATOM 12 CB ALA A 2 4.730 2.977 1.946 1.00 0.00 C
+ATOM 13 CEN ALA A 2 4.730 2.977 1.944 1.00 0.00 X
+ATOM 14 H ALA A 2 3.542 0.839 1.184 1.00 0.00 H
+ATOM 15 N ALA A 3 4.941 2.266 -1.224 1.00 0.00 N
+ATOM 16 CA ALA A 3 5.639 2.468 -2.488 1.00 0.00 C
+ATOM 17 C ALA A 3 5.686 3.944 -2.862 1.00 0.00 C
+ATOM 18 O ALA A 3 5.052 4.371 -3.827 1.00 0.00 O
+ATOM 19 CB ALA A 3 4.976 1.659 -3.594 1.00 0.00 C
+ATOM 20 CEN ALA A 3 4.977 1.660 -3.594 1.00 0.00 X
+ATOM 21 H ALA A 3 4.822 1.326 -0.873 1.00 0.00 H
+ATOM 22 N GLU A 4 6.440 4.720 -2.091 1.00 0.00 N
+ATOM 23 CA GLU A 4 6.572 6.151 -2.339 1.00 0.00 C
+ATOM 24 C GLU A 4 5.551 6.946 -1.536 1.00 0.00 C
+ATOM 25 O GLU A 4 5.760 7.230 -0.357 1.00 0.00 O
+ATOM 26 CB GLU A 4 6.417 6.452 -3.831 1.00 0.00 C
+ATOM 27 CEN GLU A 4 7.113 6.779 -5.352 1.00 0.00 X
+ATOM 28 H GLU A 4 6.935 4.308 -1.313 1.00 0.00 H
+ATOM 29 N ALA A 5 4.446 7.303 -2.182 1.00 0.00 N
+ATOM 30 CA ALA A 5 3.390 8.067 -1.529 1.00 0.00 C
+ATOM 31 C ALA A 5 2.012 7.579 -1.957 1.00 0.00 C
+ATOM 32 O ALA A 5 1.709 7.513 -3.148 1.00 0.00 O
+ATOM 33 CB ALA A 5 3.547 9.551 -1.828 1.00 0.00 C
+ATOM 34 CEN ALA A 5 3.546 9.550 -1.828 1.00 0.00 X
+ATOM 35 H ALA A 5 4.335 7.039 -3.151 1.00 0.00 H
+ATOM 36 N TYR A 6 1.180 7.239 -0.978 1.00 0.00 N
+ATOM 37 CA TYR A 6 -0.168 6.756 -1.252 1.00 0.00 C
+ATOM 38 C TYR A 6 -0.144 5.560 -2.194 1.00 0.00 C
+ATOM 39 O TYR A 6 0.921 5.110 -2.614 1.00 0.00 O
+ATOM 40 CB TYR A 6 -1.027 7.875 -1.845 1.00 0.00 C
+ATOM 41 CEN TYR A 6 -2.248 9.037 -1.366 1.00 0.00 X
+ATOM 42 H TYR A 6 1.490 7.316 -0.021 1.00 0.00 H
+ATOM 43 N ALA A 7 -1.326 5.050 -2.524 1.00 0.00 N
+ATOM 44 CA ALA A 7 -1.443 3.904 -3.418 1.00 0.00 C
+ATOM 45 C ALA A 7 -0.938 4.242 -4.815 1.00 0.00 C
+ATOM 46 O ALA A 7 -1.111 5.363 -5.293 1.00 0.00 O
+ATOM 47 CB ALA A 7 -2.885 3.421 -3.474 1.00 0.00 C
+ATOM 48 CEN ALA A 7 -2.884 3.421 -3.475 1.00 0.00 X
+ATOM 49 H ALA A 7 -2.165 5.466 -2.145 1.00 0.00 H
+ATOM 50 N LYS A 8 -0.314 3.265 -5.465 1.00 0.00 N
+ATOM 51 CA LYS A 8 0.217 3.457 -6.809 1.00 0.00 C
+ATOM 52 C LYS A 8 -0.430 2.498 -7.799 1.00 0.00 C
+ATOM 53 O LYS A 8 -0.372 2.709 -9.011 1.00 0.00 O
+ATOM 54 CB LYS A 8 1.736 3.274 -6.816 1.00 0.00 C
+ATOM 55 CEN LYS A 8 3.663 4.144 -6.884 1.00 0.00 X
+ATOM 56 H LYS A 8 -0.204 2.367 -5.017 1.00 0.00 H
+ATOM 57 N ARG A 9 -1.048 1.444 -7.277 1.00 0.00 N
+ATOM 58 CA ARG A 9 -1.708 0.450 -8.115 1.00 0.00 C
+ATOM 59 C ARG A 9 -1.175 0.490 -9.541 1.00 0.00 C
+ATOM 60 O ARG A 9 -0.026 0.867 -9.774 1.00 0.00 O
+ATOM 61 CB ARG A 9 -3.223 0.588 -8.083 1.00 0.00 C
+ATOM 62 CEN ARG A 9 -5.594 0.221 -7.453 1.00 0.00 X
+ATOM 63 H ARG A 9 -1.060 1.328 -6.273 1.00 0.00 H
+ATOM 64 N ILE A 10 -2.015 0.099 -10.493 1.00 0.00 N
+ATOM 65 CA ILE A 10 -1.629 0.089 -11.899 1.00 0.00 C
+ATOM 66 C ILE A 10 -1.299 -1.321 -12.369 1.00 0.00 C
+ATOM 67 O ILE A 10 -0.767 -2.131 -11.609 1.00 0.00 O
+ATOM 68 CB ILE A 10 -0.419 1.004 -12.159 1.00 0.00 C
+ATOM 69 CEN ILE A 10 -0.102 2.025 -12.373 1.00 0.00 X
+ATOM 70 H ILE A 10 -2.945 -0.200 -10.236 1.00 0.00 H
+ATOM 71 N ALA A 11 -1.616 -1.609 -13.627 1.00 0.00 N
+ATOM 72 CA ALA A 11 -1.353 -2.923 -14.202 1.00 0.00 C
+ATOM 73 C ALA A 11 -1.341 -4.002 -13.127 1.00 0.00 C
+ATOM 74 O ALA A 11 -0.466 -4.868 -13.113 1.00 0.00 O
+ATOM 75 CB ALA A 11 -0.036 -2.914 -14.964 1.00 0.00 C
+ATOM 76 CEN ALA A 11 -0.037 -2.915 -14.963 1.00 0.00 X
+ATOM 77 H ALA A 11 -2.051 -0.900 -14.200 1.00 0.00 H
+ATOM 78 N GLU A 12 -2.317 -3.945 -12.227 1.00 0.00 N
+ATOM 79 CA GLU A 12 -2.420 -4.918 -11.146 1.00 0.00 C
+ATOM 80 C GLU A 12 -3.647 -4.654 -10.283 1.00 0.00 C
+ATOM 81 O GLU A 12 -4.781 -4.811 -10.734 1.00 0.00 O
+ATOM 82 CB GLU A 12 -1.156 -4.897 -10.284 1.00 0.00 C
+ATOM 83 CEN GLU A 12 0.358 -5.557 -9.868 1.00 0.00 X
+ATOM 84 H GLU A 12 -3.006 -3.209 -12.293 1.00 0.00 H
+ATOM 85 N ALA A 13 -3.412 -4.251 -9.038 1.00 0.00 N
+ATOM 86 CA ALA A 13 -4.498 -3.965 -8.108 1.00 0.00 C
+ATOM 87 C ALA A 13 -4.332 -2.589 -7.475 1.00 0.00 C
+ATOM 88 O ALA A 13 -3.344 -1.898 -7.720 1.00 0.00 O
+ATOM 89 CB ALA A 13 -4.574 -5.040 -7.035 1.00 0.00 C
+ATOM 90 CEN ALA A 13 -4.575 -5.039 -7.035 1.00 0.00 X
+ATOM 91 H ALA A 13 -2.457 -4.142 -8.728 1.00 0.00 H
+ATOM 92 N MET A 14 -5.305 -2.197 -6.659 1.00 0.00 N
+ATOM 93 CA MET A 14 -5.269 -0.904 -5.989 1.00 0.00 C
+ATOM 94 C MET A 14 -4.123 -0.834 -4.988 1.00 0.00 C
+ATOM 95 O MET A 14 -3.250 0.028 -5.088 1.00 0.00 O
+ATOM 96 CB MET A 14 -6.600 -0.635 -5.289 1.00 0.00 C
+ATOM 97 CEN MET A 14 -8.040 0.364 -5.369 1.00 0.00 X
+ATOM 98 H MET A 14 -6.091 -2.812 -6.499 1.00 0.00 H
+ATOM 99 N ALA A 15 -4.132 -1.747 -4.022 1.00 0.00 N
+ATOM 100 CA ALA A 15 -3.093 -1.790 -3.000 1.00 0.00 C
+ATOM 101 C ALA A 15 -3.083 -3.134 -2.282 1.00 0.00 C
+ATOM 102 O ALA A 15 -3.874 -4.023 -2.596 1.00 0.00 O
+ATOM 103 CB ALA A 15 -3.281 -0.655 -2.004 1.00 0.00 C
+ATOM 104 CEN ALA A 15 -3.281 -0.656 -2.004 1.00 0.00 X
+ATOM 105 H ALA A 15 -4.878 -2.428 -3.995 1.00 0.00 H
+ATOM 106 N LYS A 16 -2.182 -3.276 -1.315 1.00 0.00 N
+ATOM 107 CA LYS A 16 -2.067 -4.511 -0.551 1.00 0.00 C
+ATOM 108 C LYS A 16 -3.433 -5.008 -0.098 1.00 0.00 C
+ATOM 109 O LYS A 16 -4.454 -4.372 -0.360 1.00 0.00 O
+ATOM 110 CB LYS A 16 -1.153 -4.309 0.659 1.00 0.00 C
+ATOM 111 CEN LYS A 16 0.731 -4.606 1.574 1.00 0.00 X
+ATOM 112 H LYS A 16 -1.560 -2.508 -1.105 1.00 0.00 H
+ATOM 113 N GLY A 17 -3.446 -6.149 0.583 1.00 0.00 N
+ATOM 114 CA GLY A 17 -4.688 -6.734 1.074 1.00 0.00 C
+ATOM 115 C GLY A 17 -5.574 -7.193 -0.077 1.00 0.00 C
+ATOM 116 O GLY A 17 -5.354 -8.239 -0.623 1.00 0.00 O
+ATOM 117 CEN GLY A 17 -4.689 -6.734 1.074 1.00 0.00 X
+ATOM 118 H GLY A 17 -2.573 -6.623 0.766 1.00 0.00 H
+TER
+# All scores below are weighted scores, not raw scores.
+#BEGIN_POSE_ENERGIES_TABLE ./data/centroid_mcmc.pdb
+label vdw pair env cbeta total
+weights 1 1 1 1 NA
+pose 0.1118 0.06816 2.95965 6.67439 9.81401
+SER:NtermProteinFull_1 0 -0.08006 -0.44156 0.28039 -0.24122
+ALA_2 0 -0.00549 0.56855 0.52478 1.08784
+ALA_3 0 0.02375 0.8284 0.26859 1.12074
+GLU_4 0 0 -2.02607 0.3346 -1.69146
+ALA_5 0 0 1.55746 0.39653 1.95399
+TYR_6 0 0.03941 1.5936 0.5404 2.17341
+ALA_7 0 0.05647 0.33435 0.33746 0.72828
+LYS_8 0.05162 0 -1.37777 0.36141 -0.96475
+ARG_9 0.0559 0 -0.86534 0.28018 -0.52926
+ILE_10 0 0.00594 2.83791 0.57143 3.41527
+ALA_11 0 0 1.594 0.39653 1.99053
+GLU_12 0 0.03633 -2.06806 0.36693 -1.6648
+ALA_13 0.00429 0.05407 0.56855 0.37141 0.99831
+MET_14 0 -0.02717 -0.20533 0.37845 0.14595
+ALA_15 0 -0.09255 0.33435 0.2761 0.51789
+LYS_16 0 0.01468 -2.09855 0.38857 -1.6953
+GLY:CtermProteinFull_17 0 0.04278 1.82518 0.60064 2.46859
+#END_POSE_ENERGIES_TABLE ./data/centroid_mcmc.pdb
+
diff --git a/4_MCMC/data/prediction.pdb b/4_MCMC/data/prediction.pdb
index f7bfb9e..33b0365 100644
--- a/4_MCMC/data/prediction.pdb
+++ b/4_MCMC/data/prediction.pdb
@@ -1,489 +1,489 @@
-HEADER 23-APR-21 XXXX
+HEADER 03-AUG-21 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 23-APR-21
+REMARK 220 DATE OF DATA COLLECTION : 03-AUG-21
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.50+release.1295438cd4b
+REMARK 220 VERSION 2021.26+release.b308454c455
ATOM 1 N LEU A 1 0.000 0.000 0.000 1.00 0.00 N
ATOM 2 CA LEU A 1 1.458 0.000 0.000 1.00 0.00 C
ATOM 3 C LEU A 1 2.009 1.420 0.000 1.00 0.00 C
-ATOM 4 O LEU A 1 1.512 2.289 -0.716 1.00 0.00 O
+ATOM 4 O LEU A 1 1.357 2.349 -0.477 1.00 0.00 O
ATOM 5 CB LEU A 1 1.988 -0.778 -1.211 1.00 0.00 C
ATOM 6 CEN LEU A 1 2.608 -2.180 -1.363 1.00 0.00 X
ATOM 7 H LEU A 1 -0.500 -0.433 -0.750 1.00 0.00 H
-ATOM 8 N ARG A 2 3.039 1.650 0.808 1.00 0.00 N
-ATOM 9 CA ARG A 2 3.656 2.967 0.907 1.00 0.00 C
-ATOM 10 C ARG A 2 5.150 2.899 0.617 1.00 0.00 C
-ATOM 11 O ARG A 2 5.682 3.707 -0.144 1.00 0.00 O
-ATOM 12 CB ARG A 2 3.378 3.632 2.247 1.00 0.00 C
-ATOM 13 CEN ARG A 2 2.320 5.062 3.976 1.00 0.00 X
-ATOM 14 H ARG A 2 3.403 0.893 1.367 1.00 0.00 H
-ATOM 15 N THR A 3 5.822 1.930 1.229 1.00 0.00 N
-ATOM 16 CA THR A 3 7.279 1.880 1.213 1.00 0.00 C
-ATOM 17 C THR A 3 7.780 0.611 0.536 1.00 0.00 C
-ATOM 18 O THR A 3 8.627 0.665 -0.355 1.00 0.00 O
-ATOM 19 CB THR A 3 7.862 1.955 2.637 1.00 0.00 C
-ATOM 20 CEN THR A 3 7.934 2.227 3.149 1.00 0.00 X
-ATOM 21 H THR A 3 5.310 1.208 1.717 1.00 0.00 H
-ATOM 22 N ASN A 4 7.252 -0.530 0.965 1.00 0.00 N
-ATOM 23 CA ASN A 4 7.820 -1.822 0.600 1.00 0.00 C
-ATOM 24 C ASN A 4 6.737 -2.794 0.152 1.00 0.00 C
-ATOM 25 O ASN A 4 5.564 -2.630 0.489 1.00 0.00 O
-ATOM 26 CB ASN A 4 8.620 -2.419 1.743 1.00 0.00 C
-ATOM 27 CEN ASN A 4 9.615 -2.431 2.079 1.00 0.00 X
-ATOM 28 H ASN A 4 6.435 -0.502 1.558 1.00 0.00 H
-ATOM 29 N PHE A 5 7.136 -3.807 -0.611 1.00 0.00 N
-ATOM 30 CA PHE A 5 6.202 -4.817 -1.092 1.00 0.00 C
-ATOM 31 C PHE A 5 6.770 -6.220 -0.919 1.00 0.00 C
-ATOM 32 O PHE A 5 7.930 -6.474 -1.243 1.00 0.00 O
-ATOM 33 CB PHE A 5 5.855 -4.568 -2.561 1.00 0.00 C
-ATOM 34 CEN PHE A 5 4.691 -3.896 -3.410 1.00 0.00 X
-ATOM 35 H PHE A 5 8.111 -3.878 -0.863 1.00 0.00 H
-ATOM 36 N THR A 6 5.946 -7.128 -0.407 1.00 0.00 N
-ATOM 37 CA THR A 6 6.282 -8.547 -0.396 1.00 0.00 C
-ATOM 38 C THR A 6 5.826 -9.231 -1.678 1.00 0.00 C
-ATOM 39 O THR A 6 5.056 -8.666 -2.455 1.00 0.00 O
-ATOM 40 CB THR A 6 5.651 -9.267 0.810 1.00 0.00 C
-ATOM 41 CEN THR A 6 5.578 -9.338 1.386 1.00 0.00 X
-ATOM 42 H THR A 6 5.065 -6.827 -0.016 1.00 0.00 H
-ATOM 43 N THR A 7 6.306 -10.451 -1.894 1.00 0.00 N
-ATOM 44 CA THR A 7 5.967 -11.205 -3.095 1.00 0.00 C
-ATOM 45 C THR A 7 4.479 -11.524 -3.145 1.00 0.00 C
-ATOM 46 O THR A 7 3.822 -11.311 -4.164 1.00 0.00 O
-ATOM 47 CB THR A 7 6.766 -12.519 -3.181 1.00 0.00 C
-ATOM 48 CEN THR A 7 7.270 -12.813 -3.208 1.00 0.00 X
-ATOM 49 H THR A 7 6.921 -10.866 -1.209 1.00 0.00 H
-ATOM 50 N ARG A 8 3.951 -12.035 -2.037 1.00 0.00 N
-ATOM 51 CA ARG A 8 2.539 -12.390 -1.955 1.00 0.00 C
-ATOM 52 C ARG A 8 1.663 -11.147 -1.860 1.00 0.00 C
-ATOM 53 O ARG A 8 0.549 -11.120 -2.382 1.00 0.00 O
-ATOM 54 CB ARG A 8 2.257 -13.358 -0.815 1.00 0.00 C
-ATOM 55 CEN ARG A 8 1.868 -15.477 0.413 1.00 0.00 X
-ATOM 56 H ARG A 8 4.543 -12.181 -1.232 1.00 0.00 H
-ATOM 57 N GLN A 9 2.174 -10.119 -1.192 1.00 0.00 N
-ATOM 58 CA GLN A 9 1.485 -8.836 -1.115 1.00 0.00 C
-ATOM 59 C GLN A 9 1.390 -8.179 -2.487 1.00 0.00 C
-ATOM 60 O GLN A 9 0.368 -7.585 -2.831 1.00 0.00 O
-ATOM 61 CB GLN A 9 2.205 -7.898 -0.142 1.00 0.00 C
-ATOM 62 CEN GLN A 9 2.185 -7.244 1.476 1.00 0.00 X
-ATOM 63 H GLN A 9 3.063 -10.228 -0.725 1.00 0.00 H
-ATOM 64 N LEU A 10 2.460 -8.291 -3.266 1.00 0.00 N
-ATOM 65 CA LEU A 10 2.498 -7.711 -4.603 1.00 0.00 C
-ATOM 66 C LEU A 10 1.631 -8.504 -5.572 1.00 0.00 C
-ATOM 67 O LEU A 10 0.947 -7.931 -6.420 1.00 0.00 O
-ATOM 68 CB LEU A 10 3.943 -7.645 -5.112 1.00 0.00 C
-ATOM 69 CEN LEU A 10 4.948 -6.486 -5.257 1.00 0.00 X
-ATOM 70 H LEU A 10 3.269 -8.790 -2.923 1.00 0.00 H
-ATOM 71 N THR A 11 1.663 -9.826 -5.441 1.00 0.00 N
-ATOM 72 CA THR A 11 0.875 -10.701 -6.301 1.00 0.00 C
-ATOM 73 C THR A 11 -0.617 -10.468 -6.104 1.00 0.00 C
-ATOM 74 O THR A 11 -1.376 -10.389 -7.071 1.00 0.00 O
-ATOM 75 CB THR A 11 1.191 -12.185 -6.040 1.00 0.00 C
-ATOM 76 CEN THR A 11 1.563 -12.635 -6.020 1.00 0.00 X
-ATOM 77 H THR A 11 2.249 -10.235 -4.728 1.00 0.00 H
-ATOM 78 N GLU A 12 -1.033 -10.358 -4.847 1.00 0.00 N
-ATOM 79 CA GLU A 12 -2.439 -10.156 -4.520 1.00 0.00 C
-ATOM 80 C GLU A 12 -2.925 -8.792 -4.994 1.00 0.00 C
-ATOM 81 O GLU A 12 -4.025 -8.666 -5.531 1.00 0.00 O
-ATOM 82 CB GLU A 12 -2.665 -10.300 -3.014 1.00 0.00 C
-ATOM 83 CEN GLU A 12 -3.155 -11.237 -1.677 1.00 0.00 X
-ATOM 84 H GLU A 12 -0.357 -10.415 -4.099 1.00 0.00 H
-ATOM 85 N LEU A 13 -2.098 -7.772 -4.791 1.00 0.00 N
-ATOM 86 CA LEU A 13 -2.388 -6.437 -5.300 1.00 0.00 C
-ATOM 87 C LEU A 13 -2.518 -6.442 -6.818 1.00 0.00 C
-ATOM 88 O LEU A 13 -3.388 -5.776 -7.379 1.00 0.00 O
-ATOM 89 CB LEU A 13 -1.297 -5.453 -4.862 1.00 0.00 C
-ATOM 90 CEN LEU A 13 -1.252 -4.355 -3.783 1.00 0.00 X
-ATOM 91 H LEU A 13 -1.246 -7.925 -4.271 1.00 0.00 H
-ATOM 92 N GLU A 14 -1.648 -7.199 -7.479 1.00 0.00 N
-ATOM 93 CA GLU A 14 -1.707 -7.347 -8.928 1.00 0.00 C
-ATOM 94 C GLU A 14 -2.974 -8.076 -9.356 1.00 0.00 C
-ATOM 95 O GLU A 14 -3.575 -7.748 -10.379 1.00 0.00 O
-ATOM 96 CB GLU A 14 -0.473 -8.093 -9.441 1.00 0.00 C
-ATOM 97 CEN GLU A 14 1.075 -8.073 -10.152 1.00 0.00 X
-ATOM 98 H GLU A 14 -0.927 -7.683 -6.963 1.00 0.00 H
-ATOM 99 N LYS A 15 -3.377 -9.066 -8.566 1.00 0.00 N
-ATOM 100 CA LYS A 15 -4.574 -9.844 -8.862 1.00 0.00 C
-ATOM 101 C LYS A 15 -5.829 -8.988 -8.749 1.00 0.00 C
-ATOM 102 O LYS A 15 -6.549 -8.793 -9.729 1.00 0.00 O
-ATOM 103 CB LYS A 15 -4.674 -11.050 -7.927 1.00 0.00 C
-ATOM 104 CEN LYS A 15 -4.464 -13.135 -7.634 1.00 0.00 X
-ATOM 105 H LYS A 15 -2.840 -9.285 -7.739 1.00 0.00 H
-ATOM 106 N GLU A 16 -6.086 -8.480 -7.549 1.00 0.00 N
-ATOM 107 CA GLU A 16 -7.258 -7.648 -7.305 1.00 0.00 C
-ATOM 108 C GLU A 16 -7.332 -6.494 -8.297 1.00 0.00 C
-ATOM 109 O GLU A 16 -8.395 -6.200 -8.844 1.00 0.00 O
-ATOM 110 CB GLU A 16 -7.244 -7.109 -5.872 1.00 0.00 C
-ATOM 111 CEN GLU A 16 -7.770 -7.201 -4.254 1.00 0.00 X
-ATOM 112 H GLU A 16 -5.453 -8.674 -6.786 1.00 0.00 H
-ATOM 113 N PHE A 17 -6.196 -5.844 -8.526 1.00 0.00 N
-ATOM 114 CA PHE A 17 -6.134 -4.709 -9.439 1.00 0.00 C
-ATOM 115 C PHE A 17 -6.529 -5.117 -10.852 1.00 0.00 C
-ATOM 116 O PHE A 17 -7.411 -4.510 -11.460 1.00 0.00 O
-ATOM 117 CB PHE A 17 -4.730 -4.100 -9.439 1.00 0.00 C
-ATOM 118 CEN PHE A 17 -3.963 -2.882 -8.767 1.00 0.00 X
-ATOM 119 H PHE A 17 -5.354 -6.143 -8.055 1.00 0.00 H
-ATOM 120 N HIS A 18 -5.870 -6.148 -11.371 1.00 0.00 N
-ATOM 121 CA HIS A 18 -6.173 -6.659 -12.702 1.00 0.00 C
-ATOM 122 C HIS A 18 -7.616 -7.140 -12.793 1.00 0.00 C
-ATOM 123 O HIS A 18 -8.268 -6.987 -13.826 1.00 0.00 O
-ATOM 124 CB HIS A 18 -5.218 -7.797 -13.076 1.00 0.00 C
-ATOM 125 CEN HIS A 18 -3.998 -7.969 -13.792 1.00 0.00 X
-ATOM 126 H HIS A 18 -5.141 -6.589 -10.829 1.00 0.00 H
-ATOM 127 N PHE A 19 -8.109 -7.722 -11.705 1.00 0.00 N
-ATOM 128 CA PHE A 19 -9.475 -8.230 -11.661 1.00 0.00 C
-ATOM 129 C PHE A 19 -10.482 -7.095 -11.528 1.00 0.00 C
-ATOM 130 O PHE A 19 -11.686 -7.298 -11.685 1.00 0.00 O
-ATOM 131 CB PHE A 19 -9.641 -9.218 -10.504 1.00 0.00 C
-ATOM 132 CEN PHE A 19 -9.646 -10.791 -10.276 1.00 0.00 X
-ATOM 133 H PHE A 19 -7.523 -7.814 -10.888 1.00 0.00 H
-ATOM 134 N ASN A 20 -9.982 -5.898 -11.239 1.00 0.00 N
-ATOM 135 CA ASN A 20 -10.842 -4.742 -11.019 1.00 0.00 C
-ATOM 136 C ASN A 20 -10.941 -3.883 -12.273 1.00 0.00 C
-ATOM 137 O ASN A 20 -11.707 -2.920 -12.319 1.00 0.00 O
-ATOM 138 CB ASN A 20 -10.359 -3.906 -9.848 1.00 0.00 C
-ATOM 139 CEN ASN A 20 -10.531 -3.833 -8.815 1.00 0.00 X
-ATOM 140 H ASN A 20 -8.980 -5.787 -11.169 1.00 0.00 H
-ATOM 141 N LYS A 21 -10.161 -4.236 -13.289 1.00 0.00 N
-ATOM 142 CA LYS A 21 -10.136 -3.479 -14.535 1.00 0.00 C
-ATOM 143 C LYS A 21 -9.754 -2.025 -14.288 1.00 0.00 C
-ATOM 144 O LYS A 21 -10.126 -1.137 -15.054 1.00 0.00 O
-ATOM 145 CB LYS A 21 -11.493 -3.554 -15.236 1.00 0.00 C
-ATOM 146 CEN LYS A 21 -12.689 -4.363 -16.783 1.00 0.00 X
-ATOM 147 H LYS A 21 -9.571 -5.051 -13.197 1.00 0.00 H
-ATOM 148 N TYR A 22 -9.009 -1.789 -13.213 1.00 0.00 N
-ATOM 149 CA TYR A 22 -8.439 -0.473 -12.951 1.00 0.00 C
-ATOM 150 C TYR A 22 -6.925 -0.483 -13.124 1.00 0.00 C
-ATOM 151 O TYR A 22 -6.262 0.535 -12.930 1.00 0.00 O
-ATOM 152 CB TYR A 22 -8.802 -0.004 -11.540 1.00 0.00 C
-ATOM 153 CEN TYR A 22 -9.936 1.049 -10.719 1.00 0.00 X
-ATOM 154 H TYR A 22 -8.833 -2.540 -12.562 1.00 0.00 H
-ATOM 155 N LEU A 23 -6.385 -1.641 -13.492 1.00 0.00 N
-ATOM 156 CA LEU A 23 -4.963 -1.762 -13.788 1.00 0.00 C
-ATOM 157 C LEU A 23 -4.715 -2.781 -14.893 1.00 0.00 C
-ATOM 158 O LEU A 23 -5.194 -3.913 -14.825 1.00 0.00 O
-ATOM 159 CB LEU A 23 -4.189 -2.150 -12.521 1.00 0.00 C
-ATOM 160 CEN LEU A 23 -3.285 -1.351 -11.563 1.00 0.00 X
-ATOM 161 H LEU A 23 -6.975 -2.457 -13.567 1.00 0.00 H
-ATOM 162 N SER A 24 -3.965 -2.372 -15.911 1.00 0.00 N
-ATOM 163 CA SER A 24 -3.708 -3.226 -17.064 1.00 0.00 C
-ATOM 164 C SER A 24 -2.414 -4.011 -16.890 1.00 0.00 C
-ATOM 165 O SER A 24 -1.602 -3.703 -16.018 1.00 0.00 O
-ATOM 166 CB SER A 24 -3.653 -2.391 -18.329 1.00 0.00 C
-ATOM 167 CEN SER A 24 -3.554 -1.966 -18.653 1.00 0.00 X
-ATOM 168 H SER A 24 -3.564 -1.446 -15.885 1.00 0.00 H
-ATOM 169 N ARG A 25 -2.228 -5.027 -17.726 1.00 0.00 N
-ATOM 170 CA ARG A 25 -1.020 -5.842 -17.684 1.00 0.00 C
-ATOM 171 C ARG A 25 0.223 -4.997 -17.931 1.00 0.00 C
-ATOM 172 O ARG A 25 1.281 -5.247 -17.353 1.00 0.00 O
-ATOM 173 CB ARG A 25 -1.090 -7.022 -18.641 1.00 0.00 C
-ATOM 174 CEN ARG A 25 -1.449 -9.321 -19.500 1.00 0.00 X
-ATOM 175 H ARG A 25 -2.942 -5.241 -18.407 1.00 0.00 H
-ATOM 176 N ALA A 26 0.089 -3.995 -18.794 1.00 0.00 N
-ATOM 177 CA ALA A 26 1.174 -3.055 -19.050 1.00 0.00 C
-ATOM 178 C ALA A 26 1.467 -2.203 -17.822 1.00 0.00 C
-ATOM 179 O ALA A 26 2.593 -1.747 -17.625 1.00 0.00 O
-ATOM 180 CB ALA A 26 0.838 -2.172 -20.243 1.00 0.00 C
-ATOM 181 CEN ALA A 26 0.839 -2.172 -20.242 1.00 0.00 X
-ATOM 182 H ALA A 26 -0.787 -3.881 -19.284 1.00 0.00 H
-ATOM 183 N ARG A 27 0.446 -1.991 -16.998 1.00 0.00 N
-ATOM 184 CA ARG A 27 0.580 -1.154 -15.811 1.00 0.00 C
-ATOM 185 C ARG A 27 1.041 -1.971 -14.610 1.00 0.00 C
-ATOM 186 O ARG A 27 1.636 -1.435 -13.675 1.00 0.00 O
-ATOM 187 CB ARG A 27 -0.695 -0.384 -15.505 1.00 0.00 C
-ATOM 188 CEN ARG A 27 -2.360 1.454 -15.431 1.00 0.00 X
-ATOM 189 H ARG A 27 -0.445 -2.421 -17.198 1.00 0.00 H
-ATOM 190 N ARG A 28 0.762 -3.269 -14.642 1.00 0.00 N
-ATOM 191 CA ARG A 28 1.186 -4.170 -13.577 1.00 0.00 C
-ATOM 192 C ARG A 28 2.656 -3.967 -13.236 1.00 0.00 C
-ATOM 193 O ARG A 28 3.051 -4.049 -12.073 1.00 0.00 O
-ATOM 194 CB ARG A 28 0.887 -5.626 -13.903 1.00 0.00 C
-ATOM 195 CEN ARG A 28 -0.273 -7.817 -13.979 1.00 0.00 X
-ATOM 196 H ARG A 28 0.244 -3.642 -15.425 1.00 0.00 H
-ATOM 197 N VAL A 29 3.464 -3.700 -14.256 1.00 0.00 N
-ATOM 198 CA VAL A 29 4.895 -3.495 -14.068 1.00 0.00 C
-ATOM 199 C VAL A 29 5.193 -2.069 -13.620 1.00 0.00 C
-ATOM 200 O VAL A 29 6.353 -1.671 -13.515 1.00 0.00 O
-ATOM 201 CB VAL A 29 5.684 -3.793 -15.356 1.00 0.00 C
-ATOM 202 CEN VAL A 29 6.121 -4.238 -15.649 1.00 0.00 X
-ATOM 203 H VAL A 29 3.077 -3.638 -15.187 1.00 0.00 H
-ATOM 204 N GLU A 30 4.138 -1.305 -13.358 1.00 0.00 N
-ATOM 205 CA GLU A 30 4.285 0.071 -12.898 1.00 0.00 C
-ATOM 206 C GLU A 30 3.759 0.237 -11.479 1.00 0.00 C
-ATOM 207 O GLU A 30 3.961 1.275 -10.848 1.00 0.00 O
-ATOM 208 CB GLU A 30 3.559 1.032 -13.843 1.00 0.00 C
-ATOM 209 CEN GLU A 30 3.597 2.140 -15.137 1.00 0.00 X
-ATOM 210 H GLU A 30 3.211 -1.686 -13.480 1.00 0.00 H
-ATOM 211 N ILE A 31 3.083 -0.792 -10.980 1.00 0.00 N
-ATOM 212 CA ILE A 31 2.536 -0.767 -9.628 1.00 0.00 C
-ATOM 213 C ILE A 31 3.645 -0.814 -8.585 1.00 0.00 C
-ATOM 214 O ILE A 31 3.540 -0.195 -7.526 1.00 0.00 O
-ATOM 215 CB ILE A 31 1.568 -1.940 -9.389 1.00 0.00 C
-ATOM 216 CEN ILE A 31 0.538 -2.282 -9.492 1.00 0.00 X
-ATOM 217 H ILE A 31 2.944 -1.613 -11.551 1.00 0.00 H
-ATOM 218 N ALA A 32 4.706 -1.553 -8.889 1.00 0.00 N
-ATOM 219 CA ALA A 32 5.853 -1.652 -7.994 1.00 0.00 C
-ATOM 220 C ALA A 32 6.550 -0.306 -7.840 1.00 0.00 C
-ATOM 221 O ALA A 32 6.958 0.070 -6.742 1.00 0.00 O
-ATOM 222 CB ALA A 32 6.830 -2.704 -8.500 1.00 0.00 C
-ATOM 223 CEN ALA A 32 6.830 -2.703 -8.499 1.00 0.00 X
-ATOM 224 H ALA A 32 4.720 -2.058 -9.764 1.00 0.00 H
-ATOM 225 N ALA A 33 6.683 0.415 -8.948 1.00 0.00 N
-ATOM 226 CA ALA A 33 7.292 1.740 -8.930 1.00 0.00 C
-ATOM 227 C ALA A 33 6.472 2.711 -8.090 1.00 0.00 C
-ATOM 228 O ALA A 33 7.025 3.542 -7.368 1.00 0.00 O
-ATOM 229 CB ALA A 33 7.454 2.268 -10.348 1.00 0.00 C
-ATOM 230 CEN ALA A 33 7.453 2.268 -10.347 1.00 0.00 X
-ATOM 231 H ALA A 33 6.355 0.036 -9.825 1.00 0.00 H
-ATOM 232 N THR A 34 5.152 2.602 -8.188 1.00 0.00 N
-ATOM 233 CA THR A 34 4.254 3.444 -7.406 1.00 0.00 C
-ATOM 234 C THR A 34 4.462 3.233 -5.912 1.00 0.00 C
-ATOM 235 O THR A 34 4.346 4.170 -5.121 1.00 0.00 O
-ATOM 236 CB THR A 34 2.778 3.169 -7.752 1.00 0.00 C
-ATOM 237 CEN THR A 34 2.335 3.148 -8.131 1.00 0.00 X
-ATOM 238 H THR A 34 4.760 1.919 -8.820 1.00 0.00 H
-ATOM 239 N LEU A 35 4.771 1.999 -5.531 1.00 0.00 N
-ATOM 240 CA LEU A 35 4.993 1.662 -4.130 1.00 0.00 C
-ATOM 241 C LEU A 35 6.371 2.117 -3.666 1.00 0.00 C
-ATOM 242 O LEU A 35 6.745 1.915 -2.511 1.00 0.00 O
-ATOM 243 CB LEU A 35 4.829 0.152 -3.915 1.00 0.00 C
-ATOM 244 CEN LEU A 35 3.704 -0.700 -3.296 1.00 0.00 X
-ATOM 245 H LEU A 35 4.854 1.274 -6.230 1.00 0.00 H
-ATOM 246 N GLU A 36 7.122 2.731 -4.573 1.00 0.00 N
-ATOM 247 CA GLU A 36 8.460 3.218 -4.258 1.00 0.00 C
-ATOM 248 C GLU A 36 9.396 2.068 -3.906 1.00 0.00 C
-ATOM 249 O GLU A 36 10.255 2.199 -3.034 1.00 0.00 O
-ATOM 250 CB GLU A 36 8.407 4.223 -3.105 1.00 0.00 C
-ATOM 251 CEN GLU A 36 8.390 5.835 -2.551 1.00 0.00 X
-ATOM 252 H GLU A 36 6.757 2.865 -5.505 1.00 0.00 H
-ATOM 253 N LEU A 37 9.223 0.942 -4.589 1.00 0.00 N
-ATOM 254 CA LEU A 37 10.075 -0.222 -4.375 1.00 0.00 C
-ATOM 255 C LEU A 37 11.461 -0.006 -4.970 1.00 0.00 C
-ATOM 256 O LEU A 37 11.596 0.362 -6.137 1.00 0.00 O
-ATOM 257 CB LEU A 37 9.425 -1.473 -4.978 1.00 0.00 C
-ATOM 258 CEN LEU A 37 8.689 -2.674 -4.353 1.00 0.00 X
-ATOM 259 H LEU A 37 8.483 0.890 -5.274 1.00 0.00 H
-ATOM 260 N ASN A 38 12.489 -0.238 -4.160 1.00 0.00 N
-ATOM 261 CA ASN A 38 13.838 -0.443 -4.674 1.00 0.00 C
-ATOM 262 C ASN A 38 13.827 -1.330 -5.913 1.00 0.00 C
-ATOM 263 O ASN A 38 13.018 -2.251 -6.021 1.00 0.00 O
-ATOM 264 CB ASN A 38 14.752 -1.032 -3.616 1.00 0.00 C
-ATOM 265 CEN ASN A 38 15.423 -0.692 -2.884 1.00 0.00 X
-ATOM 266 H ASN A 38 12.332 -0.273 -3.163 1.00 0.00 H
-ATOM 267 N GLU A 39 14.729 -1.045 -6.846 1.00 0.00 N
-ATOM 268 CA GLU A 39 14.643 -1.604 -8.190 1.00 0.00 C
-ATOM 269 C GLU A 39 14.649 -3.127 -8.154 1.00 0.00 C
-ATOM 270 O GLU A 39 13.892 -3.777 -8.876 1.00 0.00 O
-ATOM 271 CB GLU A 39 15.797 -1.095 -9.057 1.00 0.00 C
-ATOM 272 CEN GLU A 39 16.395 -0.022 -10.238 1.00 0.00 X
-ATOM 273 H GLU A 39 15.493 -0.426 -6.619 1.00 0.00 H
-ATOM 274 N THR A 40 15.506 -3.691 -7.310 1.00 0.00 N
-ATOM 275 CA THR A 40 15.588 -5.139 -7.155 1.00 0.00 C
-ATOM 276 C THR A 40 14.282 -5.711 -6.618 1.00 0.00 C
-ATOM 277 O THR A 40 13.858 -6.796 -7.016 1.00 0.00 O
-ATOM 278 CB THR A 40 16.738 -5.542 -6.214 1.00 0.00 C
-ATOM 279 CEN THR A 40 17.304 -5.552 -6.069 1.00 0.00 X
-ATOM 280 H THR A 40 16.116 -3.102 -6.761 1.00 0.00 H
-ATOM 281 N GLN A 41 13.648 -4.974 -5.712 1.00 0.00 N
-ATOM 282 CA GLN A 41 12.391 -5.409 -5.115 1.00 0.00 C
-ATOM 283 C GLN A 41 11.279 -5.470 -6.155 1.00 0.00 C
-ATOM 284 O GLN A 41 10.448 -6.378 -6.136 1.00 0.00 O
-ATOM 285 CB GLN A 41 11.983 -4.468 -3.978 1.00 0.00 C
-ATOM 286 CEN GLN A 41 11.959 -4.263 -2.245 1.00 0.00 X
-ATOM 287 H GLN A 41 14.046 -4.090 -5.430 1.00 0.00 H
-ATOM 288 N VAL A 42 11.269 -4.499 -7.061 1.00 0.00 N
-ATOM 289 CA VAL A 42 10.337 -4.506 -8.182 1.00 0.00 C
-ATOM 290 C VAL A 42 10.675 -5.614 -9.172 1.00 0.00 C
-ATOM 291 O VAL A 42 9.784 -6.227 -9.760 1.00 0.00 O
-ATOM 292 CB VAL A 42 10.330 -3.155 -8.921 1.00 0.00 C
-ATOM 293 CEN VAL A 42 9.955 -2.589 -9.039 1.00 0.00 X
-ATOM 294 H VAL A 42 11.925 -3.736 -6.971 1.00 0.00 H
-ATOM 295 N LYS A 43 11.967 -5.865 -9.353 1.00 0.00 N
-ATOM 296 CA LYS A 43 12.423 -6.983 -10.170 1.00 0.00 C
-ATOM 297 C LYS A 43 12.001 -8.316 -9.565 1.00 0.00 C
-ATOM 298 O LYS A 43 11.509 -9.199 -10.267 1.00 0.00 O
-ATOM 299 CB LYS A 43 13.943 -6.939 -10.337 1.00 0.00 C
-ATOM 300 CEN LYS A 43 15.617 -6.513 -11.558 1.00 0.00 X
-ATOM 301 H LYS A 43 12.651 -5.266 -8.912 1.00 0.00 H
-ATOM 302 N ILE A 44 12.196 -8.455 -8.258 1.00 0.00 N
-ATOM 303 CA ILE A 44 11.826 -9.677 -7.554 1.00 0.00 C
-ATOM 304 C ILE A 44 10.328 -9.933 -7.644 1.00 0.00 C
-ATOM 305 O ILE A 44 9.891 -11.072 -7.807 1.00 0.00 O
-ATOM 306 CB ILE A 44 12.240 -9.622 -6.072 1.00 0.00 C
-ATOM 307 CEN ILE A 44 13.051 -9.799 -5.364 1.00 0.00 X
-ATOM 308 H ILE A 44 12.611 -7.694 -7.739 1.00 0.00 H
-ATOM 309 N TRP A 45 9.543 -8.866 -7.537 1.00 0.00 N
-ATOM 310 CA TRP A 45 8.091 -8.972 -7.619 1.00 0.00 C
-ATOM 311 C TRP A 45 7.654 -9.515 -8.973 1.00 0.00 C
-ATOM 312 O TRP A 45 6.932 -10.509 -9.051 1.00 0.00 O
-ATOM 313 CB TRP A 45 7.442 -7.609 -7.366 1.00 0.00 C
-ATOM 314 CEN TRP A 45 6.369 -6.769 -6.263 1.00 0.00 X
-ATOM 315 H TRP A 45 9.963 -7.958 -7.394 1.00 0.00 H
-ATOM 316 N PHE A 46 8.095 -8.856 -10.040 1.00 0.00 N
-ATOM 317 CA PHE A 46 7.769 -9.286 -11.394 1.00 0.00 C
-ATOM 318 C PHE A 46 8.438 -10.613 -11.727 1.00 0.00 C
-ATOM 319 O PHE A 46 7.868 -11.447 -12.431 1.00 0.00 O
-ATOM 320 CB PHE A 46 8.186 -8.218 -12.408 1.00 0.00 C
-ATOM 321 CEN PHE A 46 7.517 -7.031 -13.226 1.00 0.00 X
-ATOM 322 H PHE A 46 8.672 -8.037 -9.908 1.00 0.00 H
-ATOM 323 N GLN A 47 9.650 -10.804 -11.218 1.00 0.00 N
-ATOM 324 CA GLN A 47 10.368 -12.060 -11.399 1.00 0.00 C
-ATOM 325 C GLN A 47 9.583 -13.232 -10.825 1.00 0.00 C
-ATOM 326 O GLN A 47 9.336 -14.222 -11.512 1.00 0.00 O
-ATOM 327 CB GLN A 47 11.747 -11.988 -10.737 1.00 0.00 C
-ATOM 328 CEN GLN A 47 13.451 -11.748 -11.030 1.00 0.00 X
-ATOM 329 H GLN A 47 10.085 -10.060 -10.691 1.00 0.00 H
-ATOM 330 N ASN A 48 9.192 -13.112 -9.560 1.00 0.00 N
-ATOM 331 CA ASN A 48 8.415 -14.153 -8.897 1.00 0.00 C
-ATOM 332 C ASN A 48 6.999 -14.222 -9.454 1.00 0.00 C
-ATOM 333 O ASN A 48 6.401 -15.296 -9.526 1.00 0.00 O
-ATOM 334 CB ASN A 48 8.378 -13.946 -7.394 1.00 0.00 C
-ATOM 335 CEN ASN A 48 8.919 -14.252 -6.549 1.00 0.00 X
-ATOM 336 H ASN A 48 9.439 -12.280 -9.045 1.00 0.00 H
-ATOM 337 N ARG A 49 6.466 -13.070 -9.847 1.00 0.00 N
-ATOM 338 CA ARG A 49 5.133 -13.002 -10.434 1.00 0.00 C
-ATOM 339 C ARG A 49 5.161 -13.376 -11.910 1.00 0.00 C
-ATOM 340 O ARG A 49 4.242 -14.021 -12.415 1.00 0.00 O
-ATOM 341 CB ARG A 49 4.477 -11.647 -10.215 1.00 0.00 C
-ATOM 342 CEN ARG A 49 3.077 -9.857 -9.220 1.00 0.00 X
-ATOM 343 H ARG A 49 6.998 -12.218 -9.736 1.00 0.00 H
-ATOM 344 N ARG A 50 6.222 -12.967 -12.598 1.00 0.00 N
-ATOM 345 CA ARG A 50 6.524 -13.493 -13.924 1.00 0.00 C
-ATOM 346 C ARG A 50 6.700 -15.006 -13.889 1.00 0.00 C
-ATOM 347 O ARG A 50 6.254 -15.713 -14.792 1.00 0.00 O
-ATOM 348 CB ARG A 50 7.728 -12.807 -14.553 1.00 0.00 C
-ATOM 349 CEN ARG A 50 9.079 -11.242 -15.924 1.00 0.00 X
-ATOM 350 H ARG A 50 6.834 -12.273 -12.193 1.00 0.00 H
-ATOM 351 N MET A 51 7.353 -15.497 -12.841 1.00 0.00 N
-ATOM 352 CA MET A 51 7.591 -16.927 -12.688 1.00 0.00 C
-ATOM 353 C MET A 51 6.335 -17.648 -12.217 1.00 0.00 C
-ATOM 354 O MET A 51 6.231 -18.870 -12.325 1.00 0.00 O
-ATOM 355 CB MET A 51 8.738 -17.169 -11.709 1.00 0.00 C
-ATOM 356 CEN MET A 51 10.405 -17.711 -11.620 1.00 0.00 X
-ATOM 357 H MET A 51 7.692 -14.863 -12.132 1.00 0.00 H
-ATOM 358 N LYS A 52 5.382 -16.884 -11.693 1.00 0.00 N
-ATOM 359 CA LYS A 52 4.212 -17.459 -11.041 1.00 0.00 C
-ATOM 360 C LYS A 52 2.959 -17.262 -11.885 1.00 0.00 C
-ATOM 361 O LYS A 52 1.891 -17.780 -11.558 1.00 0.00 O
-ATOM 362 CB LYS A 52 4.014 -16.842 -9.655 1.00 0.00 C
-ATOM 363 CEN LYS A 52 4.177 -17.024 -7.554 1.00 0.00 X
-ATOM 364 H LYS A 52 5.471 -15.879 -11.748 1.00 0.00 H
-ATOM 365 N GLN A 53 3.096 -16.511 -12.972 1.00 0.00 N
-ATOM 366 CA GLN A 53 1.941 -16.020 -13.715 1.00 0.00 C
-ATOM 367 C GLN A 53 1.063 -17.170 -14.191 1.00 0.00 C
-ATOM 368 O GLN A 53 -0.156 -17.146 -14.018 1.00 0.00 O
-ATOM 369 CB GLN A 53 2.392 -15.183 -14.915 1.00 0.00 C
-ATOM 370 CEN GLN A 53 2.619 -13.557 -15.506 1.00 0.00 X
-ATOM 371 H GLN A 53 4.024 -16.274 -13.293 1.00 0.00 H
-ATOM 372 N LYS A 54 1.689 -18.177 -14.791 1.00 0.00 N
-ATOM 373 CA LYS A 54 0.961 -19.320 -15.328 1.00 0.00 C
-ATOM 374 C LYS A 54 0.057 -19.943 -14.271 1.00 0.00 C
-ATOM 375 O LYS A 54 -1.141 -20.118 -14.491 1.00 0.00 O
-ATOM 376 CB LYS A 54 1.934 -20.368 -15.871 1.00 0.00 C
-ATOM 377 CEN LYS A 54 2.853 -21.293 -17.537 1.00 0.00 X
-ATOM 378 H LYS A 54 2.694 -18.149 -14.878 1.00 0.00 H
-ATOM 379 N LYS A 55 0.639 -20.276 -13.124 1.00 0.00 N
-ATOM 380 CA LYS A 55 -0.087 -20.978 -12.073 1.00 0.00 C
-ATOM 381 C LYS A 55 -1.150 -20.085 -11.446 1.00 0.00 C
-ATOM 382 O LYS A 55 -2.225 -20.553 -11.070 1.00 0.00 O
-ATOM 383 CB LYS A 55 0.879 -21.480 -10.998 1.00 0.00 C
-ATOM 384 CEN LYS A 55 1.935 -23.091 -10.124 1.00 0.00 X
-ATOM 385 H LYS A 55 1.609 -20.036 -12.976 1.00 0.00 H
-ATOM 386 N ARG A 56 -0.844 -18.797 -11.336 1.00 0.00 N
-ATOM 387 CA ARG A 56 -1.781 -17.832 -10.775 1.00 0.00 C
-ATOM 388 C ARG A 56 -3.057 -17.758 -11.603 1.00 0.00 C
-ATOM 389 O ARG A 56 -3.096 -18.218 -12.744 1.00 0.00 O
-ATOM 390 CB ARG A 56 -1.152 -16.458 -10.596 1.00 0.00 C
-ATOM 391 CEN ARG A 56 -0.021 -14.521 -9.538 1.00 0.00 X
-ATOM 392 H ARG A 56 0.062 -18.478 -11.649 1.00 0.00 H
-ATOM 393 N GLU A 57 -4.101 -17.176 -11.022 1.00 0.00 N
-ATOM 394 CA GLU A 57 -5.376 -17.022 -11.713 1.00 0.00 C
-ATOM 395 C GLU A 57 -5.274 -15.997 -12.835 1.00 0.00 C
-ATOM 396 O GLU A 57 -4.468 -15.069 -12.770 1.00 0.00 O
-ATOM 397 CB GLU A 57 -6.474 -16.615 -10.728 1.00 0.00 C
-ATOM 398 CEN GLU A 57 -7.796 -17.031 -9.736 1.00 0.00 X
-ATOM 399 H GLU A 57 -4.009 -16.830 -10.077 1.00 0.00 H
-ATOM 400 N ARG A 58 -6.096 -16.171 -13.864 1.00 0.00 N
-ATOM 401 CA ARG A 58 -6.116 -15.248 -14.993 1.00 0.00 C
-ATOM 402 C ARG A 58 -6.584 -13.863 -14.565 1.00 0.00 C
-ATOM 403 O ARG A 58 -6.397 -12.884 -15.286 1.00 0.00 O
-ATOM 404 CB ARG A 58 -6.942 -15.781 -16.155 1.00 0.00 C
-ATOM 405 CEN ARG A 58 -7.530 -16.890 -18.294 1.00 0.00 X
-ATOM 406 H ARG A 58 -6.724 -16.962 -13.865 1.00 0.00 H
-ATOM 407 N GLU A 59 -7.194 -13.789 -13.387 1.00 0.00 N
-ATOM 408 CA GLU A 59 -7.617 -12.513 -12.823 1.00 0.00 C
-ATOM 409 C GLU A 59 -6.483 -11.845 -12.056 1.00 0.00 C
-ATOM 410 O GLU A 59 -6.087 -10.764 -12.392 1.00 0.00 O
-ATOM 411 CB GLU A 59 -8.828 -12.707 -11.907 1.00 0.00 C
-ATOM 412 CEN GLU A 59 -10.512 -12.645 -11.652 1.00 0.00 X
-ATOM 413 H GLU A 59 -7.368 -14.638 -12.868 1.00 0.00 H
+ATOM 8 N ARG A 2 3.213 1.582 0.538 1.00 0.00 N
+ATOM 9 CA ARG A 2 3.928 2.850 0.448 1.00 0.00 C
+ATOM 10 C ARG A 2 5.414 2.627 0.202 1.00 0.00 C
+ATOM 11 O ARG A 2 5.943 1.549 0.471 1.00 0.00 O
+ATOM 12 CB ARG A 2 3.690 3.731 1.666 1.00 0.00 C
+ATOM 13 CEN ARG A 2 2.731 5.483 3.137 1.00 0.00 X
+ATOM 14 H ARG A 2 3.644 0.808 1.022 1.00 0.00 H
+ATOM 15 N THR A 3 6.084 3.654 -0.310 1.00 0.00 N
+ATOM 16 CA THR A 3 7.501 3.556 -0.640 1.00 0.00 C
+ATOM 17 C THR A 3 8.345 3.348 0.611 1.00 0.00 C
+ATOM 18 O THR A 3 8.040 3.889 1.674 1.00 0.00 O
+ATOM 19 CB THR A 3 7.998 4.814 -1.378 1.00 0.00 C
+ATOM 20 CEN THR A 3 7.978 5.188 -1.826 1.00 0.00 X
+ATOM 21 H THR A 3 5.600 4.525 -0.475 1.00 0.00 H
+ATOM 22 N ASN A 4 9.407 2.560 0.478 1.00 0.00 N
+ATOM 23 CA ASN A 4 10.336 2.335 1.579 1.00 0.00 C
+ATOM 24 C ASN A 4 11.239 3.544 1.793 1.00 0.00 C
+ATOM 25 O ASN A 4 11.309 4.435 0.947 1.00 0.00 O
+ATOM 26 CB ASN A 4 11.173 1.089 1.353 1.00 0.00 C
+ATOM 27 CEN ASN A 4 11.135 0.068 1.593 1.00 0.00 X
+ATOM 28 H ASN A 4 9.574 2.105 -0.408 1.00 0.00 H
+ATOM 29 N PHE A 5 11.928 3.567 2.928 1.00 0.00 N
+ATOM 30 CA PHE A 5 12.907 4.611 3.209 1.00 0.00 C
+ATOM 31 C PHE A 5 14.220 4.344 2.485 1.00 0.00 C
+ATOM 32 O PHE A 5 14.593 3.192 2.261 1.00 0.00 O
+ATOM 33 CB PHE A 5 13.150 4.724 4.715 1.00 0.00 C
+ATOM 34 CEN PHE A 5 12.671 5.629 5.932 1.00 0.00 X
+ATOM 35 H PHE A 5 11.770 2.843 3.615 1.00 0.00 H
+ATOM 36 N THR A 6 14.918 5.414 2.122 1.00 0.00 N
+ATOM 37 CA THR A 6 16.277 5.304 1.604 1.00 0.00 C
+ATOM 38 C THR A 6 17.275 5.051 2.726 1.00 0.00 C
+ATOM 39 O THR A 6 17.002 5.341 3.891 1.00 0.00 O
+ATOM 40 CB THR A 6 16.693 6.572 0.836 1.00 0.00 C
+ATOM 41 CEN THR A 6 16.621 6.957 0.403 1.00 0.00 X
+ATOM 42 H THR A 6 14.497 6.328 2.207 1.00 0.00 H
+ATOM 43 N THR A 7 18.434 4.508 2.369 1.00 0.00 N
+ATOM 44 CA THR A 7 19.541 4.377 3.308 1.00 0.00 C
+ATOM 45 C THR A 7 19.966 5.736 3.851 1.00 0.00 C
+ATOM 46 O THR A 7 20.334 5.861 5.019 1.00 0.00 O
+ATOM 47 CB THR A 7 20.758 3.693 2.657 1.00 0.00 C
+ATOM 48 CEN THR A 7 21.009 3.240 2.387 1.00 0.00 X
+ATOM 49 H THR A 7 18.551 4.177 1.421 1.00 0.00 H
+ATOM 50 N ARG A 8 19.912 6.752 2.997 1.00 0.00 N
+ATOM 51 CA ARG A 8 20.338 8.094 3.374 1.00 0.00 C
+ATOM 52 C ARG A 8 19.465 8.656 4.489 1.00 0.00 C
+ATOM 53 O ARG A 8 19.961 9.295 5.417 1.00 0.00 O
+ATOM 54 CB ARG A 8 20.393 9.036 2.181 1.00 0.00 C
+ATOM 55 CEN ARG A 8 21.281 10.339 0.266 1.00 0.00 X
+ATOM 56 H ARG A 8 19.567 6.590 2.061 1.00 0.00 H
+ATOM 57 N GLN A 9 18.162 8.415 4.391 1.00 0.00 N
+ATOM 58 CA GLN A 9 17.217 8.892 5.394 1.00 0.00 C
+ATOM 59 C GLN A 9 17.233 8.006 6.632 1.00 0.00 C
+ATOM 60 O GLN A 9 17.250 8.499 7.760 1.00 0.00 O
+ATOM 61 CB GLN A 9 15.801 8.944 4.814 1.00 0.00 C
+ATOM 62 CEN GLN A 9 14.582 9.994 4.137 1.00 0.00 X
+ATOM 63 H GLN A 9 17.817 7.886 3.602 1.00 0.00 H
+ATOM 64 N LEU A 10 17.228 6.695 6.416 1.00 0.00 N
+ATOM 65 CA LEU A 10 17.340 5.738 7.510 1.00 0.00 C
+ATOM 66 C LEU A 10 18.699 5.837 8.192 1.00 0.00 C
+ATOM 67 O LEU A 10 18.799 5.737 9.415 1.00 0.00 O
+ATOM 68 CB LEU A 10 17.106 4.313 6.993 1.00 0.00 C
+ATOM 69 CEN LEU A 10 15.910 3.346 7.096 1.00 0.00 X
+ATOM 70 H LEU A 10 17.144 6.353 5.469 1.00 0.00 H
+ATOM 71 N THR A 11 19.743 6.034 7.394 1.00 0.00 N
+ATOM 72 CA THR A 11 21.092 6.191 7.923 1.00 0.00 C
+ATOM 73 C THR A 11 21.202 7.437 8.792 1.00 0.00 C
+ATOM 74 O THR A 11 21.886 7.433 9.815 1.00 0.00 O
+ATOM 75 CB THR A 11 22.136 6.272 6.793 1.00 0.00 C
+ATOM 76 CEN THR A 11 22.407 6.047 6.327 1.00 0.00 X
+ATOM 77 H THR A 11 19.598 6.076 6.395 1.00 0.00 H
+ATOM 78 N GLU A 12 20.523 8.502 8.379 1.00 0.00 N
+ATOM 79 CA GLU A 12 20.492 9.738 9.152 1.00 0.00 C
+ATOM 80 C GLU A 12 19.792 9.533 10.490 1.00 0.00 C
+ATOM 81 O GLU A 12 20.272 9.988 11.528 1.00 0.00 O
+ATOM 82 CB GLU A 12 19.798 10.848 8.360 1.00 0.00 C
+ATOM 83 CEN GLU A 12 19.886 12.229 7.366 1.00 0.00 X
+ATOM 84 H GLU A 12 20.016 8.454 7.507 1.00 0.00 H
+ATOM 85 N LEU A 13 18.655 8.846 10.458 1.00 0.00 N
+ATOM 86 CA LEU A 13 17.900 8.559 11.671 1.00 0.00 C
+ATOM 87 C LEU A 13 18.676 7.630 12.596 1.00 0.00 C
+ATOM 88 O LEU A 13 18.624 7.769 13.818 1.00 0.00 O
+ATOM 89 CB LEU A 13 16.540 7.944 11.316 1.00 0.00 C
+ATOM 90 CEN LEU A 13 15.108 8.511 11.303 1.00 0.00 X
+ATOM 91 H LEU A 13 18.305 8.515 9.570 1.00 0.00 H
+ATOM 92 N GLU A 14 19.396 6.682 12.006 1.00 0.00 N
+ATOM 93 CA GLU A 14 20.283 5.809 12.765 1.00 0.00 C
+ATOM 94 C GLU A 14 21.425 6.598 13.394 1.00 0.00 C
+ATOM 95 O GLU A 14 21.887 6.275 14.488 1.00 0.00 O
+ATOM 96 CB GLU A 14 20.840 4.701 11.870 1.00 0.00 C
+ATOM 97 CEN GLU A 14 20.794 3.092 11.309 1.00 0.00 X
+ATOM 98 H GLU A 14 19.326 6.562 11.005 1.00 0.00 H
+ATOM 99 N LYS A 15 21.877 7.634 12.695 1.00 0.00 N
+ATOM 100 CA LYS A 15 22.952 8.483 13.193 1.00 0.00 C
+ATOM 101 C LYS A 15 22.509 9.273 14.417 1.00 0.00 C
+ATOM 102 O LYS A 15 23.186 9.276 15.445 1.00 0.00 O
+ATOM 103 CB LYS A 15 23.432 9.437 12.097 1.00 0.00 C
+ATOM 104 CEN LYS A 15 24.892 9.946 10.653 1.00 0.00 X
+ATOM 105 H LYS A 15 21.465 7.838 11.796 1.00 0.00 H
+ATOM 106 N GLU A 16 21.367 9.943 14.301 1.00 0.00 N
+ATOM 107 CA GLU A 16 20.836 10.748 15.395 1.00 0.00 C
+ATOM 108 C GLU A 16 20.337 9.869 16.534 1.00 0.00 C
+ATOM 109 O GLU A 16 20.295 10.297 17.688 1.00 0.00 O
+ATOM 110 CB GLU A 16 19.708 11.653 14.895 1.00 0.00 C
+ATOM 111 CEN GLU A 16 19.163 13.177 14.364 1.00 0.00 X
+ATOM 112 H GLU A 16 20.853 9.892 13.433 1.00 0.00 H
+ATOM 113 N PHE A 17 19.960 8.639 16.204 1.00 0.00 N
+ATOM 114 CA PHE A 17 19.587 7.655 17.214 1.00 0.00 C
+ATOM 115 C PHE A 17 20.781 7.276 18.081 1.00 0.00 C
+ATOM 116 O PHE A 17 20.674 7.207 19.305 1.00 0.00 O
+ATOM 117 CB PHE A 17 19.000 6.407 16.552 1.00 0.00 C
+ATOM 118 CEN PHE A 17 17.569 5.792 16.234 1.00 0.00 X
+ATOM 119 H PHE A 17 19.931 8.378 15.229 1.00 0.00 H
+ATOM 120 N HIS A 18 21.918 7.031 17.439 1.00 0.00 N
+ATOM 121 CA HIS A 18 23.150 6.719 18.154 1.00 0.00 C
+ATOM 122 C HIS A 18 23.563 7.867 19.066 1.00 0.00 C
+ATOM 123 O HIS A 18 24.109 7.648 20.147 1.00 0.00 O
+ATOM 124 CB HIS A 18 24.280 6.400 17.170 1.00 0.00 C
+ATOM 125 CEN HIS A 18 24.880 5.252 16.577 1.00 0.00 X
+ATOM 126 H HIS A 18 21.929 7.062 16.429 1.00 0.00 H
+ATOM 127 N PHE A 19 23.298 9.092 18.624 1.00 0.00 N
+ATOM 128 CA PHE A 19 23.631 10.277 19.406 1.00 0.00 C
+ATOM 129 C PHE A 19 22.415 10.796 20.163 1.00 0.00 C
+ATOM 130 O PHE A 19 22.424 11.915 20.677 1.00 0.00 O
+ATOM 131 CB PHE A 19 24.195 11.374 18.500 1.00 0.00 C
+ATOM 132 CEN PHE A 19 25.613 11.949 18.071 1.00 0.00 X
+ATOM 133 H PHE A 19 22.856 9.205 17.723 1.00 0.00 H
+ATOM 134 N ASN A 20 21.371 9.977 20.228 1.00 0.00 N
+ATOM 135 CA ASN A 20 20.134 10.365 20.896 1.00 0.00 C
+ATOM 136 C ASN A 20 19.640 11.717 20.397 1.00 0.00 C
+ATOM 137 O ASN A 20 18.714 12.298 20.964 1.00 0.00 O
+ATOM 138 CB ASN A 20 20.302 10.392 22.404 1.00 0.00 C
+ATOM 139 CEN ASN A 20 20.166 9.743 23.217 1.00 0.00 X
+ATOM 140 H ASN A 20 21.436 9.063 19.805 1.00 0.00 H
+ATOM 141 N LYS A 21 20.262 12.213 19.333 1.00 0.00 N
+ATOM 142 CA LYS A 21 19.896 13.505 18.765 1.00 0.00 C
+ATOM 143 C LYS A 21 18.470 13.488 18.230 1.00 0.00 C
+ATOM 144 O LYS A 21 17.744 14.476 18.341 1.00 0.00 O
+ATOM 145 CB LYS A 21 20.871 13.896 17.653 1.00 0.00 C
+ATOM 146 CEN LYS A 21 22.509 15.072 17.013 1.00 0.00 X
+ATOM 147 H LYS A 21 21.007 11.681 18.906 1.00 0.00 H
+ATOM 148 N TYR A 22 18.075 12.361 17.649 1.00 0.00 N
+ATOM 149 CA TYR A 22 16.732 12.210 17.103 1.00 0.00 C
+ATOM 150 C TYR A 22 15.679 12.283 18.202 1.00 0.00 C
+ATOM 151 O TYR A 22 14.632 12.908 18.031 1.00 0.00 O
+ATOM 152 CB TYR A 22 16.607 10.887 16.344 1.00 0.00 C
+ATOM 153 CEN TYR A 22 16.631 10.263 14.707 1.00 0.00 X
+ATOM 154 H TYR A 22 18.722 11.588 17.583 1.00 0.00 H
+ATOM 155 N LEU A 23 15.963 11.641 19.330 1.00 0.00 N
+ATOM 156 CA LEU A 23 15.041 11.632 20.459 1.00 0.00 C
+ATOM 157 C LEU A 23 14.863 13.030 21.037 1.00 0.00 C
+ATOM 158 O LEU A 23 13.755 13.427 21.395 1.00 0.00 O
+ATOM 159 CB LEU A 23 15.538 10.665 21.541 1.00 0.00 C
+ATOM 160 CEN LEU A 23 15.093 9.253 21.966 1.00 0.00 X
+ATOM 161 H LEU A 23 16.841 11.148 19.407 1.00 0.00 H
+ATOM 162 N SER A 24 15.962 13.772 21.126 1.00 0.00 N
+ATOM 163 CA SER A 24 15.917 15.156 21.581 1.00 0.00 C
+ATOM 164 C SER A 24 15.372 16.075 20.495 1.00 0.00 C
+ATOM 165 O SER A 24 15.002 17.218 20.764 1.00 0.00 O
+ATOM 166 CB SER A 24 17.298 15.609 22.012 1.00 0.00 C
+ATOM 167 CEN SER A 24 17.840 15.652 22.017 1.00 0.00 X
+ATOM 168 H SER A 24 16.851 13.366 20.872 1.00 0.00 H
+ATOM 169 N ARG A 25 15.324 15.569 19.268 1.00 0.00 N
+ATOM 170 CA ARG A 25 14.821 16.343 18.139 1.00 0.00 C
+ATOM 171 C ARG A 25 13.819 15.538 17.322 1.00 0.00 C
+ATOM 172 O ARG A 25 13.804 15.610 16.093 1.00 0.00 O
+ATOM 173 CB ARG A 25 15.945 16.882 17.266 1.00 0.00 C
+ATOM 174 CEN ARG A 25 17.644 18.426 16.326 1.00 0.00 X
+ATOM 175 H ARG A 25 15.645 14.624 19.112 1.00 0.00 H
+ATOM 176 N ALA A 26 12.981 14.771 18.012 1.00 0.00 N
+ATOM 177 CA ALA A 26 12.020 13.898 17.350 1.00 0.00 C
+ATOM 178 C ALA A 26 10.971 14.705 16.595 1.00 0.00 C
+ATOM 179 O ALA A 26 10.501 14.291 15.535 1.00 0.00 O
+ATOM 180 CB ALA A 26 11.356 12.976 18.362 1.00 0.00 C
+ATOM 181 CEN ALA A 26 11.356 12.976 18.361 1.00 0.00 X
+ATOM 182 H ALA A 26 13.012 14.793 19.021 1.00 0.00 H
+ATOM 183 N ARG A 27 10.609 15.858 17.147 1.00 0.00 N
+ATOM 184 CA ARG A 27 9.619 16.727 16.524 1.00 0.00 C
+ATOM 185 C ARG A 27 10.165 17.363 15.253 1.00 0.00 C
+ATOM 186 O ARG A 27 9.472 17.442 14.239 1.00 0.00 O
+ATOM 187 CB ARG A 27 9.090 17.778 17.490 1.00 0.00 C
+ATOM 188 CEN ARG A 27 7.633 18.915 19.144 1.00 0.00 X
+ATOM 189 H ARG A 27 11.032 16.139 18.020 1.00 0.00 H
+ATOM 190 N ARG A 28 11.413 17.816 15.313 1.00 0.00 N
+ATOM 191 CA ARG A 28 12.061 18.431 14.161 1.00 0.00 C
+ATOM 192 C ARG A 28 12.148 17.457 12.993 1.00 0.00 C
+ATOM 193 O ARG A 28 11.869 17.818 11.849 1.00 0.00 O
+ATOM 194 CB ARG A 28 13.426 19.006 14.509 1.00 0.00 C
+ATOM 195 CEN ARG A 28 15.187 20.631 15.150 1.00 0.00 X
+ATOM 196 H ARG A 28 11.926 17.732 16.179 1.00 0.00 H
+ATOM 197 N VAL A 29 12.536 16.221 13.287 1.00 0.00 N
+ATOM 198 CA VAL A 29 12.684 15.199 12.258 1.00 0.00 C
+ATOM 199 C VAL A 29 11.381 14.441 12.044 1.00 0.00 C
+ATOM 200 O VAL A 29 10.949 14.238 10.909 1.00 0.00 O
+ATOM 201 CB VAL A 29 13.798 14.196 12.614 1.00 0.00 C
+ATOM 202 CEN VAL A 29 14.433 13.990 12.445 1.00 0.00 X
+ATOM 203 H VAL A 29 12.734 15.984 14.249 1.00 0.00 H
+ATOM 204 N GLU A 30 10.758 14.023 13.140 1.00 0.00 N
+ATOM 205 CA GLU A 30 9.560 13.194 13.073 1.00 0.00 C
+ATOM 206 C GLU A 30 8.468 13.871 12.254 1.00 0.00 C
+ATOM 207 O GLU A 30 7.782 13.224 11.462 1.00 0.00 O
+ATOM 208 CB GLU A 30 9.045 12.881 14.479 1.00 0.00 C
+ATOM 209 CEN GLU A 30 8.924 11.817 15.805 1.00 0.00 X
+ATOM 210 H GLU A 30 11.124 14.286 14.044 1.00 0.00 H
+ATOM 211 N ILE A 31 8.312 15.176 12.449 1.00 0.00 N
+ATOM 212 CA ILE A 31 7.296 15.941 11.735 1.00 0.00 C
+ATOM 213 C ILE A 31 7.616 16.029 10.249 1.00 0.00 C
+ATOM 214 O ILE A 31 6.732 15.884 9.404 1.00 0.00 O
+ATOM 215 CB ILE A 31 7.156 17.364 12.306 1.00 0.00 C
+ATOM 216 CEN ILE A 31 6.674 17.976 13.069 1.00 0.00 X
+ATOM 217 H ILE A 31 8.913 15.650 13.108 1.00 0.00 H
+ATOM 218 N ALA A 32 8.885 16.268 9.935 1.00 0.00 N
+ATOM 219 CA ALA A 32 9.329 16.349 8.548 1.00 0.00 C
+ATOM 220 C ALA A 32 9.047 15.051 7.803 1.00 0.00 C
+ATOM 221 O ALA A 32 8.518 15.064 6.692 1.00 0.00 O
+ATOM 222 CB ALA A 32 10.811 16.689 8.486 1.00 0.00 C
+ATOM 223 CEN ALA A 32 10.810 16.688 8.485 1.00 0.00 X
+ATOM 224 H ALA A 32 9.559 16.397 10.676 1.00 0.00 H
+ATOM 225 N ALA A 33 9.404 13.930 8.421 1.00 0.00 N
+ATOM 226 CA ALA A 33 9.179 12.620 7.822 1.00 0.00 C
+ATOM 227 C ALA A 33 7.694 12.365 7.595 1.00 0.00 C
+ATOM 228 O ALA A 33 7.298 11.829 6.560 1.00 0.00 O
+ATOM 229 CB ALA A 33 9.779 11.528 8.696 1.00 0.00 C
+ATOM 230 CEN ALA A 33 9.778 11.528 8.695 1.00 0.00 X
+ATOM 231 H ALA A 33 9.842 13.987 9.329 1.00 0.00 H
+ATOM 232 N THR A 34 6.877 12.753 8.568 1.00 0.00 N
+ATOM 233 CA THR A 34 5.436 12.550 8.485 1.00 0.00 C
+ATOM 234 C THR A 34 4.851 13.246 7.263 1.00 0.00 C
+ATOM 235 O THR A 34 3.853 12.797 6.698 1.00 0.00 O
+ATOM 236 CB THR A 34 4.718 13.063 9.747 1.00 0.00 C
+ATOM 237 CEN THR A 34 4.627 13.059 10.324 1.00 0.00 X
+ATOM 238 H THR A 34 7.264 13.200 9.387 1.00 0.00 H
+ATOM 239 N LEU A 35 5.478 14.345 6.858 1.00 0.00 N
+ATOM 240 CA LEU A 35 4.994 15.133 5.730 1.00 0.00 C
+ATOM 241 C LEU A 35 5.232 14.410 4.411 1.00 0.00 C
+ATOM 242 O LEU A 35 4.353 14.365 3.549 1.00 0.00 O
+ATOM 243 CB LEU A 35 5.671 16.509 5.715 1.00 0.00 C
+ATOM 244 CEN LEU A 35 5.186 17.918 6.106 1.00 0.00 X
+ATOM 245 H LEU A 35 6.312 14.643 7.343 1.00 0.00 H
+ATOM 246 N GLU A 36 6.425 13.846 4.258 1.00 0.00 N
+ATOM 247 CA GLU A 36 6.911 13.424 2.950 1.00 0.00 C
+ATOM 248 C GLU A 36 6.977 11.906 2.849 1.00 0.00 C
+ATOM 249 O GLU A 36 6.717 11.332 1.792 1.00 0.00 O
+ATOM 250 CB GLU A 36 8.288 14.030 2.669 1.00 0.00 C
+ATOM 251 CEN GLU A 36 9.254 15.222 1.928 1.00 0.00 X
+ATOM 252 H GLU A 36 7.010 13.705 5.069 1.00 0.00 H
+ATOM 253 N LEU A 37 7.326 11.259 3.956 1.00 0.00 N
+ATOM 254 CA LEU A 37 7.811 9.885 3.920 1.00 0.00 C
+ATOM 255 C LEU A 37 6.687 8.897 4.201 1.00 0.00 C
+ATOM 256 O LEU A 37 5.604 9.282 4.643 1.00 0.00 O
+ATOM 257 CB LEU A 37 8.951 9.698 4.930 1.00 0.00 C
+ATOM 258 CEN LEU A 37 10.479 9.583 4.772 1.00 0.00 X
+ATOM 259 H LEU A 37 7.254 11.732 4.846 1.00 0.00 H
+ATOM 260 N ASN A 38 6.949 7.620 3.943 1.00 0.00 N
+ATOM 261 CA ASN A 38 5.962 6.572 4.175 1.00 0.00 C
+ATOM 262 C ASN A 38 6.019 6.071 5.612 1.00 0.00 C
+ATOM 263 O ASN A 38 7.032 6.225 6.294 1.00 0.00 O
+ATOM 264 CB ASN A 38 6.141 5.416 3.208 1.00 0.00 C
+ATOM 265 CEN ASN A 38 5.775 5.116 2.272 1.00 0.00 X
+ATOM 266 H ASN A 38 7.856 7.369 3.576 1.00 0.00 H
+ATOM 267 N GLU A 39 4.925 5.469 6.067 1.00 0.00 N
+ATOM 268 CA GLU A 39 4.855 4.928 7.419 1.00 0.00 C
+ATOM 269 C GLU A 39 5.870 3.809 7.618 1.00 0.00 C
+ATOM 270 O GLU A 39 6.567 3.764 8.632 1.00 0.00 O
+ATOM 271 CB GLU A 39 3.444 4.417 7.719 1.00 0.00 C
+ATOM 272 CEN GLU A 39 1.909 4.646 8.423 1.00 0.00 X
+ATOM 273 H GLU A 39 4.122 5.385 5.461 1.00 0.00 H
+ATOM 274 N THR A 40 5.947 2.908 6.646 1.00 0.00 N
+ATOM 275 CA THR A 40 6.903 1.808 6.695 1.00 0.00 C
+ATOM 276 C THR A 40 8.337 2.322 6.657 1.00 0.00 C
+ATOM 277 O THR A 40 9.218 1.784 7.327 1.00 0.00 O
+ATOM 278 CB THR A 40 6.692 0.823 5.531 1.00 0.00 C
+ATOM 279 CEN THR A 40 6.361 0.446 5.230 1.00 0.00 X
+ATOM 280 H THR A 40 5.328 2.986 5.852 1.00 0.00 H
+ATOM 281 N GLN A 41 8.564 3.368 5.869 1.00 0.00 N
+ATOM 282 CA GLN A 41 9.881 3.987 5.779 1.00 0.00 C
+ATOM 283 C GLN A 41 10.276 4.637 7.099 1.00 0.00 C
+ATOM 284 O GLN A 41 11.396 4.461 7.578 1.00 0.00 O
+ATOM 285 CB GLN A 41 9.906 5.034 4.661 1.00 0.00 C
+ATOM 286 CEN GLN A 41 10.391 5.338 3.012 1.00 0.00 X
+ATOM 287 H GLN A 41 7.805 3.743 5.318 1.00 0.00 H
+ATOM 288 N VAL A 42 9.348 5.387 7.684 1.00 0.00 N
+ATOM 289 CA VAL A 42 9.590 6.047 8.961 1.00 0.00 C
+ATOM 290 C VAL A 42 9.917 5.035 10.051 1.00 0.00 C
+ATOM 291 O VAL A 42 10.812 5.254 10.868 1.00 0.00 O
+ATOM 292 CB VAL A 42 8.377 6.888 9.402 1.00 0.00 C
+ATOM 293 CEN VAL A 42 8.151 7.533 9.486 1.00 0.00 X
+ATOM 294 H VAL A 42 8.452 5.503 7.232 1.00 0.00 H
+ATOM 295 N LYS A 43 9.187 3.925 10.060 1.00 0.00 N
+ATOM 296 CA LYS A 43 9.400 2.875 11.049 1.00 0.00 C
+ATOM 297 C LYS A 43 10.614 2.025 10.697 1.00 0.00 C
+ATOM 298 O LYS A 43 11.377 1.622 11.575 1.00 0.00 O
+ATOM 299 CB LYS A 43 8.157 1.992 11.168 1.00 0.00 C
+ATOM 300 CEN LYS A 43 6.426 1.440 12.253 1.00 0.00 X
+ATOM 301 H LYS A 43 8.466 3.806 9.363 1.00 0.00 H
+ATOM 302 N ILE A 44 10.788 1.756 9.408 1.00 0.00 N
+ATOM 303 CA ILE A 44 11.916 0.961 8.936 1.00 0.00 C
+ATOM 304 C ILE A 44 13.242 1.617 9.299 1.00 0.00 C
+ATOM 305 O ILE A 44 14.186 0.944 9.712 1.00 0.00 O
+ATOM 306 CB ILE A 44 11.860 0.748 7.413 1.00 0.00 C
+ATOM 307 CEN ILE A 44 11.455 0.127 6.613 1.00 0.00 X
+ATOM 308 H ILE A 44 10.122 2.110 8.737 1.00 0.00 H
+ATOM 309 N TRP A 45 13.306 2.935 9.144 1.00 0.00 N
+ATOM 310 CA TRP A 45 14.512 3.687 9.468 1.00 0.00 C
+ATOM 311 C TRP A 45 14.986 3.385 10.884 1.00 0.00 C
+ATOM 312 O TRP A 45 16.183 3.242 11.132 1.00 0.00 O
+ATOM 313 CB TRP A 45 14.265 5.188 9.307 1.00 0.00 C
+ATOM 314 CEN TRP A 45 14.783 6.587 8.386 1.00 0.00 X
+ATOM 315 H TRP A 45 12.498 3.429 8.792 1.00 0.00 H
+ATOM 316 N PHE A 46 14.039 3.289 11.811 1.00 0.00 N
+ATOM 317 CA PHE A 46 14.359 3.025 13.209 1.00 0.00 C
+ATOM 318 C PHE A 46 14.644 1.546 13.439 1.00 0.00 C
+ATOM 319 O PHE A 46 15.480 1.187 14.268 1.00 0.00 O
+ATOM 320 CB PHE A 46 13.217 3.488 14.116 1.00 0.00 C
+ATOM 321 CEN PHE A 46 12.851 4.742 15.021 1.00 0.00 X
+ATOM 322 H PHE A 46 13.072 3.402 11.541 1.00 0.00 H
+ATOM 323 N GLN A 47 13.943 0.692 12.701 1.00 0.00 N
+ATOM 324 CA GLN A 47 14.233 -0.737 12.700 1.00 0.00 C
+ATOM 325 C GLN A 47 15.665 -1.009 12.257 1.00 0.00 C
+ATOM 326 O GLN A 47 16.313 -1.930 12.752 1.00 0.00 O
+ATOM 327 CB GLN A 47 13.258 -1.481 11.784 1.00 0.00 C
+ATOM 328 CEN GLN A 47 11.812 -2.457 11.743 1.00 0.00 X
+ATOM 329 H GLN A 47 13.191 1.042 12.125 1.00 0.00 H
+ATOM 330 N ASN A 48 16.153 -0.201 11.322 1.00 0.00 N
+ATOM 331 CA ASN A 48 17.525 -0.322 10.845 1.00 0.00 C
+ATOM 332 C ASN A 48 18.518 -0.241 11.998 1.00 0.00 C
+ATOM 333 O ASN A 48 19.456 -1.034 12.079 1.00 0.00 O
+ATOM 334 CB ASN A 48 17.845 0.733 9.802 1.00 0.00 C
+ATOM 335 CEN ASN A 48 17.826 0.831 8.757 1.00 0.00 X
+ATOM 336 H ASN A 48 15.558 0.516 10.932 1.00 0.00 H
+ATOM 337 N ARG A 49 18.306 0.722 12.888 1.00 0.00 N
+ATOM 338 CA ARG A 49 19.180 0.906 14.041 1.00 0.00 C
+ATOM 339 C ARG A 49 19.131 -0.302 14.967 1.00 0.00 C
+ATOM 340 O ARG A 49 20.159 -0.745 15.480 1.00 0.00 O
+ATOM 341 CB ARG A 49 18.877 2.195 14.791 1.00 0.00 C
+ATOM 342 CEN ARG A 49 19.009 4.559 15.531 1.00 0.00 X
+ATOM 343 H ARG A 49 17.519 1.343 12.763 1.00 0.00 H
+ATOM 344 N ARG A 50 17.931 -0.832 15.177 1.00 0.00 N
+ATOM 345 CA ARG A 50 17.754 -2.028 15.993 1.00 0.00 C
+ATOM 346 C ARG A 50 17.692 -3.280 15.128 1.00 0.00 C
+ATOM 347 O ARG A 50 17.569 -3.197 13.906 1.00 0.00 O
+ATOM 348 CB ARG A 50 16.544 -1.924 16.909 1.00 0.00 C
+ATOM 349 CEN ARG A 50 15.168 -1.513 18.932 1.00 0.00 X
+ATOM 350 H ARG A 50 17.121 -0.396 14.761 1.00 0.00 H
+ATOM 351 N MET A 51 17.777 -4.441 15.769 1.00 0.00 N
+ATOM 352 CA MET A 51 17.761 -5.713 15.056 1.00 0.00 C
+ATOM 353 C MET A 51 16.508 -6.514 15.386 1.00 0.00 C
+ATOM 354 O MET A 51 16.277 -6.876 16.540 1.00 0.00 O
+ATOM 355 CB MET A 51 19.011 -6.523 15.395 1.00 0.00 C
+ATOM 356 CEN MET A 51 20.525 -7.097 14.721 1.00 0.00 X
+ATOM 357 H MET A 51 17.854 -4.442 16.776 1.00 0.00 H
+ATOM 358 N LYS A 52 15.702 -6.788 14.367 1.00 0.00 N
+ATOM 359 CA LYS A 52 14.493 -7.585 14.539 1.00 0.00 C
+ATOM 360 C LYS A 52 14.825 -9.065 14.682 1.00 0.00 C
+ATOM 361 O LYS A 52 15.349 -9.686 13.757 1.00 0.00 O
+ATOM 362 CB LYS A 52 13.539 -7.372 13.362 1.00 0.00 C
+ATOM 363 CEN LYS A 52 11.779 -6.480 12.598 1.00 0.00 X
+ATOM 364 H LYS A 52 15.932 -6.435 13.449 1.00 0.00 H
+ATOM 365 N GLN A 53 14.516 -9.625 15.847 1.00 0.00 N
+ATOM 366 CA GLN A 53 14.786 -11.033 16.115 1.00 0.00 C
+ATOM 367 C GLN A 53 13.551 -11.888 15.865 1.00 0.00 C
+ATOM 368 O GLN A 53 12.455 -11.560 16.320 1.00 0.00 O
+ATOM 369 CB GLN A 53 15.262 -11.222 17.558 1.00 0.00 C
+ATOM 370 CEN GLN A 53 16.663 -11.453 18.572 1.00 0.00 X
+ATOM 371 H GLN A 53 14.084 -9.062 16.565 1.00 0.00 H
+ATOM 372 N LYS A 54 13.734 -12.985 15.139 1.00 0.00 N
+ATOM 373 CA LYS A 54 12.628 -13.873 14.799 1.00 0.00 C
+ATOM 374 C LYS A 54 12.482 -14.989 15.825 1.00 0.00 C
+ATOM 375 O LYS A 54 13.419 -15.294 16.562 1.00 0.00 O
+ATOM 376 CB LYS A 54 12.826 -14.465 13.403 1.00 0.00 C
+ATOM 377 CEN LYS A 54 12.306 -14.477 11.352 1.00 0.00 X
+ATOM 378 H LYS A 54 14.663 -13.211 14.815 1.00 0.00 H
+ATOM 379 N LYS A 55 11.301 -15.596 15.868 1.00 0.00 N
+ATOM 380 CA LYS A 55 11.023 -16.666 16.818 1.00 0.00 C
+ATOM 381 C LYS A 55 11.024 -18.026 16.132 1.00 0.00 C
+ATOM 382 O LYS A 55 10.622 -18.149 14.975 1.00 0.00 O
+ATOM 383 CB LYS A 55 9.682 -16.429 17.514 1.00 0.00 C
+ATOM 384 CEN LYS A 55 8.622 -15.820 19.241 1.00 0.00 X
+ATOM 385 H LYS A 55 10.576 -15.308 15.225 1.00 0.00 H
+ATOM 386 N ARG A 56 11.479 -19.046 16.852 1.00 0.00 N
+ATOM 387 CA ARG A 56 11.504 -20.405 16.325 1.00 0.00 C
+ATOM 388 C ARG A 56 10.172 -21.108 16.548 1.00 0.00 C
+ATOM 389 O ARG A 56 9.519 -20.911 17.573 1.00 0.00 O
+ATOM 390 CB ARG A 56 12.663 -21.216 16.885 1.00 0.00 C
+ATOM 391 CEN ARG A 56 14.893 -22.283 17.085 1.00 0.00 X
+ATOM 392 H ARG A 56 11.815 -18.875 17.789 1.00 0.00 H
+ATOM 393 N GLU A 57 9.772 -21.929 15.582 1.00 0.00 N
+ATOM 394 CA GLU A 57 8.522 -22.673 15.678 1.00 0.00 C
+ATOM 395 C GLU A 57 8.590 -23.724 16.778 1.00 0.00 C
+ATOM 396 O GLU A 57 9.622 -24.366 16.974 1.00 0.00 O
+ATOM 397 CB GLU A 57 8.189 -23.334 14.338 1.00 0.00 C
+ATOM 398 CEN GLU A 57 7.330 -23.337 12.867 1.00 0.00 X
+ATOM 399 H GLU A 57 10.350 -22.040 14.761 1.00 0.00 H
+ATOM 400 N ARG A 58 7.483 -23.897 17.493 1.00 0.00 N
+ATOM 401 CA ARG A 58 7.391 -24.921 18.527 1.00 0.00 C
+ATOM 402 C ARG A 58 6.761 -26.197 17.983 1.00 0.00 C
+ATOM 403 O ARG A 58 6.513 -27.145 18.728 1.00 0.00 O
+ATOM 404 CB ARG A 58 6.661 -24.423 19.765 1.00 0.00 C
+ATOM 405 CEN ARG A 58 6.256 -23.478 22.022 1.00 0.00 X
+ATOM 406 H ARG A 58 6.686 -23.303 17.317 1.00 0.00 H
+ATOM 407 N GLU A 59 6.502 -26.214 16.680 1.00 0.00 N
+ATOM 408 CA GLU A 59 5.802 -27.328 16.052 1.00 0.00 C
+ATOM 409 C GLU A 59 4.487 -27.622 16.762 1.00 0.00 C
+ATOM 410 O GLU A 59 3.451 -27.549 16.160 1.00 0.00 O
+ATOM 411 CB GLU A 59 6.684 -28.579 16.042 1.00 0.00 C
+ATOM 412 CEN GLU A 59 7.749 -29.628 15.225 1.00 0.00 X
+ATOM 413 H GLU A 59 6.799 -25.435 16.109 1.00 0.00 H
TER
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE ./data/prediction.pdb
label vdw pair env cbeta total
weights 1 1 1 1 NA
-pose 0.02292 -18.7286 -29.6068 25.0958 -23.2168
-LEU:NtermProteinFull_1 0 -1.49156 0.16253 0.24067 -1.08836
-ARG_2 0 -0.10568 -1.50839 0.59991 -1.01416
-THR_3 0 -0.11882 0.24268 0.57143 0.6953
-ASN_4 0 0.19621 -0.48355 0.34436 0.05702
-PHE_5 0 -0.37593 -0.76843 0.36816 -0.77621
-THR_6 0 0.03199 -0.41248 0.45392 0.07343
-THR_7 0 -0.34091 -0.40703 0.45457 -0.29337
-ARG_8 0 -0.33894 -1.11166 0.56199 -0.88861
-GLN_9 0 0.12299 -0.49122 0.3422 -0.02603
-LEU_10 0.00861 -1.56565 -0.78297 0.28564 -2.05437
-THR_11 0 -0.30822 -0.20634 0.28492 -0.22965
-GLU_12 0 -0.80022 -1.43167 0.55023 -1.68166
-LEU_13 0 -1.0869 -0.13164 0.2934 -0.92514
-GLU_14 0 -2.00929 1.27157 0.29932 -0.43841
-LYS_15 0 -1.84348 -0.85222 0.3422 -2.3535
-GLU_16 0 -0.30572 -1.85203 0.55151 -1.60624
-PHE_17 0 0.05012 0.14274 0.28156 0.47442
-HIS_18 0 -0.11267 -0.38987 0.55543 0.05289
-PHE_19 0 0.57597 2.54293 0.55647 3.67537
-ASN_20 0 -0.06831 -0.81931 0.56647 -0.32115
-LYS_21 0 -0.24837 -2.09855 0.57623 -1.77068
-TYR_22 0 0.07266 1.5936 0.57695 2.24321
-LEU_23 0 0.01496 1.1799 0.28156 1.47642
-SER_24 0 0.04769 -0.43085 0.35644 -0.02672
-ARG_25 0 -0.70374 -0.86534 0.55759 -1.0115
-ALA_26 0 0.00586 0.8284 0.57143 1.40568
-ARG_27 0 0.07617 -0.72563 0.31791 -0.33156
-ARG_28 0 -0.91381 -0.21987 0.28068 -0.853
-VAL_29 0 0.45387 0.93843 0.55351 1.94581
-GLU_30 0 0.02421 -1.43167 0.55661 -0.85085
-ILE_31 0 -0.29297 -0.83365 0.24139 -0.88522
-ALA_32 0 -0.29012 -0.03695 0.31123 -0.01584
-ALA_33 0 0.00966 0.30608 0.28244 0.59817
-THR_34 0 0.18265 -0.41248 0.34436 0.11453
-LEU_35 0 -0.71068 -0.38967 0.27947 -0.82087
-GLU_36 0 -0.35977 -1.65356 0.55687 -1.45646
-LEU_37 0 -0.42108 -0.60732 0.38493 -0.64346
-ASN_38 0 -0.16856 -0.81931 0.55647 -0.4314
-GLU_39 0 0 -2.06806 0.57071 -1.49735
-THR_40 0 0.00576 0.24268 0.57143 0.81988
-GLN_41 0 0.037 -0.18373 0.27899 0.13226
-VAL_42 0 -0.69871 -0.20876 0.28213 -0.62535
-LYS_43 0 0.0421 -1.743 0.35268 -1.34822
-ILE_44 0 -0.11642 1.45005 0.55272 1.88635
-TRP_45 0.00861 -0.11717 -1.14336 0.28932 -0.9626
-PHE_46 0.00285 -0.02226 0.14274 0.34877 0.4721
-GLN_47 0 0.04146 -1.19606 0.46045 -0.69415
-ASN_48 0 -0.28287 -0.38805 0.34235 -0.32857
-ARG_49 0 0.00994 0.80477 0.28644 1.10115
-ARG_50 0.00285 -0.02652 -0.86534 0.55223 -0.33679
-MET_51 0 0.01147 0.58854 0.55687 1.15688
-LYS_52 0 -0.9076 -1.0307 0.28064 -1.65766
-GLN_53 0 -0.29103 -0.65819 0.55143 -0.3978
-LYS_54 0 0 -1.97983 0.58775 -1.39208
-LYS_55 0 0.02315 -2.21323 0.58071 -1.60937
-ARG_56 0 -1.26311 -0.53907 0.24067 -1.56151
-GLU_57 0 -0.70675 -2.06806 0.37141 -2.40341
-ARG_58 0 -0.09322 -1.73331 0.57623 -1.2503
-GLU:CtermProteinFull_59 0 -1.25745 -1.85203 0.37141 -2.73808
+pose 0.26961 -11.5409 -30.6183 25.9103 -15.9793
+LEU:NtermProteinFull_1 0 0.1066 1.77006 0.58806 2.46471
+ARG_2 1e-05 -0.83742 -0.86534 0.34756 -1.35519
+THR_3 0 -0.49641 0.04179 0.35268 -0.10193
+ASN_4 0.00314 -0.61108 -0.64346 0.32188 -0.92951
+PHE_5 0.00499 -0.22296 -0.76843 0.30868 -0.67772
+THR_6 0 -0.14039 -0.35797 0.34436 -0.154
+THR_7 4e-05 -0.05239 0.04179 0.55647 0.54592
+ARG_8 0 -0.01517 -1.29317 0.57695 -0.73139
+GLN_9 0 0.04026 -0.03392 0.23859 0.24493
+LEU_10 0 0.22486 -0.60732 0.2414 -0.14106
+THR_11 4e-05 -0.20953 -0.40703 0.4766 -0.13992
+GLU_12 0 -0.20404 -0.75087 0.55279 -0.40212
+LEU_13 0 -0.72916 -0.91622 0.24907 -1.39631
+GLU_14 0 -0.93833 -0.75087 0.31914 -1.37006
+LYS_15 0 -0.0277 -1.20373 0.55151 -0.67992
+GLU_16 0 -0.86208 0.29134 0.23859 -0.33215
+PHE_17 0 -0.02866 0.48153 0.28156 0.73442
+HIS_18 0 0.00227 0.40723 0.55955 0.96905
+PHE_19 0.00162 0.00801 2.39837 0.57143 2.97942
+ASN_20 0 -0.15923 -0.72442 0.57143 -0.31221
+LYS_21 0.00162 -0.13248 -1.37777 0.28564 -1.22299
+TYR_22 0 -0.33384 -0.95418 0.24403 -1.04399
+LEU_23 0 0.0723 2.24917 0.55511 2.87658
+SER_24 0 0 -0.43085 0.55687 0.12601
+ARG_25 0 -0.77401 -0.97053 0.28564 -1.45891
+ALA_26 0.11328 0.04646 0.27277 0.55095 0.98345
+ARG_27 0 0 -1.50839 0.57623 -0.93216
+ARG_28 0 -0.29257 -0.78741 0.57143 -0.50855
+VAL_29 0 0.24188 -0.20876 0.26607 0.29918
+GLU_30 0.11328 0.21404 -0.75087 0.55095 0.1274
+ILE_31 0 -0.04272 2.23322 0.56459 2.75509
+ALA_32 0 -0.0337 0.30608 0.46175 0.73413
+ALA_33 0 -0.34671 -0.03695 0.24067 -0.14299
+THR_34 0 0.0749 0.04179 0.43282 0.54952
+LEU_35 0 0 1.77006 0.58071 2.35077
+GLU_36 0 -0.15702 -2.00083 0.55439 -1.60346
+LEU_37 0 -0.02434 -0.38967 0.27803 -0.13597
+ASN_38 1e-05 -0.77131 -0.48355 0.24227 -1.01258
+GLU_39 0 -0.75873 -2.00083 0.5628 -2.19675
+THR_40 0 -0.15598 -0.35797 0.32353 -0.19042
+GLN_41 0.00813 -0.53226 -0.33374 0.27675 -0.58111
+VAL_42 0 -0.51539 -0.39189 0.35108 -0.55619
+LYS_43 0 -0.22676 -1.55725 0.55191 -1.23211
+ILE_44 0 0.03445 0.95357 0.27667 1.26469
+TRP_45 0 -0.9277 -1.15164 0.24635 -1.83299
+PHE_46 0 -0.4914 -0.60247 0.3414 -0.75247
+GLN_47 0.01172 0.13738 -1.19606 0.34408 -0.70287
+ASN_48 0 -0.03032 -0.38805 0.34479 -0.07358
+ARG_49 0 -0.60002 -0.34727 0.31366 -0.63362
+ARG_50 0.01172 0.11757 -1.11166 0.56575 -0.41662
+MET_51 0 0.00855 -0.81103 0.58071 -0.22177
+LYS_52 0 -0.18858 -1.743 0.56875 -1.36284
+GLN_53 0 0 -1.05594 0.59991 -0.45602
+LYS_54 0 0 -2.21323 0.59831 -1.61492
+LYS_55 0 0 -2.09855 0.59991 -1.49863
+ARG_56 0 0 -1.91744 0.59991 -1.31753
+GLU_57 0 0 -2.02607 0.60584 -1.42023
+ARG_58 0 0 -1.73331 0.60584 -1.12748
+GLU:CtermProteinFull_59 0 0 -1.61722 0.60584 -1.01138
#END_POSE_ENERGIES_TABLE ./data/prediction.pdb
diff --git a/4_MCMC/img/2i9m.png b/4_MCMC/img/2i9m.png
new file mode 100644
index 0000000..9344343
Binary files /dev/null and b/4_MCMC/img/2i9m.png differ
diff --git a/4_MCMC/img/mcmc_river.jpg b/4_MCMC/img/mcmc_river.jpg
new file mode 100644
index 0000000..5b24c8d
Binary files /dev/null and b/4_MCMC/img/mcmc_river.jpg differ
diff --git a/4_MCMC/img/sample_mcm.png b/4_MCMC/img/sample_mcm.png
new file mode 100644
index 0000000..571bf5c
Binary files /dev/null and b/4_MCMC/img/sample_mcm.png differ
diff --git a/5_Residue_Selector/.ipynb_checkpoints/5_0_ResidueSelectors_Logic-checkpoint.ipynb b/5_Residue_Selector/.ipynb_checkpoints/5_0_ResidueSelectors_Logic-checkpoint.ipynb
index d01dece..3836730 100644
--- a/5_Residue_Selector/.ipynb_checkpoints/5_0_ResidueSelectors_Logic-checkpoint.ipynb
+++ b/5_Residue_Selector/.ipynb_checkpoints/5_0_ResidueSelectors_Logic-checkpoint.ipynb
@@ -44,15 +44,15 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release 2020.50+release.1295438cd4bd2be39c9dbbfab8db669ab62415ab 2020-12-12T00:30:01] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.31+release.c7009b3115c22daa9efe2805d9d1ebba08426a54 2021-08-07T10:04:12] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
"\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release r274 2020.50+release.1295438cd4b 1295438cd4bd2be39c9dbbfab8db669ab62415ab http://www.pyrosetta.org 2020-12-12T00:30:01\n",
- "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.6/site-packages/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-194978320 seed_offset=0 real_seed=-194978320 thread_index=0\n",
- "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-194978320 RG_type=mt19937\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 985 residue types\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.646457 seconds.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r292 2021.31+release.c7009b3115c c7009b3115c22daa9efe2805d9d1ebba08426a54 http://www.pyrosetta.org 2021-08-07T10:04:12\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=1885576095 seed_offset=0 real_seed=1885576095 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=1885576095 RG_type=mt19937\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 983 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.651952 seconds.\n",
"\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/6LZ9_H_L.pdb' automatically determined to be of type PDB\n",
"\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 21 94\n",
"\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 21 CYS\n",
@@ -80,7 +80,8 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "
\n",
+ "(图片来源: 晶泰科技团队)"
]
},
{
@@ -7160,6 +1208,13 @@
"使用APBS计算McCoy, Chandana, Colman Electrostatic complementarity"
]
},
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "**[linux]*注意：需要安装APBS: conda install -c conda-forge apbs*"
+ ]
+ },
{
"cell_type": "code",
"execution_count": 40,
@@ -7169,22 +1224,18 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/sc/sc_radii.lib\n",
- "\u001b[0mcore.simple_metrics.composite_metrics.ElectrostaticComplementarityMetric: {0} \u001b[0mUsing residues for molecule surface (rosetta numbering):\n",
- "\u001b[0mcore.simple_metrics.composite_metrics.ElectrostaticComplementarityMetric: {0} \u001b[0m Surface 1: 1, 2, 3, 4, 5, 6, 7, 8, 9\n",
- "\u001b[0mcore.simple_metrics.composite_metrics.ElectrostaticComplementarityMetric: {0} \u001b[0m Surface 2: 10, 11, 12, 13, 14, 15, 16, 17, 18, 19\n",
- "\u001b[0mcore.scoring.sc.ElectrostaticComplementarityCalculator: {0} \u001b[0mIgnoring atoms farther than 20 from interface.\n",
- "\u001b[0mcore.scoring.sc.ElectrostaticComplementarityCalculator: {0} \u001b[0mTrimmed 3686 dots to 178 dots.\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mPB_95MCKN2P.pqr is successfully written.\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mPB_95MCKN2P.in is successfully written.\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mPB potential is successfully loaded from: PB_95MCKN2P.dx\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mConvertion of PB potential to Certesian coordinates is completed\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mPB took 4 seconds\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mPB_95MCKN2P.pqr is successfully written.\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mPB_95MCKN2P.in is successfully written.\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mPB potential is successfully loaded from: PB_95MCKN2P.dx\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mConvertion of PB potential to Certesian coordinates is completed\n",
- "\u001b[0mcore.scoring.PoissonBoltzmannPotential: {0} \u001b[0mPB took 3 seconds\n"
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/sc/sc_radii.lib\n"
+ ]
+ },
+ {
+ "ename": "RuntimeError",
+ "evalue": "\n\nFile: /Volumes/MacintoshHD3/benchmark/W.fujii.release/rosetta.Fujii.release/_commits_/main/source/src/core/scoring/PoissonBoltzmannPotential.cc:306\n[ ERROR ] UtilityExitException\nERROR: APBS failed to generate the result file.\n\n",
+ "output_type": "error",
+ "traceback": [
+ "\u001b[0;31m---------------------------------------------------------------------------\u001b[0m",
+ "\u001b[0;31mRuntimeError\u001b[0m Traceback (most recent call last)",
+ "\u001b[0;32m\u001b[0m in \u001b[0;36m\u001b[0;34m\u001b[0m\n\u001b[1;32m 9\u001b[0m \u001b[0mElectrostatic\u001b[0m\u001b[0;34m.\u001b[0m\u001b[0mresidue_selector1\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0mEC_selector1\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[1;32m 10\u001b[0m \u001b[0mElectrostatic\u001b[0m\u001b[0;34m.\u001b[0m\u001b[0mresidue_selector2\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0mEC_selector2\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0;32m---> 11\u001b[0;31m \u001b[0mElectrostatic\u001b[0m\u001b[0;34m.\u001b[0m\u001b[0mapply\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0mpose\u001b[0m\u001b[0;34m,\u001b[0m\u001b[0;34m'pose_'\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0m",
+ "\u001b[0;31mRuntimeError\u001b[0m: \n\nFile: /Volumes/MacintoshHD3/benchmark/W.fujii.release/rosetta.Fujii.release/_commits_/main/source/src/core/scoring/PoissonBoltzmannPotential.cc:306\n[ ERROR ] UtilityExitException\nERROR: APBS failed to generate the result file.\n\n"
]
}
],
@@ -7204,26 +1255,22 @@
},
{
"cell_type": "code",
- "execution_count": 41,
+ "execution_count": null,
"metadata": {},
- "outputs": [
- {
- "data": {
- "text/plain": [
- "map_std_string_double{1_p: 0.145445, 1_s: -0.00359636, 2_p: 0.304056, 2_s: -0.00359636, avg: 0.110577, p: 0.224751, s: -0.00359636}"
- ]
- },
- "execution_count": 41,
- "metadata": {},
- "output_type": "execute_result"
- }
- ],
+ "outputs": [],
"source": [
"from pyrosetta.rosetta.core.simple_metrics import get_sm_data\n",
"sm_data = get_sm_data(pose)\n",
"composite_real_metric = sm_data.get_composite_real_metric_data()\n",
"composite_real_metric['pose_ec']"
]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
}
],
"metadata": {
@@ -7242,7 +1289,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/7_Simple_Metrics/data/4r80.pdb b/7_Simple_Metrics/data/4r80.pdb
new file mode 100644
index 0000000..fd3d4c1
--- /dev/null
+++ b/7_Simple_Metrics/data/4r80.pdb
@@ -0,0 +1,1395 @@
+HEADER 30-JUL-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 30-JUL-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.26+release.b308454c455
+HETNAM HOH A 101 HOH
+HETNAM HOH A 102 HOH
+HETNAM HOH A 103 HOH
+HETNAM HOH A 104 HOH
+HETNAM HOH A 105 HOH
+HETNAM HOH A 106 HOH
+HETNAM HOH A 107 HOH
+HETNAM HOH A 108 HOH
+HETNAM HOH A 109 HOH
+HETNAM HOH A 110 HOH
+HETNAM HOH A 111 HOH
+HETNAM HOH A 112 HOH
+HETNAM HOH A 113 HOH
+HETNAM HOH A 114 HOH
+HETNAM HOH A 115 HOH
+HETNAM HOH A 116 HOH
+HETNAM HOH A 117 HOH
+HETNAM HOH A 118 HOH
+HETNAM HOH A 119 HOH
+HETNAM HOH A 120 HOH
+HETNAM HOH A 121 HOH
+HETNAM HOH A 122 HOH
+HETNAM HOH A 123 HOH
+HETNAM HOH A 124 HOH
+HETNAM HOH A 125 HOH
+HETNAM HOH A 126 HOH
+HETNAM HOH A 127 HOH
+HETNAM HOH A 128 HOH
+HETNAM HOH A 129 HOH
+HETNAM HOH A 130 HOH
+HETNAM HOH A 131 HOH
+HETNAM HOH A 132 HOH
+HETNAM HOH A 133 HOH
+HETNAM HOH A 134 HOH
+ATOM 1 N PRO A 1 35.432 -0.708 7.647 1.00 49.13 N
+ATOM 2 CA PRO A 1 35.959 0.478 8.332 1.00 38.65 C
+ATOM 3 C PRO A 1 36.620 1.469 7.374 1.00 28.53 C
+ATOM 4 O PRO A 1 36.946 1.110 6.240 1.00 28.02 O
+ATOM 5 CB PRO A 1 36.987 -0.100 9.317 1.00 32.04 C
+ATOM 6 CG PRO A 1 37.119 -1.563 8.970 1.00 40.69 C
+ATOM 7 CD PRO A 1 35.846 -1.957 8.305 1.00 42.21 C
+ATOM 8 HA PRO A 1 35.141 0.977 8.872 1.00 0.00 H
+ATOM 9 1HB PRO A 1 37.944 0.434 9.218 1.00 0.00 H
+ATOM 10 2HB PRO A 1 36.642 0.048 10.351 1.00 0.00 H
+ATOM 11 1HG PRO A 1 37.985 -1.720 8.311 1.00 0.00 H
+ATOM 12 2HG PRO A 1 37.300 -2.154 9.880 1.00 0.00 H
+ATOM 13 1HD PRO A 1 36.044 -2.759 7.579 1.00 0.00 H
+ATOM 14 2HD PRO A 1 35.123 -2.291 9.064 1.00 0.00 H
+ATOM 15 1H PRO A 1 35.759 -0.700 6.700 1.00 0.00 H
+ATOM 16 2H PRO A 1 34.427 -0.649 7.643 1.00 0.00 H
+ATOM 17 N SER A 2 36.815 2.698 7.838 1.00 22.66 N
+ATOM 18 CA SER A 2 37.414 3.747 7.016 1.00 31.33 C
+ATOM 19 C SER A 2 38.879 3.483 6.687 1.00 20.81 C
+ATOM 20 O SER A 2 39.541 2.667 7.323 1.00 24.00 O
+ATOM 21 CB SER A 2 37.265 5.114 7.688 1.00 31.88 C
+ATOM 22 OG SER A 2 38.032 5.193 8.876 1.00 25.58 O
+ATOM 23 H SER A 2 36.541 2.912 8.786 1.00 0.00 H
+ATOM 24 HA SER A 2 36.895 3.774 6.057 1.00 0.00 H
+ATOM 25 1HB SER A 2 37.584 5.895 6.998 1.00 0.00 H
+ATOM 26 2HB SER A 2 36.216 5.292 7.921 1.00 0.00 H
+ATOM 27 HG SER A 2 38.468 4.342 8.967 1.00 0.00 H
+ATOM 28 N GLU A 3 39.374 4.194 5.674 1.00 14.67 N
+ATOM 29 CA GLU A 3 40.759 4.083 5.233 1.00 27.63 C
+ATOM 30 C GLU A 3 41.791 4.401 6.321 1.00 31.10 C
+ATOM 31 O GLU A 3 42.779 3.680 6.473 1.00 26.33 O
+ATOM 32 CB GLU A 3 40.984 4.996 4.022 1.00 28.94 C
+ATOM 33 CG GLU A 3 42.401 4.981 3.472 1.00 31.98 C
+ATOM 34 CD GLU A 3 42.748 3.681 2.774 1.00 48.58 C
+ATOM 35 OE1 GLU A 3 41.822 2.962 2.342 1.00 56.19 O
+ATOM 36 OE2 GLU A 3 43.952 3.381 2.656 1.00 65.35 O
+ATOM 37 H GLU A 3 38.756 4.835 5.197 1.00 0.00 H
+ATOM 38 HA GLU A 3 40.947 3.049 4.941 1.00 0.00 H
+ATOM 39 1HB GLU A 3 40.311 4.703 3.216 1.00 0.00 H
+ATOM 40 2HB GLU A 3 40.743 6.024 4.292 1.00 0.00 H
+ATOM 41 1HG GLU A 3 42.514 5.802 2.764 1.00 0.00 H
+ATOM 42 2HG GLU A 3 43.099 5.146 4.291 1.00 0.00 H
+ATOM 43 N GLU A 4 41.560 5.471 7.070 1.00 17.43 N
+ATOM 44 CA GLU A 4 42.500 5.906 8.102 1.00 21.60 C
+ATOM 45 C GLU A 4 42.452 5.027 9.349 1.00 18.74 C
+ATOM 46 O GLU A 4 43.455 4.852 10.041 1.00 25.77 O
+ATOM 47 CB GLU A 4 42.235 7.370 8.468 1.00 14.42 C
+ATOM 48 CG GLU A 4 43.187 7.941 9.502 1.00 15.98 C
+ATOM 49 CD GLU A 4 44.635 7.593 9.223 1.00 33.57 C
+ATOM 50 OE1 GLU A 4 45.099 7.818 8.086 1.00 30.50 O
+ATOM 51 OE2 GLU A 4 45.311 7.088 10.144 1.00 40.01 O
+ATOM 52 H GLU A 4 40.712 5.999 6.923 1.00 0.00 H
+ATOM 53 HA GLU A 4 43.513 5.819 7.707 1.00 0.00 H
+ATOM 54 1HB GLU A 4 42.305 7.987 7.572 1.00 0.00 H
+ATOM 55 2HB GLU A 4 41.221 7.470 8.856 1.00 0.00 H
+ATOM 56 1HG GLU A 4 43.082 9.025 9.518 1.00 0.00 H
+ATOM 57 2HG GLU A 4 42.909 7.562 10.485 1.00 0.00 H
+ATOM 58 N GLU A 5 41.281 4.463 9.616 1.00 17.77 N
+ATOM 59 CA GLU A 5 41.068 3.599 10.768 1.00 23.67 C
+ATOM 60 C GLU A 5 41.805 2.277 10.586 1.00 26.69 C
+ATOM 61 O GLU A 5 42.305 1.695 11.547 1.00 20.55 O
+ATOM 62 CB GLU A 5 39.569 3.347 10.912 1.00 19.47 C
+ATOM 63 CG GLU A 5 39.085 2.802 12.239 1.00 28.37 C
+ATOM 64 CD GLU A 5 39.143 1.288 12.327 1.00 49.97 C
+ATOM 65 OE1 GLU A 5 39.290 0.618 11.283 1.00 55.05 O
+ATOM 66 OE2 GLU A 5 38.993 0.765 13.451 1.00 41.25 O
+ATOM 67 H GLU A 5 40.511 4.646 8.989 1.00 0.00 H
+ATOM 68 HA GLU A 5 41.441 4.109 11.657 1.00 0.00 H
+ATOM 69 1HB GLU A 5 39.026 4.277 10.745 1.00 0.00 H
+ATOM 70 2HB GLU A 5 39.245 2.637 10.151 1.00 0.00 H
+ATOM 71 1HG GLU A 5 39.699 3.220 13.037 1.00 0.00 H
+ATOM 72 2HG GLU A 5 38.058 3.127 12.400 1.00 0.00 H
+ATOM 73 N GLU A 6 41.870 1.811 9.341 1.00 17.90 N
+ATOM 74 CA GLU A 6 42.522 0.544 9.030 1.00 16.74 C
+ATOM 75 C GLU A 6 44.038 0.687 8.982 1.00 21.73 C
+ATOM 76 O GLU A 6 44.765 -0.227 9.367 1.00 15.35 O
+ATOM 77 CB GLU A 6 41.992 -0.042 7.717 1.00 24.91 C
+ATOM 78 CG GLU A 6 40.527 -0.460 7.765 1.00 36.46 C
+ATOM 79 CD GLU A 6 40.074 -1.143 6.487 1.00 42.23 C
+ATOM 80 OE1 GLU A 6 40.896 -1.276 5.560 1.00 31.93 O
+ATOM 81 OE2 GLU A 6 38.894 -1.540 6.404 1.00 33.39 O
+ATOM 82 H GLU A 6 41.457 2.349 8.592 1.00 0.00 H
+ATOM 83 HA GLU A 6 42.306 -0.162 9.833 1.00 0.00 H
+ATOM 84 1HB GLU A 6 42.106 0.692 6.919 1.00 0.00 H
+ATOM 85 2HB GLU A 6 42.582 -0.917 7.444 1.00 0.00 H
+ATOM 86 1HG GLU A 6 40.382 -1.142 8.603 1.00 0.00 H
+ATOM 87 2HG GLU A 6 39.914 0.423 7.940 1.00 0.00 H
+ATOM 88 N LYS A 7 44.511 1.833 8.501 1.00 20.12 N
+ATOM 89 CA LYS A 7 45.940 2.115 8.490 1.00 22.09 C
+ATOM 90 C LYS A 7 46.464 2.272 9.911 1.00 15.05 C
+ATOM 91 O LYS A 7 47.587 1.875 10.215 1.00 14.11 O
+ATOM 92 CB LYS A 7 46.257 3.375 7.681 1.00 16.56 C
+ATOM 93 CG LYS A 7 46.085 3.233 6.181 1.00 13.03 C
+ATOM 94 CD LYS A 7 46.318 4.569 5.495 1.00 17.67 C
+ATOM 95 CE LYS A 7 46.604 4.394 4.017 1.00 21.28 C
+ATOM 96 NZ LYS A 7 46.821 5.701 3.343 1.00 25.19 N
+ATOM 97 H LYS A 7 43.871 2.523 8.136 1.00 0.00 H
+ATOM 98 HA LYS A 7 46.455 1.274 8.025 1.00 0.00 H
+ATOM 99 1HB LYS A 7 45.613 4.191 8.010 1.00 0.00 H
+ATOM 100 2HB LYS A 7 47.288 3.677 7.867 1.00 0.00 H
+ATOM 101 1HG LYS A 7 46.797 2.499 5.801 1.00 0.00 H
+ATOM 102 2HG LYS A 7 45.077 2.882 5.962 1.00 0.00 H
+ATOM 103 1HD LYS A 7 45.434 5.197 5.612 1.00 0.00 H
+ATOM 104 2HD LYS A 7 47.165 5.074 5.960 1.00 0.00 H
+ATOM 105 1HE LYS A 7 47.493 3.777 3.889 1.00 0.00 H
+ATOM 106 2HE LYS A 7 45.765 3.886 3.542 1.00 0.00 H
+ATOM 107 1HZ LYS A 7 47.008 5.548 2.362 1.00 0.00 H
+ATOM 108 2HZ LYS A 7 45.994 6.273 3.442 1.00 0.00 H
+ATOM 109 3HZ LYS A 7 47.608 6.172 3.766 1.00 0.00 H
+ATOM 110 N ARG A 8 45.646 2.862 10.774 1.00 10.74 N
+ATOM 111 CA ARG A 8 46.032 3.075 12.164 1.00 17.60 C
+ATOM 112 C ARG A 8 46.185 1.757 12.922 1.00 14.92 C
+ATOM 113 O ARG A 8 47.174 1.549 13.627 1.00 8.90 O
+ATOM 114 CB ARG A 8 45.036 4.008 12.860 1.00 21.09 C
+ATOM 115 CG ARG A 8 45.374 4.323 14.306 1.00 27.78 C
+ATOM 116 CD ARG A 8 44.145 4.800 15.063 1.00 26.00 C
+ATOM 117 NE ARG A 8 43.131 3.758 15.179 1.00 34.55 N
+ATOM 118 CZ ARG A 8 43.130 2.815 16.115 1.00 43.72 C
+ATOM 119 NH1 ARG A 8 44.096 2.774 17.022 1.00 40.25 N
+ATOM 120 NH2 ARG A 8 42.162 1.909 16.142 1.00 40.71 N
+ATOM 121 H ARG A 8 44.736 3.171 10.463 1.00 0.00 H
+ATOM 122 HA ARG A 8 47.017 3.541 12.182 1.00 0.00 H
+ATOM 123 1HB ARG A 8 44.981 4.951 12.318 1.00 0.00 H
+ATOM 124 2HB ARG A 8 44.042 3.560 12.840 1.00 0.00 H
+ATOM 125 1HG ARG A 8 45.758 3.427 14.794 1.00 0.00 H
+ATOM 126 2HG ARG A 8 46.131 5.107 14.340 1.00 0.00 H
+ATOM 127 1HD ARG A 8 44.433 5.105 16.069 1.00 0.00 H
+ATOM 128 2HD ARG A 8 43.702 5.647 14.540 1.00 0.00 H
+ATOM 129 HE ARG A 8 42.380 3.755 14.501 1.00 0.00 H
+ATOM 130 1HH1 ARG A 8 44.836 3.461 17.003 1.00 0.00 H
+ATOM 131 2HH1 ARG A 8 44.092 2.056 17.732 1.00 0.00 H
+ATOM 132 1HH2 ARG A 8 41.425 1.936 15.451 1.00 0.00 H
+ATOM 133 2HH2 ARG A 8 42.161 1.193 16.853 1.00 0.00 H
+ATOM 134 N ARG A 9 45.207 0.870 12.767 1.00 14.08 N
+ATOM 135 CA ARG A 9 45.243 -0.438 13.412 1.00 14.69 C
+ATOM 136 C ARG A 9 46.399 -1.294 12.889 1.00 11.68 C
+ATOM 137 O ARG A 9 47.117 -1.928 13.665 1.00 12.65 O
+ATOM 138 CB ARG A 9 43.909 -1.166 13.223 1.00 18.24 C
+ATOM 139 CG ARG A 9 42.740 -0.533 13.964 1.00 17.57 C
+ATOM 140 CD ARG A 9 41.425 -1.249 13.662 1.00 17.44 C
+ATOM 141 NE ARG A 9 41.443 -2.661 14.035 1.00 21.95 N
+ATOM 142 CZ ARG A 9 40.422 -3.491 13.855 1.00 24.65 C
+ATOM 143 NH1 ARG A 9 39.294 -3.062 13.305 1.00 24.72 N
+ATOM 144 NH2 ARG A 9 40.538 -4.762 14.219 1.00 21.79 N
+ATOM 145 H ARG A 9 44.417 1.110 12.186 1.00 0.00 H
+ATOM 146 HA ARG A 9 45.413 -0.293 14.479 1.00 0.00 H
+ATOM 147 1HB ARG A 9 43.658 -1.196 12.164 1.00 0.00 H
+ATOM 148 2HB ARG A 9 44.005 -2.196 13.566 1.00 0.00 H
+ATOM 149 1HG ARG A 9 42.919 -0.584 15.038 1.00 0.00 H
+ATOM 150 2HG ARG A 9 42.640 0.510 13.662 1.00 0.00 H
+ATOM 151 1HD ARG A 9 40.616 -0.772 14.215 1.00 0.00 H
+ATOM 152 2HD ARG A 9 41.217 -1.193 12.594 1.00 0.00 H
+ATOM 153 HE ARG A 9 42.287 -3.025 14.456 1.00 0.00 H
+ATOM 154 1HH1 ARG A 9 39.206 -2.097 13.019 1.00 0.00 H
+ATOM 155 2HH1 ARG A 9 38.523 -3.700 13.172 1.00 0.00 H
+ATOM 156 1HH2 ARG A 9 41.400 -5.093 14.631 1.00 0.00 H
+ATOM 157 2HH2 ARG A 9 39.766 -5.398 14.085 1.00 0.00 H
+ATOM 158 N ALA A 10 46.580 -1.298 11.571 1.00 9.90 N
+ATOM 159 CA ALA A 10 47.635 -2.091 10.949 1.00 18.91 C
+ATOM 160 C ALA A 10 49.004 -1.600 11.389 1.00 15.03 C
+ATOM 161 O ALA A 10 49.913 -2.399 11.610 1.00 12.19 O
+ATOM 162 CB ALA A 10 47.519 -2.046 9.432 1.00 15.11 C
+ATOM 163 H ALA A 10 45.974 -0.740 10.986 1.00 0.00 H
+ATOM 164 HA ALA A 10 47.521 -3.124 11.278 1.00 0.00 H
+ATOM 165 1HB ALA A 10 48.315 -2.644 8.988 1.00 0.00 H
+ATOM 166 2HB ALA A 10 46.552 -2.447 9.129 1.00 0.00 H
+ATOM 167 3HB ALA A 10 47.607 -1.016 9.091 1.00 0.00 H
+ATOM 168 N LYS A 11 49.145 -0.286 11.522 1.00 7.37 N
+ATOM 169 CA LYS A 11 50.406 0.296 11.963 1.00 13.14 C
+ATOM 170 C LYS A 11 50.715 -0.097 13.404 1.00 14.33 C
+ATOM 171 O LYS A 11 51.861 -0.396 13.741 1.00 11.73 O
+ATOM 172 CB LYS A 11 50.379 1.820 11.841 1.00 12.35 C
+ATOM 173 CG LYS A 11 51.699 2.484 12.209 1.00 22.32 C
+ATOM 174 CD LYS A 11 51.592 4.001 12.197 1.00 34.72 C
+ATOM 175 CE LYS A 11 50.919 4.513 13.459 1.00 32.92 C
+ATOM 176 NZ LYS A 11 51.717 4.180 14.673 1.00 33.62 N
+ATOM 177 H LYS A 11 48.367 0.324 11.315 1.00 0.00 H
+ATOM 178 HA LYS A 11 51.205 -0.086 11.326 1.00 0.00 H
+ATOM 179 1HB LYS A 11 50.129 2.099 10.817 1.00 0.00 H
+ATOM 180 2HB LYS A 11 49.601 2.223 12.489 1.00 0.00 H
+ATOM 181 1HG LYS A 11 52.003 2.163 13.206 1.00 0.00 H
+ATOM 182 2HG LYS A 11 52.468 2.182 11.499 1.00 0.00 H
+ATOM 183 1HD LYS A 11 52.590 4.436 12.123 1.00 0.00 H
+ATOM 184 2HD LYS A 11 51.011 4.318 11.331 1.00 0.00 H
+ATOM 185 1HE LYS A 11 50.801 5.594 13.395 1.00 0.00 H
+ATOM 186 2HE LYS A 11 49.929 4.066 13.550 1.00 0.00 H
+ATOM 187 1HZ LYS A 11 51.245 4.532 15.494 1.00 0.00 H
+ATOM 188 2HZ LYS A 11 51.817 3.177 14.746 1.00 0.00 H
+ATOM 189 3HZ LYS A 11 52.631 4.604 14.603 1.00 0.00 H
+ATOM 190 N GLN A 12 49.688 -0.102 14.249 1.00 12.02 N
+ATOM 191 CA GLN A 12 49.858 -0.447 15.656 1.00 15.49 C
+ATOM 192 C GLN A 12 50.111 -1.938 15.860 1.00 12.04 C
+ATOM 193 O GLN A 12 50.891 -2.326 16.730 1.00 14.24 O
+ATOM 194 CB GLN A 12 48.640 -0.001 16.468 1.00 18.78 C
+ATOM 195 CG GLN A 12 48.498 1.509 16.583 1.00 24.78 C
+ATOM 196 CD GLN A 12 47.297 1.923 17.409 1.00 28.44 C
+ATOM 197 OE1 GLN A 12 46.545 1.080 17.899 1.00 44.53 O
+ATOM 198 NE2 GLN A 12 47.110 3.228 17.567 1.00 16.03 N
+ATOM 199 H GLN A 12 48.768 0.139 13.909 1.00 0.00 H
+ATOM 200 HA GLN A 12 50.738 0.072 16.035 1.00 0.00 H
+ATOM 201 1HB GLN A 12 47.733 -0.394 16.009 1.00 0.00 H
+ATOM 202 2HB GLN A 12 48.703 -0.414 17.475 1.00 0.00 H
+ATOM 203 1HG GLN A 12 49.392 1.913 17.058 1.00 0.00 H
+ATOM 204 2HG GLN A 12 48.384 1.930 15.584 1.00 0.00 H
+ATOM 205 1HE2 GLN A 12 46.333 3.561 18.103 1.00 0.00 H
+ATOM 206 2HE2 GLN A 12 47.745 3.879 17.151 1.00 0.00 H
+ATOM 207 N VAL A 13 49.461 -2.769 15.051 1.00 10.69 N
+ATOM 208 CA VAL A 13 49.692 -4.208 15.090 1.00 12.61 C
+ATOM 209 C VAL A 13 51.126 -4.472 14.659 1.00 12.43 C
+ATOM 210 O VAL A 13 51.838 -5.279 15.258 1.00 15.82 O
+ATOM 211 CB VAL A 13 48.725 -4.965 14.156 1.00 10.36 C
+ATOM 212 CG1 VAL A 13 49.204 -6.392 13.923 1.00 13.75 C
+ATOM 213 CG2 VAL A 13 47.317 -4.959 14.729 1.00 15.35 C
+ATOM 214 H VAL A 13 48.791 -2.396 14.394 1.00 0.00 H
+ATOM 215 HA VAL A 13 49.522 -4.558 16.109 1.00 0.00 H
+ATOM 216 HB VAL A 13 48.718 -4.476 13.182 1.00 0.00 H
+ATOM 217 1HG1 VAL A 13 48.507 -6.907 13.261 1.00 0.00 H
+ATOM 218 2HG1 VAL A 13 50.192 -6.374 13.464 1.00 0.00 H
+ATOM 219 3HG1 VAL A 13 49.255 -6.919 14.876 1.00 0.00 H
+ATOM 220 1HG2 VAL A 13 46.649 -5.496 14.057 1.00 0.00 H
+ATOM 221 2HG2 VAL A 13 47.319 -5.445 15.705 1.00 0.00 H
+ATOM 222 3HG2 VAL A 13 46.972 -3.930 14.837 1.00 0.00 H
+ATOM 223 N ALA A 14 51.541 -3.763 13.618 1.00 15.19 N
+ATOM 224 CA ALA A 14 52.885 -3.880 13.078 1.00 12.78 C
+ATOM 225 C ALA A 14 53.942 -3.394 14.064 1.00 12.82 C
+ATOM 226 O ALA A 14 54.966 -4.048 14.259 1.00 10.73 O
+ATOM 227 CB ALA A 14 52.981 -3.093 11.792 1.00 12.26 C
+ATOM 228 H ALA A 14 50.893 -3.119 13.189 1.00 0.00 H
+ATOM 229 HA ALA A 14 53.077 -4.933 12.872 1.00 0.00 H
+ATOM 230 1HB ALA A 14 53.989 -3.180 11.386 1.00 0.00 H
+ATOM 231 2HB ALA A 14 52.264 -3.486 11.071 1.00 0.00 H
+ATOM 232 3HB ALA A 14 52.759 -2.045 11.990 1.00 0.00 H
+ATOM 233 N LYS A 15 53.688 -2.246 14.684 1.00 13.08 N
+ATOM 234 CA LYS A 15 54.650 -1.642 15.598 1.00 13.08 C
+ATOM 235 C LYS A 15 54.793 -2.444 16.889 1.00 15.11 C
+ATOM 236 O LYS A 15 55.899 -2.612 17.403 1.00 11.88 O
+ATOM 237 CB LYS A 15 54.262 -0.196 15.909 1.00 13.38 C
+ATOM 238 CG LYS A 15 55.260 0.544 16.783 1.00 18.77 C
+ATOM 239 CD LYS A 15 54.795 1.964 17.060 1.00 18.67 C
+ATOM 240 CE LYS A 15 55.714 2.665 18.044 1.00 19.68 C
+ATOM 241 NZ LYS A 15 55.136 3.956 18.505 1.00 35.90 N
+ATOM 242 H LYS A 15 52.807 -1.780 14.518 1.00 0.00 H
+ATOM 243 HA LYS A 15 55.630 -1.644 15.120 1.00 0.00 H
+ATOM 244 1HB LYS A 15 54.154 0.360 14.977 1.00 0.00 H
+ATOM 245 2HB LYS A 15 53.296 -0.179 16.414 1.00 0.00 H
+ATOM 246 1HG LYS A 15 55.377 0.015 17.730 1.00 0.00 H
+ATOM 247 2HG LYS A 15 56.228 0.576 16.283 1.00 0.00 H
+ATOM 248 1HD LYS A 15 54.776 2.529 16.127 1.00 0.00 H
+ATOM 249 2HD LYS A 15 53.786 1.943 17.472 1.00 0.00 H
+ATOM 250 1HE LYS A 15 55.881 2.022 18.907 1.00 0.00 H
+ATOM 251 2HE LYS A 15 56.677 2.857 17.570 1.00 0.00 H
+ATOM 252 1HZ LYS A 15 55.770 4.396 19.156 1.00 0.00 H
+ATOM 253 2HZ LYS A 15 54.994 4.564 17.711 1.00 0.00 H
+ATOM 254 3HZ LYS A 15 54.251 3.786 18.961 1.00 0.00 H
+ATOM 255 N GLU A 16 53.673 -2.940 17.405 1.00 12.44 N
+ATOM 256 CA GLU A 16 53.690 -3.772 18.603 1.00 17.90 C
+ATOM 257 C GLU A 16 54.466 -5.051 18.326 1.00 16.95 C
+ATOM 258 O GLU A 16 55.174 -5.564 19.192 1.00 14.28 O
+ATOM 259 CB GLU A 16 52.267 -4.093 19.065 1.00 16.10 C
+ATOM 260 CG GLU A 16 52.193 -4.959 20.318 1.00 17.22 C
+ATOM 261 CD GLU A 16 52.839 -4.307 21.529 1.00 20.04 C
+ATOM 262 OE1 GLU A 16 52.740 -3.070 21.671 1.00 22.27 O
+ATOM 263 OE2 GLU A 16 53.450 -5.035 22.339 1.00 24.17 O
+ATOM 264 H GLU A 16 52.790 -2.737 16.959 1.00 0.00 H
+ATOM 265 HA GLU A 16 54.195 -3.223 19.398 1.00 0.00 H
+ATOM 266 1HB GLU A 16 51.732 -3.165 19.267 1.00 0.00 H
+ATOM 267 2HB GLU A 16 51.734 -4.611 18.268 1.00 0.00 H
+ATOM 268 1HG GLU A 16 51.147 -5.162 20.545 1.00 0.00 H
+ATOM 269 2HG GLU A 16 52.685 -5.910 20.119 1.00 0.00 H
+ATOM 270 N LYS A 17 54.323 -5.567 17.105 1.00 10.73 N
+ATOM 271 CA LYS A 17 55.078 -6.730 16.665 1.00 17.12 C
+ATOM 272 C LYS A 17 56.585 -6.482 16.683 1.00 18.84 C
+ATOM 273 O LYS A 17 57.361 -7.336 17.100 1.00 17.74 O
+ATOM 274 CB LYS A 17 54.637 -7.162 15.265 1.00 20.56 C
+ATOM 275 CG LYS A 17 55.434 -8.328 14.706 1.00 24.81 C
+ATOM 276 CD LYS A 17 55.289 -9.565 15.566 1.00 21.94 C
+ATOM 277 CE LYS A 17 55.641 -10.816 14.787 1.00 26.24 C
+ATOM 278 NZ LYS A 17 55.759 -12.003 15.675 1.00 35.24 N
+ATOM 279 H LYS A 17 53.669 -5.135 16.468 1.00 0.00 H
+ATOM 280 HA LYS A 17 54.886 -7.550 17.358 1.00 0.00 H
+ATOM 281 1HB LYS A 17 53.585 -7.447 15.287 1.00 0.00 H
+ATOM 282 2HB LYS A 17 54.734 -6.322 14.577 1.00 0.00 H
+ATOM 283 1HG LYS A 17 55.086 -8.557 13.698 1.00 0.00 H
+ATOM 284 2HG LYS A 17 56.488 -8.057 14.654 1.00 0.00 H
+ATOM 285 1HD LYS A 17 55.948 -9.486 16.432 1.00 0.00 H
+ATOM 286 2HD LYS A 17 54.261 -9.644 15.920 1.00 0.00 H
+ATOM 287 1HE LYS A 17 54.871 -11.008 14.041 1.00 0.00 H
+ATOM 288 2HE LYS A 17 56.589 -10.668 14.269 1.00 0.00 H
+ATOM 289 1HZ LYS A 17 55.994 -12.815 15.123 1.00 0.00 H
+ATOM 290 2HZ LYS A 17 56.484 -11.841 16.360 1.00 0.00 H
+ATOM 291 3HZ LYS A 17 54.880 -12.160 16.146 1.00 0.00 H
+ATOM 292 N ILE A 18 56.994 -5.299 16.226 1.00 10.98 N
+ATOM 293 CA ILE A 18 58.408 -4.945 16.209 1.00 15.03 C
+ATOM 294 C ILE A 18 58.941 -4.686 17.617 1.00 17.93 C
+ATOM 295 O ILE A 18 60.072 -5.058 17.938 1.00 17.62 O
+ATOM 296 CB ILE A 18 58.669 -3.719 15.308 1.00 13.57 C
+ATOM 297 CG1 ILE A 18 58.148 -3.981 13.894 1.00 19.73 C
+ATOM 298 CG2 ILE A 18 60.150 -3.386 15.266 1.00 17.53 C
+ATOM 299 CD1 ILE A 18 58.675 -5.257 13.279 1.00 15.94 C
+ATOM 300 H ILE A 18 56.316 -4.633 15.884 1.00 0.00 H
+ATOM 301 HA ILE A 18 58.971 -5.788 15.809 1.00 0.00 H
+ATOM 302 HB ILE A 18 58.127 -2.858 15.699 1.00 0.00 H
+ATOM 303 1HG1 ILE A 18 57.060 -4.033 13.911 1.00 0.00 H
+ATOM 304 2HG1 ILE A 18 58.424 -3.150 13.244 1.00 0.00 H
+ATOM 305 1HG2 ILE A 18 60.310 -2.519 14.625 1.00 0.00 H
+ATOM 306 2HG2 ILE A 18 60.501 -3.162 16.272 1.00 0.00 H
+ATOM 307 3HG2 ILE A 18 60.703 -4.238 14.870 1.00 0.00 H
+ATOM 308 1HD1 ILE A 18 58.263 -5.375 12.277 1.00 0.00 H
+ATOM 309 2HD1 ILE A 18 59.763 -5.211 13.221 1.00 0.00 H
+ATOM 310 3HD1 ILE A 18 58.380 -6.106 13.894 1.00 0.00 H
+ATOM 311 N LEU A 19 58.121 -4.061 18.457 1.00 20.64 N
+ATOM 312 CA LEU A 19 58.503 -3.776 19.838 1.00 22.53 C
+ATOM 313 C LEU A 19 58.763 -5.052 20.638 1.00 21.26 C
+ATOM 314 O LEU A 19 59.675 -5.101 21.464 1.00 31.42 O
+ATOM 315 CB LEU A 19 57.426 -2.937 20.531 1.00 13.93 C
+ATOM 316 CG LEU A 19 57.335 -1.461 20.136 1.00 20.76 C
+ATOM 317 CD1 LEU A 19 56.052 -0.844 20.674 1.00 21.35 C
+ATOM 318 CD2 LEU A 19 58.549 -0.688 20.626 1.00 20.61 C
+ATOM 319 H LEU A 19 57.209 -3.776 18.130 1.00 0.00 H
+ATOM 320 HA LEU A 19 59.433 -3.209 19.829 1.00 0.00 H
+ATOM 321 1HB LEU A 19 56.454 -3.382 20.327 1.00 0.00 H
+ATOM 322 2HB LEU A 19 57.599 -2.970 21.607 1.00 0.00 H
+ATOM 323 HG LEU A 19 57.283 -1.377 19.050 1.00 0.00 H
+ATOM 324 1HD1 LEU A 19 56.003 0.206 20.384 1.00 0.00 H
+ATOM 325 2HD1 LEU A 19 55.193 -1.374 20.262 1.00 0.00 H
+ATOM 326 3HD1 LEU A 19 56.039 -0.921 21.761 1.00 0.00 H
+ATOM 327 1HD2 LEU A 19 58.458 0.358 20.331 1.00 0.00 H
+ATOM 328 2HD2 LEU A 19 58.608 -0.754 21.713 1.00 0.00 H
+ATOM 329 3HD2 LEU A 19 59.452 -1.112 20.187 1.00 0.00 H
+ATOM 330 N GLU A 20 57.956 -6.078 20.392 1.00 12.02 N
+ATOM 331 CA GLU A 20 58.108 -7.359 21.077 1.00 28.59 C
+ATOM 332 C GLU A 20 59.414 -8.053 20.701 1.00 23.32 C
+ATOM 333 O GLU A 20 60.096 -8.621 21.554 1.00 27.77 O
+ATOM 334 CB GLU A 20 56.913 -8.272 20.792 1.00 23.90 C
+ATOM 335 CG GLU A 20 55.627 -7.825 21.469 1.00 38.66 C
+ATOM 336 CD GLU A 20 54.431 -8.667 21.071 1.00 42.11 C
+ATOM 337 OE1 GLU A 20 54.555 -9.465 20.119 1.00 45.50 O
+ATOM 338 OE2 GLU A 20 53.367 -8.529 21.711 1.00 50.32 O
+ATOM 339 H GLU A 20 57.217 -5.968 19.712 1.00 0.00 H
+ATOM 340 HA GLU A 20 58.154 -7.174 22.151 1.00 0.00 H
+ATOM 341 1HB GLU A 20 56.736 -8.315 19.717 1.00 0.00 H
+ATOM 342 2HB GLU A 20 57.141 -9.284 21.126 1.00 0.00 H
+ATOM 343 1HG GLU A 20 55.757 -7.885 22.549 1.00 0.00 H
+ATOM 344 2HG GLU A 20 55.436 -6.784 21.211 1.00 0.00 H
+ATOM 345 N GLN A 21 59.756 -8.003 19.416 1.00 18.29 N
+ATOM 346 CA GLN A 21 60.977 -8.625 18.918 1.00 17.09 C
+ATOM 347 C GLN A 21 62.207 -7.779 19.235 1.00 21.34 C
+ATOM 348 O GLN A 21 63.337 -8.260 19.164 1.00 22.42 O
+ATOM 349 CB GLN A 21 60.878 -8.860 17.409 1.00 14.07 C
+ATOM 350 CG GLN A 21 59.809 -9.860 17.003 1.00 22.16 C
+ATOM 351 CD GLN A 21 59.795 -10.121 15.510 1.00 25.16 C
+ATOM 352 OE1 GLN A 21 60.425 -9.399 14.736 1.00 22.46 O
+ATOM 353 NE2 GLN A 21 59.076 -11.158 15.096 1.00 23.83 N
+ATOM 354 H GLN A 21 59.151 -7.519 18.768 1.00 0.00 H
+ATOM 355 HA GLN A 21 61.102 -9.587 19.414 1.00 0.00 H
+ATOM 356 1HB GLN A 21 60.664 -7.916 16.907 1.00 0.00 H
+ATOM 357 2HB GLN A 21 61.836 -9.220 17.033 1.00 0.00 H
+ATOM 358 1HG GLN A 21 59.998 -10.805 17.513 1.00 0.00 H
+ATOM 359 2HG GLN A 21 58.833 -9.469 17.290 1.00 0.00 H
+ATOM 360 1HE2 GLN A 21 59.030 -11.378 14.121 1.00 0.00 H
+ATOM 361 2HE2 GLN A 21 58.580 -11.720 15.758 1.00 0.00 H
+ATOM 362 N ASN A 22 61.981 -6.516 19.583 1.00 20.93 N
+ATOM 363 CA ASN A 22 63.072 -5.604 19.907 1.00 22.28 C
+ATOM 364 C ASN A 22 62.775 -4.808 21.175 1.00 30.47 C
+ATOM 365 O ASN A 22 62.407 -3.637 21.109 1.00 44.13 O
+ATOM 366 CB ASN A 22 63.341 -4.657 18.736 1.00 27.08 C
+ATOM 367 CG ASN A 22 63.684 -5.397 17.456 1.00 27.04 C
+ATOM 368 OD1 ASN A 22 64.852 -5.663 17.173 1.00 21.70 O
+ATOM 369 ND2 ASN A 22 62.663 -5.741 16.679 1.00 11.85 N
+ATOM 370 H ASN A 22 61.030 -6.179 19.624 1.00 0.00 H
+ATOM 371 HA ASN A 22 63.971 -6.193 20.094 1.00 0.00 H
+ATOM 372 1HB ASN A 22 62.461 -4.037 18.560 1.00 0.00 H
+ATOM 373 2HB ASN A 22 64.166 -3.990 18.989 1.00 0.00 H
+ATOM 374 1HD2 ASN A 22 62.829 -6.231 15.823 1.00 0.00 H
+ATOM 375 2HD2 ASN A 22 61.729 -5.511 16.950 1.00 0.00 H
+ATOM 376 N PRO A 23 62.939 -5.463 22.342 1.00 25.10 N
+ATOM 377 CA PRO A 23 62.573 -4.912 23.656 1.00 35.12 C
+ATOM 378 C PRO A 23 63.259 -3.599 24.012 1.00 47.04 C
+ATOM 379 O PRO A 23 62.581 -2.632 24.361 1.00 55.86 O
+ATOM 380 CB PRO A 23 63.008 -6.022 24.626 1.00 39.70 C
+ATOM 381 CG PRO A 23 64.016 -6.820 23.879 1.00 44.25 C
+ATOM 382 CD PRO A 23 63.565 -6.783 22.453 1.00 32.20 C
+ATOM 383 HA PRO A 23 61.484 -4.759 23.694 1.00 0.00 H
+ATOM 384 1HB PRO A 23 63.422 -5.579 25.544 1.00 0.00 H
+ATOM 385 2HB PRO A 23 62.137 -6.623 24.925 1.00 0.00 H
+ATOM 386 1HG PRO A 23 65.018 -6.386 24.011 1.00 0.00 H
+ATOM 387 2HG PRO A 23 64.059 -7.845 24.276 1.00 0.00 H
+ATOM 388 1HD PRO A 23 64.437 -6.878 21.789 1.00 0.00 H
+ATOM 389 2HD PRO A 23 62.850 -7.599 22.273 1.00 0.00 H
+ATOM 390 N SER A 24 64.583 -3.559 23.925 1.00 36.64 N
+ATOM 391 CA SER A 24 65.325 -2.363 24.296 1.00 45.82 C
+ATOM 392 C SER A 24 65.522 -1.459 23.088 1.00 61.39 C
+ATOM 393 O SER A 24 66.646 -1.048 22.794 1.00 69.10 O
+ATOM 394 CB SER A 24 66.679 -2.743 24.897 1.00 52.54 C
+ATOM 395 OG SER A 24 67.576 -3.190 23.894 1.00 57.23 O
+ATOM 396 H SER A 24 65.088 -4.369 23.596 1.00 0.00 H
+ATOM 397 HA SER A 24 64.750 -1.817 25.046 1.00 0.00 H
+ATOM 398 1HB SER A 24 67.104 -1.881 25.409 1.00 0.00 H
+ATOM 399 2HB SER A 24 66.540 -3.528 25.639 1.00 0.00 H
+ATOM 400 HG SER A 24 67.093 -3.140 23.066 1.00 0.00 H
+ATOM 401 N SER A 25 64.435 -1.149 22.396 1.00 50.50 N
+ATOM 402 CA SER A 25 64.533 -0.385 21.159 1.00 39.54 C
+ATOM 403 C SER A 25 63.439 0.661 21.003 1.00 45.41 C
+ATOM 404 O SER A 25 62.302 0.462 21.427 1.00 40.18 O
+ATOM 405 CB SER A 25 64.516 -1.337 19.960 1.00 35.17 C
+ATOM 406 OG SER A 25 64.307 -0.632 18.752 1.00 49.93 O
+ATOM 407 H SER A 25 63.525 -1.442 22.723 1.00 0.00 H
+ATOM 408 HA SER A 25 65.477 0.163 21.164 1.00 0.00 H
+ATOM 409 1HB SER A 25 65.462 -1.875 19.910 1.00 0.00 H
+ATOM 410 2HB SER A 25 63.726 -2.075 20.093 1.00 0.00 H
+ATOM 411 HG SER A 25 64.226 0.293 18.996 1.00 0.00 H
+ATOM 412 N LYS A 26 63.804 1.786 20.389 1.00 37.69 N
+ATOM 413 CA LYS A 26 62.843 2.810 19.997 1.00 39.81 C
+ATOM 414 C LYS A 26 62.468 2.651 18.530 1.00 31.56 C
+ATOM 415 O LYS A 26 63.322 2.730 17.649 1.00 31.55 O
+ATOM 416 CB LYS A 26 63.368 4.221 20.285 1.00 49.24 C
+ATOM 417 CG LYS A 26 63.106 4.721 21.711 1.00 46.68 C
+ATOM 418 CD LYS A 26 63.644 3.792 22.783 1.00 52.82 C
+ATOM 419 CE LYS A 26 63.103 4.167 24.150 1.00 53.20 C
+ATOM 420 NZ LYS A 26 63.654 3.291 25.225 1.00 58.78 N
+ATOM 421 H LYS A 26 64.784 1.929 20.190 1.00 0.00 H
+ATOM 422 HA LYS A 26 61.929 2.666 20.574 1.00 0.00 H
+ATOM 423 1HB LYS A 26 64.445 4.251 20.115 1.00 0.00 H
+ATOM 424 2HB LYS A 26 62.908 4.928 19.595 1.00 0.00 H
+ATOM 425 1HG LYS A 26 63.574 5.697 21.847 1.00 0.00 H
+ATOM 426 2HG LYS A 26 62.033 4.828 21.867 1.00 0.00 H
+ATOM 427 1HD LYS A 26 63.356 2.765 22.553 1.00 0.00 H
+ATOM 428 2HD LYS A 26 64.732 3.850 22.802 1.00 0.00 H
+ATOM 429 1HE LYS A 26 63.361 5.201 24.372 1.00 0.00 H
+ATOM 430 2HE LYS A 26 62.017 4.079 24.148 1.00 0.00 H
+ATOM 431 1HZ LYS A 26 63.271 3.571 26.117 1.00 0.00 H
+ATOM 432 2HZ LYS A 26 63.404 2.330 25.038 1.00 0.00 H
+ATOM 433 3HZ LYS A 26 64.660 3.378 25.249 1.00 0.00 H
+ATOM 434 N VAL A 27 61.182 2.438 18.277 1.00 27.27 N
+ATOM 435 CA VAL A 27 60.702 2.125 16.939 1.00 24.63 C
+ATOM 436 C VAL A 27 59.864 3.263 16.368 1.00 30.73 C
+ATOM 437 O VAL A 27 58.869 3.672 16.965 1.00 36.63 O
+ATOM 438 CB VAL A 27 59.851 0.845 16.943 1.00 21.02 C
+ATOM 439 CG1 VAL A 27 59.410 0.509 15.535 1.00 26.88 C
+ATOM 440 CG2 VAL A 27 60.631 -0.312 17.552 1.00 19.70 C
+ATOM 441 H VAL A 27 60.519 2.495 19.037 1.00 0.00 H
+ATOM 442 HA VAL A 27 61.564 1.962 16.291 1.00 0.00 H
+ATOM 443 HB VAL A 27 58.951 1.020 17.532 1.00 0.00 H
+ATOM 444 1HG1 VAL A 27 58.807 -0.400 15.549 1.00 0.00 H
+ATOM 445 2HG1 VAL A 27 58.817 1.331 15.134 1.00 0.00 H
+ATOM 446 3HG1 VAL A 27 60.287 0.352 14.907 1.00 0.00 H
+ATOM 447 1HG2 VAL A 27 60.013 -1.210 17.547 1.00 0.00 H
+ATOM 448 2HG2 VAL A 27 61.534 -0.490 16.968 1.00 0.00 H
+ATOM 449 3HG2 VAL A 27 60.905 -0.066 18.578 1.00 0.00 H
+ATOM 450 N GLN A 28 60.272 3.772 15.210 1.00 21.37 N
+ATOM 451 CA GLN A 28 59.507 4.812 14.532 1.00 27.91 C
+ATOM 452 C GLN A 28 58.923 4.292 13.220 1.00 23.08 C
+ATOM 453 O GLN A 28 59.565 3.530 12.498 1.00 16.60 O
+ATOM 454 CB GLN A 28 60.372 6.054 14.286 1.00 32.93 C
+ATOM 455 CG GLN A 28 61.454 5.875 13.230 1.00 34.47 C
+ATOM 456 CD GLN A 28 61.846 7.180 12.562 1.00 41.00 C
+ATOM 457 OE1 GLN A 28 61.272 8.232 12.842 1.00 54.61 O
+ATOM 458 NE2 GLN A 28 62.827 7.115 11.669 1.00 40.06 N
+ATOM 459 H GLN A 28 61.126 3.436 14.789 1.00 0.00 H
+ATOM 460 HA GLN A 28 58.669 5.096 15.169 1.00 0.00 H
+ATOM 461 1HB GLN A 28 59.737 6.883 13.974 1.00 0.00 H
+ATOM 462 2HB GLN A 28 60.860 6.347 15.215 1.00 0.00 H
+ATOM 463 1HG GLN A 28 62.343 5.456 13.702 1.00 0.00 H
+ATOM 464 2HG GLN A 28 61.087 5.197 12.459 1.00 0.00 H
+ATOM 465 1HE2 GLN A 28 63.129 7.944 11.196 1.00 0.00 H
+ATOM 466 2HE2 GLN A 28 63.264 6.238 11.469 1.00 0.00 H
+ATOM 467 N VAL A 29 57.693 4.702 12.928 1.00 25.60 N
+ATOM 468 CA VAL A 29 57.030 4.325 11.686 1.00 19.10 C
+ATOM 469 C VAL A 29 57.184 5.443 10.666 1.00 16.98 C
+ATOM 470 O VAL A 29 56.836 6.591 10.938 1.00 23.11 O
+ATOM 471 CB VAL A 29 55.532 4.048 11.907 1.00 22.80 C
+ATOM 472 CG1 VAL A 29 54.862 3.674 10.594 1.00 20.60 C
+ATOM 473 CG2 VAL A 29 55.343 2.947 12.938 1.00 21.68 C
+ATOM 474 H VAL A 29 57.205 5.292 13.587 1.00 0.00 H
+ATOM 475 HA VAL A 29 57.492 3.411 11.310 1.00 0.00 H
+ATOM 476 HB VAL A 29 55.052 4.960 12.262 1.00 0.00 H
+ATOM 477 1HG1 VAL A 29 53.803 3.482 10.768 1.00 0.00 H
+ATOM 478 2HG1 VAL A 29 54.970 4.494 9.884 1.00 0.00 H
+ATOM 479 3HG1 VAL A 29 55.331 2.778 10.189 1.00 0.00 H
+ATOM 480 1HG2 VAL A 29 54.279 2.764 13.083 1.00 0.00 H
+ATOM 481 2HG2 VAL A 29 55.824 2.034 12.588 1.00 0.00 H
+ATOM 482 3HG2 VAL A 29 55.791 3.253 13.884 1.00 0.00 H
+ATOM 483 N ARG A 30 57.701 5.106 9.489 1.00 20.16 N
+ATOM 484 CA ARG A 30 57.997 6.122 8.487 1.00 18.01 C
+ATOM 485 C ARG A 30 56.947 6.217 7.388 1.00 11.26 C
+ATOM 486 O ARG A 30 56.731 7.291 6.827 1.00 16.09 O
+ATOM 487 CB ARG A 30 59.376 5.888 7.869 1.00 22.14 C
+ATOM 488 CG ARG A 30 60.523 6.064 8.844 1.00 26.59 C
+ATOM 489 CD ARG A 30 61.852 6.109 8.114 1.00 30.41 C
+ATOM 490 NE ARG A 30 61.925 7.222 7.170 1.00 41.16 N
+ATOM 491 CZ ARG A 30 62.309 8.453 7.494 1.00 44.94 C
+ATOM 492 NH1 ARG A 30 62.656 8.736 8.743 1.00 39.49 N
+ATOM 493 NH2 ARG A 30 62.346 9.404 6.570 1.00 37.67 N
+ATOM 494 H ARG A 30 57.894 4.137 9.279 1.00 0.00 H
+ATOM 495 HA ARG A 30 57.997 7.098 8.973 1.00 0.00 H
+ATOM 496 1HB ARG A 30 59.427 4.878 7.465 1.00 0.00 H
+ATOM 497 2HB ARG A 30 59.526 6.580 7.040 1.00 0.00 H
+ATOM 498 1HG ARG A 30 60.394 6.997 9.394 1.00 0.00 H
+ATOM 499 2HG ARG A 30 60.536 5.229 9.545 1.00 0.00 H
+ATOM 500 1HD ARG A 30 62.660 6.224 8.836 1.00 0.00 H
+ATOM 501 2HD ARG A 30 61.993 5.183 7.557 1.00 0.00 H
+ATOM 502 HE ARG A 30 61.666 7.041 6.209 1.00 0.00 H
+ATOM 503 1HH1 ARG A 30 62.629 8.015 9.450 1.00 0.00 H
+ATOM 504 2HH1 ARG A 30 62.947 9.672 8.986 1.00 0.00 H
+ATOM 505 1HH2 ARG A 30 62.082 9.194 5.617 1.00 0.00 H
+ATOM 506 2HH2 ARG A 30 62.638 10.338 6.818 1.00 0.00 H
+ATOM 507 N ARG A 31 56.298 5.102 7.078 1.00 13.70 N
+ATOM 508 CA ARG A 31 55.268 5.113 6.047 1.00 12.44 C
+ATOM 509 C ARG A 31 54.285 3.960 6.191 1.00 15.13 C
+ATOM 510 O ARG A 31 54.668 2.828 6.487 1.00 12.62 O
+ATOM 511 CB ARG A 31 55.888 5.115 4.647 1.00 21.41 C
+ATOM 512 CG ARG A 31 54.959 5.664 3.574 1.00 23.25 C
+ATOM 513 CD ARG A 31 55.631 5.697 2.213 1.00 32.65 C
+ATOM 514 NE ARG A 31 55.444 4.453 1.475 1.00 43.20 N
+ATOM 515 CZ ARG A 31 54.464 4.247 0.601 1.00 46.61 C
+ATOM 516 NH1 ARG A 31 53.581 5.205 0.354 1.00 44.06 N
+ATOM 517 NH2 ARG A 31 54.367 3.084 -0.028 1.00 50.78 N
+ATOM 518 H ARG A 31 56.510 4.236 7.552 1.00 0.00 H
+ATOM 519 HA ARG A 31 54.675 6.021 6.160 1.00 0.00 H
+ATOM 520 1HB ARG A 31 56.797 5.714 4.653 1.00 0.00 H
+ATOM 521 2HB ARG A 31 56.168 4.098 4.372 1.00 0.00 H
+ATOM 522 1HG ARG A 31 54.072 5.034 3.503 1.00 0.00 H
+ATOM 523 2HG ARG A 31 54.662 6.681 3.835 1.00 0.00 H
+ATOM 524 1HD ARG A 31 55.211 6.508 1.619 1.00 0.00 H
+ATOM 525 2HD ARG A 31 56.701 5.857 2.340 1.00 0.00 H
+ATOM 526 HE ARG A 31 56.103 3.704 1.642 1.00 0.00 H
+ATOM 527 1HH1 ARG A 31 53.653 6.093 0.830 1.00 0.00 H
+ATOM 528 2HH1 ARG A 31 52.837 5.047 -0.310 1.00 0.00 H
+ATOM 529 1HH2 ARG A 31 55.039 2.352 0.157 1.00 0.00 H
+ATOM 530 2HH2 ARG A 31 53.622 2.930 -0.691 1.00 0.00 H
+ATOM 531 N VAL A 32 53.011 4.267 5.984 1.00 22.93 N
+ATOM 532 CA VAL A 32 51.969 3.255 5.966 1.00 21.15 C
+ATOM 533 C VAL A 32 51.259 3.316 4.622 1.00 18.72 C
+ATOM 534 O VAL A 32 50.811 4.379 4.194 1.00 23.67 O
+ATOM 535 CB VAL A 32 50.950 3.476 7.099 1.00 14.14 C
+ATOM 536 CG1 VAL A 32 49.860 2.419 7.048 1.00 14.48 C
+ATOM 537 CG2 VAL A 32 51.651 3.466 8.451 1.00 17.16 C
+ATOM 538 H VAL A 32 52.760 5.234 5.835 1.00 0.00 H
+ATOM 539 HA VAL A 32 52.432 2.278 6.111 1.00 0.00 H
+ATOM 540 HB VAL A 32 50.462 4.440 6.953 1.00 0.00 H
+ATOM 541 1HG1 VAL A 32 49.148 2.591 7.856 1.00 0.00 H
+ATOM 542 2HG1 VAL A 32 49.342 2.476 6.091 1.00 0.00 H
+ATOM 543 3HG1 VAL A 32 50.306 1.431 7.162 1.00 0.00 H
+ATOM 544 1HG2 VAL A 32 50.918 3.624 9.242 1.00 0.00 H
+ATOM 545 2HG2 VAL A 32 52.143 2.505 8.599 1.00 0.00 H
+ATOM 546 3HG2 VAL A 32 52.395 4.263 8.481 1.00 0.00 H
+ATOM 547 N GLN A 33 51.161 2.171 3.957 1.00 16.15 N
+ATOM 548 CA GLN A 33 50.555 2.108 2.635 1.00 15.51 C
+ATOM 549 C GLN A 33 49.575 0.949 2.525 1.00 16.36 C
+ATOM 550 O GLN A 33 49.872 -0.170 2.940 1.00 14.27 O
+ATOM 551 CB GLN A 33 51.626 1.979 1.553 1.00 17.78 C
+ATOM 552 CG GLN A 33 51.057 1.907 0.146 1.00 39.98 C
+ATOM 553 CD GLN A 33 51.903 1.062 -0.781 1.00 37.61 C
+ATOM 554 OE1 GLN A 33 53.095 0.870 -0.548 1.00 53.50 O
+ATOM 555 NE2 GLN A 33 51.287 0.541 -1.835 1.00 33.87 N
+ATOM 556 H GLN A 33 51.515 1.323 4.377 1.00 0.00 H
+ATOM 557 HA GLN A 33 50.001 3.031 2.464 1.00 0.00 H
+ATOM 558 1HB GLN A 33 52.303 2.832 1.607 1.00 0.00 H
+ATOM 559 2HB GLN A 33 52.217 1.081 1.731 1.00 0.00 H
+ATOM 560 1HG GLN A 33 50.060 1.469 0.190 1.00 0.00 H
+ATOM 561 2HG GLN A 33 51.004 2.915 -0.266 1.00 0.00 H
+ATOM 562 1HE2 GLN A 33 51.797 -0.027 -2.483 1.00 0.00 H
+ATOM 563 2HE2 GLN A 33 50.313 0.715 -1.983 1.00 0.00 H
+ATOM 564 N LYS A 34 48.409 1.224 1.954 1.00 18.95 N
+ATOM 565 CA LYS A 34 47.359 0.223 1.841 1.00 19.34 C
+ATOM 566 C LYS A 34 47.118 -0.172 0.391 1.00 16.32 C
+ATOM 567 O LYS A 34 47.006 0.680 -0.489 1.00 10.27 O
+ATOM 568 CB LYS A 34 46.061 0.736 2.462 1.00 22.06 C
+ATOM 569 CG LYS A 34 44.922 -0.265 2.420 1.00 24.92 C
+ATOM 570 CD LYS A 34 43.683 0.290 3.093 1.00 26.35 C
+ATOM 571 CE LYS A 34 42.554 -0.714 3.073 1.00 28.10 C
+ATOM 572 NZ LYS A 34 42.023 -0.923 1.697 1.00 37.28 N
+ATOM 573 H LYS A 34 48.246 2.151 1.589 1.00 0.00 H
+ATOM 574 HA LYS A 34 47.674 -0.671 2.381 1.00 0.00 H
+ATOM 575 1HB LYS A 34 46.238 1.006 3.504 1.00 0.00 H
+ATOM 576 2HB LYS A 34 45.740 1.638 1.940 1.00 0.00 H
+ATOM 577 1HG LYS A 34 44.687 -0.506 1.383 1.00 0.00 H
+ATOM 578 2HG LYS A 34 45.224 -1.181 2.927 1.00 0.00 H
+ATOM 579 1HD LYS A 34 43.914 0.546 4.128 1.00 0.00 H
+ATOM 580 2HD LYS A 34 43.363 1.195 2.576 1.00 0.00 H
+ATOM 581 1HE LYS A 34 42.908 -1.667 3.463 1.00 0.00 H
+ATOM 582 2HE LYS A 34 41.744 -0.364 3.713 1.00 0.00 H
+ATOM 583 1HZ LYS A 34 41.272 -1.598 1.724 1.00 0.00 H
+ATOM 584 2HZ LYS A 34 41.675 -0.047 1.333 1.00 0.00 H
+ATOM 585 3HZ LYS A 34 42.761 -1.266 1.099 1.00 0.00 H
+ATOM 586 N GLN A 35 47.040 -1.478 0.160 1.00 20.70 N
+ATOM 587 CA GLN A 35 46.752 -2.025 -1.158 1.00 21.48 C
+ATOM 588 C GLN A 35 45.739 -3.155 -1.012 1.00 18.09 C
+ATOM 589 O GLN A 35 46.106 -4.299 -0.750 1.00 17.92 O
+ATOM 590 CB GLN A 35 48.034 -2.550 -1.806 1.00 23.99 C
+ATOM 591 CG GLN A 35 47.850 -3.082 -3.216 1.00 25.06 C
+ATOM 592 CD GLN A 35 49.069 -3.827 -3.724 1.00 30.48 C
+ATOM 593 OE1 GLN A 35 50.008 -4.091 -2.973 1.00 37.06 O
+ATOM 594 NE2 GLN A 35 49.059 -4.173 -5.007 1.00 22.43 N
+ATOM 595 H GLN A 35 47.187 -2.110 0.934 1.00 0.00 H
+ATOM 596 HA GLN A 35 46.345 -1.229 -1.781 1.00 0.00 H
+ATOM 597 1HB GLN A 35 48.776 -1.752 -1.843 1.00 0.00 H
+ATOM 598 2HB GLN A 35 48.447 -3.353 -1.196 1.00 0.00 H
+ATOM 599 1HG GLN A 35 47.004 -3.769 -3.227 1.00 0.00 H
+ATOM 600 2HG GLN A 35 47.660 -2.245 -3.887 1.00 0.00 H
+ATOM 601 1HE2 GLN A 35 49.837 -4.667 -5.399 1.00 0.00 H
+ATOM 602 2HE2 GLN A 35 48.275 -3.940 -5.582 1.00 0.00 H
+ATOM 603 N GLY A 36 44.462 -2.823 -1.171 1.00 18.05 N
+ATOM 604 CA GLY A 36 43.395 -3.792 -0.995 1.00 21.03 C
+ATOM 605 C GLY A 36 43.190 -4.096 0.476 1.00 25.96 C
+ATOM 606 O GLY A 36 42.935 -3.193 1.268 1.00 29.70 O
+ATOM 607 H GLY A 36 44.227 -1.873 -1.421 1.00 0.00 H
+ATOM 608 1HA GLY A 36 42.474 -3.402 -1.428 1.00 0.00 H
+ATOM 609 2HA GLY A 36 43.641 -4.706 -1.534 1.00 0.00 H
+ATOM 610 N ASN A 37 43.304 -5.367 0.845 1.00 21.31 N
+ATOM 611 CA ASN A 37 43.216 -5.758 2.248 1.00 22.32 C
+ATOM 612 C ASN A 37 44.600 -5.956 2.858 1.00 24.08 C
+ATOM 613 O ASN A 37 44.737 -6.462 3.972 1.00 16.42 O
+ATOM 614 CB ASN A 37 42.366 -7.019 2.418 1.00 18.53 C
+ATOM 615 CG ASN A 37 40.902 -6.782 2.095 1.00 30.99 C
+ATOM 616 OD1 ASN A 37 40.377 -5.689 2.306 1.00 43.76 O
+ATOM 617 ND2 ASN A 37 40.236 -7.811 1.584 1.00 29.18 N
+ATOM 618 H ASN A 37 43.454 -6.079 0.144 1.00 0.00 H
+ATOM 619 HA ASN A 37 42.742 -4.948 2.804 1.00 0.00 H
+ATOM 620 1HB ASN A 37 42.748 -7.806 1.766 1.00 0.00 H
+ATOM 621 2HB ASN A 37 42.447 -7.377 3.445 1.00 0.00 H
+ATOM 622 1HD2 ASN A 37 39.268 -7.714 1.351 1.00 0.00 H
+ATOM 623 2HD2 ASN A 37 40.702 -8.682 1.432 1.00 0.00 H
+ATOM 624 N THR A 38 45.626 -5.560 2.111 1.00 21.10 N
+ATOM 625 CA THR A 38 47.002 -5.679 2.573 1.00 21.20 C
+ATOM 626 C THR A 38 47.589 -4.302 2.862 1.00 22.77 C
+ATOM 627 O THR A 38 47.539 -3.409 2.018 1.00 14.04 O
+ATOM 628 CB THR A 38 47.879 -6.389 1.524 1.00 27.68 C
+ATOM 629 OG1 THR A 38 47.451 -7.749 1.381 1.00 45.20 O
+ATOM 630 CG2 THR A 38 49.344 -6.357 1.933 1.00 22.24 C
+ATOM 631 H THR A 38 45.446 -5.166 1.199 1.00 0.00 H
+ATOM 632 HA THR A 38 47.010 -6.274 3.487 1.00 0.00 H
+ATOM 633 HB THR A 38 47.768 -5.892 0.561 1.00 0.00 H
+ATOM 634 HG1 THR A 38 46.712 -7.915 1.971 1.00 0.00 H
+ATOM 635 1HG2 THR A 38 49.944 -6.864 1.177 1.00 0.00 H
+ATOM 636 2HG2 THR A 38 49.674 -5.322 2.025 1.00 0.00 H
+ATOM 637 3HG2 THR A 38 49.465 -6.862 2.890 1.00 0.00 H
+ATOM 638 N ILE A 39 48.142 -4.132 4.058 1.00 17.80 N
+ATOM 639 CA ILE A 39 48.776 -2.871 4.425 1.00 19.47 C
+ATOM 640 C ILE A 39 50.262 -3.049 4.730 1.00 11.46 C
+ATOM 641 O ILE A 39 50.655 -3.924 5.502 1.00 13.43 O
+ATOM 642 CB ILE A 39 48.063 -2.203 5.618 1.00 14.16 C
+ATOM 643 CG1 ILE A 39 46.554 -2.152 5.367 1.00 14.60 C
+ATOM 644 CG2 ILE A 39 48.595 -0.797 5.840 1.00 12.40 C
+ATOM 645 CD1 ILE A 39 45.794 -1.281 6.338 1.00 17.15 C
+ATOM 646 H ILE A 39 48.125 -4.887 4.728 1.00 0.00 H
+ATOM 647 HA ILE A 39 48.717 -2.194 3.574 1.00 0.00 H
+ATOM 648 HB ILE A 39 48.234 -2.791 6.519 1.00 0.00 H
+ATOM 649 1HG1 ILE A 39 46.365 -1.780 4.361 1.00 0.00 H
+ATOM 650 2HG1 ILE A 39 46.141 -3.159 5.425 1.00 0.00 H
+ATOM 651 1HG2 ILE A 39 48.079 -0.342 6.685 1.00 0.00 H
+ATOM 652 2HG2 ILE A 39 49.663 -0.841 6.048 1.00 0.00 H
+ATOM 653 3HG2 ILE A 39 48.424 -0.198 4.946 1.00 0.00 H
+ATOM 654 1HD1 ILE A 39 44.732 -1.300 6.090 1.00 0.00 H
+ATOM 655 2HD1 ILE A 39 45.937 -1.656 7.352 1.00 0.00 H
+ATOM 656 3HD1 ILE A 39 46.162 -0.258 6.274 1.00 0.00 H
+ATOM 657 N ARG A 40 51.082 -2.203 4.116 1.00 11.02 N
+ATOM 658 CA ARG A 40 52.528 -2.270 4.276 1.00 13.88 C
+ATOM 659 C ARG A 40 53.029 -1.157 5.186 1.00 12.89 C
+ATOM 660 O ARG A 40 52.836 0.024 4.902 1.00 12.55 O
+ATOM 661 CB ARG A 40 53.227 -2.201 2.917 1.00 16.81 C
+ATOM 662 CG ARG A 40 53.001 -3.420 2.038 1.00 27.86 C
+ATOM 663 CD ARG A 40 53.752 -3.296 0.723 1.00 32.62 C
+ATOM 664 NE ARG A 40 53.638 -4.502 -0.092 1.00 39.80 N
+ATOM 665 CZ ARG A 40 52.686 -4.706 -0.996 1.00 53.12 C
+ATOM 666 NH1 ARG A 40 51.758 -3.782 -1.205 1.00 40.03 N
+ATOM 667 NH2 ARG A 40 52.660 -5.835 -1.692 1.00 49.75 N
+ATOM 668 H ARG A 40 50.686 -1.491 3.519 1.00 0.00 H
+ATOM 669 HA ARG A 40 52.780 -3.220 4.747 1.00 0.00 H
+ATOM 670 1HB ARG A 40 52.878 -1.325 2.373 1.00 0.00 H
+ATOM 671 2HB ARG A 40 54.301 -2.088 3.066 1.00 0.00 H
+ATOM 672 1HG ARG A 40 53.353 -4.313 2.556 1.00 0.00 H
+ATOM 673 2HG ARG A 40 51.937 -3.521 1.822 1.00 0.00 H
+ATOM 674 1HD ARG A 40 53.348 -2.461 0.151 1.00 0.00 H
+ATOM 675 2HD ARG A 40 54.809 -3.121 0.923 1.00 0.00 H
+ATOM 676 HE ARG A 40 54.330 -5.227 0.042 1.00 0.00 H
+ATOM 677 1HH1 ARG A 40 51.774 -2.921 -0.676 1.00 0.00 H
+ATOM 678 2HH1 ARG A 40 51.035 -3.939 -1.892 1.00 0.00 H
+ATOM 679 1HH2 ARG A 40 53.365 -6.542 -1.535 1.00 0.00 H
+ATOM 680 2HH2 ARG A 40 51.936 -5.988 -2.378 1.00 0.00 H
+ATOM 681 N VAL A 41 53.665 -1.544 6.287 1.00 9.53 N
+ATOM 682 CA VAL A 41 54.165 -0.582 7.260 1.00 11.36 C
+ATOM 683 C VAL A 41 55.689 -0.607 7.302 1.00 12.46 C
+ATOM 684 O VAL A 41 56.301 -1.642 7.567 1.00 10.76 O
+ATOM 685 CB VAL A 41 53.612 -0.864 8.668 1.00 16.45 C
+ATOM 686 CG1 VAL A 41 54.093 0.195 9.646 1.00 6.95 C
+ATOM 687 CG2 VAL A 41 52.093 -0.923 8.639 1.00 9.34 C
+ATOM 688 H VAL A 41 53.805 -2.530 6.453 1.00 0.00 H
+ATOM 689 HA VAL A 41 53.839 0.415 6.960 1.00 0.00 H
+ATOM 690 HB VAL A 41 54.002 -1.820 9.017 1.00 0.00 H
+ATOM 691 1HG1 VAL A 41 53.694 -0.018 10.638 1.00 0.00 H
+ATOM 692 2HG1 VAL A 41 55.182 0.187 9.684 1.00 0.00 H
+ATOM 693 3HG1 VAL A 41 53.747 1.176 9.319 1.00 0.00 H
+ATOM 694 1HG2 VAL A 41 51.718 -1.124 9.642 1.00 0.00 H
+ATOM 695 2HG2 VAL A 41 51.698 0.031 8.288 1.00 0.00 H
+ATOM 696 3HG2 VAL A 41 51.772 -1.718 7.966 1.00 0.00 H
+ATOM 697 N GLU A 42 56.292 0.544 7.025 1.00 14.96 N
+ATOM 698 CA GLU A 42 57.740 0.685 7.033 1.00 15.29 C
+ATOM 699 C GLU A 42 58.195 1.299 8.352 1.00 11.07 C
+ATOM 700 O GLU A 42 57.741 2.378 8.732 1.00 15.45 O
+ATOM 701 CB GLU A 42 58.171 1.570 5.864 1.00 11.66 C
+ATOM 702 CG GLU A 42 57.788 1.005 4.505 1.00 24.83 C
+ATOM 703 CD GLU A 42 58.108 1.950 3.365 1.00 43.69 C
+ATOM 704 OE1 GLU A 42 59.067 2.740 3.492 1.00 41.20 O
+ATOM 705 OE2 GLU A 42 57.385 1.916 2.346 1.00 39.41 O
+ATOM 706 H GLU A 42 55.721 1.346 6.802 1.00 0.00 H
+ATOM 707 HA GLU A 42 58.185 -0.304 6.916 1.00 0.00 H
+ATOM 708 1HB GLU A 42 57.717 2.556 5.967 1.00 0.00 H
+ATOM 709 2HB GLU A 42 59.253 1.704 5.888 1.00 0.00 H
+ATOM 710 1HG GLU A 42 58.324 0.069 4.348 1.00 0.00 H
+ATOM 711 2HG GLU A 42 56.721 0.786 4.502 1.00 0.00 H
+ATOM 712 N LEU A 43 59.096 0.611 9.048 1.00 13.91 N
+ATOM 713 CA LEU A 43 59.596 1.094 10.330 1.00 15.06 C
+ATOM 714 C LEU A 43 61.117 1.116 10.323 1.00 14.78 C
+ATOM 715 O LEU A 43 61.758 0.362 9.592 1.00 13.95 O
+ATOM 716 CB LEU A 43 59.090 0.219 11.484 1.00 12.11 C
+ATOM 717 CG LEU A 43 57.589 -0.074 11.546 1.00 11.51 C
+ATOM 718 CD1 LEU A 43 57.298 -1.323 10.761 1.00 8.56 C
+ATOM 719 CD2 LEU A 43 57.108 -0.238 12.975 1.00 15.40 C
+ATOM 720 H LEU A 43 59.443 -0.265 8.683 1.00 0.00 H
+ATOM 721 HA LEU A 43 59.231 2.109 10.483 1.00 0.00 H
+ATOM 722 1HB LEU A 43 59.595 -0.744 11.437 1.00 0.00 H
+ATOM 723 2HB LEU A 43 59.355 0.699 12.426 1.00 0.00 H
+ATOM 724 HG LEU A 43 57.038 0.750 11.091 1.00 0.00 H
+ATOM 725 1HD1 LEU A 43 56.230 -1.537 10.801 1.00 0.00 H
+ATOM 726 2HD1 LEU A 43 57.600 -1.179 9.723 1.00 0.00 H
+ATOM 727 3HD1 LEU A 43 57.852 -2.158 11.188 1.00 0.00 H
+ATOM 728 1HD2 LEU A 43 56.037 -0.444 12.977 1.00 0.00 H
+ATOM 729 2HD2 LEU A 43 57.638 -1.067 13.445 1.00 0.00 H
+ATOM 730 3HD2 LEU A 43 57.302 0.679 13.532 1.00 0.00 H
+ATOM 731 N GLU A 44 61.691 1.992 11.150 1.00 23.39 N
+ATOM 732 CA GLU A 44 63.138 2.120 11.250 1.00 20.10 C
+ATOM 733 C GLU A 44 63.600 2.059 12.702 1.00 21.79 C
+ATOM 734 O GLU A 44 63.018 2.689 13.580 1.00 24.55 O
+ATOM 735 CB GLU A 44 63.601 3.432 10.607 1.00 20.27 C
+ATOM 736 CG GLU A 44 65.112 3.641 10.628 1.00 34.09 C
+ATOM 737 CD GLU A 44 65.554 4.835 9.805 1.00 41.11 C
+ATOM 738 OE1 GLU A 44 64.712 5.396 9.078 1.00 47.28 O
+ATOM 739 OE2 GLU A 44 66.740 5.212 9.885 1.00 53.78 O
+ATOM 740 H GLU A 44 61.104 2.582 11.722 1.00 0.00 H
+ATOM 741 HA GLU A 44 63.597 1.287 10.716 1.00 0.00 H
+ATOM 742 1HB GLU A 44 63.272 3.464 9.568 1.00 0.00 H
+ATOM 743 2HB GLU A 44 63.138 4.273 11.123 1.00 0.00 H
+ATOM 744 1HG GLU A 44 65.434 3.786 11.659 1.00 0.00 H
+ATOM 745 2HG GLU A 44 65.598 2.744 10.247 1.00 0.00 H
+ATOM 746 N ILE A 45 64.661 1.289 12.940 1.00 38.86 N
+ATOM 747 CA ILE A 45 65.290 1.200 14.253 1.00 31.32 C
+ATOM 748 C ILE A 45 66.724 1.722 14.194 1.00 30.92 C
+ATOM 749 O ILE A 45 67.481 1.381 13.286 1.00 44.07 O
+ATOM 750 CB ILE A 45 65.290 -0.251 14.785 1.00 24.35 C
+ATOM 751 CG1 ILE A 45 63.860 -0.780 14.909 1.00 22.64 C
+ATOM 752 CG2 ILE A 45 65.986 -0.342 16.133 1.00 35.22 C
+ATOM 753 CD1 ILE A 45 63.773 -2.149 15.538 1.00 34.33 C
+ATOM 754 H ILE A 45 65.039 0.748 12.176 1.00 0.00 H
+ATOM 755 HA ILE A 45 64.724 1.817 14.950 1.00 0.00 H
+ATOM 756 HB ILE A 45 65.813 -0.897 14.080 1.00 0.00 H
+ATOM 757 1HG1 ILE A 45 63.267 -0.089 15.508 1.00 0.00 H
+ATOM 758 2HG1 ILE A 45 63.403 -0.829 13.920 1.00 0.00 H
+ATOM 759 1HG2 ILE A 45 65.970 -1.374 16.482 1.00 0.00 H
+ATOM 760 2HG2 ILE A 45 67.018 -0.010 16.032 1.00 0.00 H
+ATOM 761 3HG2 ILE A 45 65.469 0.293 16.853 1.00 0.00 H
+ATOM 762 1HD1 ILE A 45 62.729 -2.459 15.593 1.00 0.00 H
+ATOM 763 2HD1 ILE A 45 64.332 -2.864 14.933 1.00 0.00 H
+ATOM 764 3HD1 ILE A 45 64.193 -2.115 16.542 1.00 0.00 H
+ATOM 765 N THR A 46 67.095 2.550 15.169 1.00 32.51 N
+ATOM 766 CA THR A 46 68.449 3.089 15.239 1.00 38.74 C
+ATOM 767 C THR A 46 69.003 2.949 16.651 1.00 42.99 C
+ATOM 768 O THR A 46 68.718 3.752 17.536 1.00 68.14 O
+ATOM 769 CB THR A 46 68.510 4.572 14.814 1.00 45.68 C
+ATOM 770 OG1 THR A 46 68.079 4.698 13.454 1.00 43.78 O
+ATOM 771 CG2 THR A 46 69.935 5.105 14.936 1.00 32.41 C
+ATOM 772 H THR A 46 66.424 2.812 15.877 1.00 0.00 H
+ATOM 773 HA THR A 46 69.083 2.521 14.558 1.00 0.00 H
+ATOM 774 HB THR A 46 67.852 5.161 15.453 1.00 0.00 H
+ATOM 775 HG1 THR A 46 67.848 3.831 13.110 1.00 0.00 H
+ATOM 776 1HG2 THR A 46 69.959 6.152 14.633 1.00 0.00 H
+ATOM 777 2HG2 THR A 46 70.268 5.019 15.970 1.00 0.00 H
+ATOM 778 3HG2 THR A 46 70.596 4.526 14.292 1.00 0.00 H
+ATOM 779 N GLU A 47 69.800 1.900 16.853 1.00 50.86 N
+ATOM 780 CA GLU A 47 70.365 1.593 18.159 1.00 54.88 C
+ATOM 781 C GLU A 47 71.730 0.924 18.019 1.00 53.93 C
+ATOM 782 O GLU A 47 71.967 0.177 17.067 1.00 41.27 O
+ATOM 783 CB GLU A 47 69.431 0.699 18.978 1.00 50.76 C
+ATOM 784 CG GLU A 47 69.165 -0.660 18.354 1.00 46.71 C
+ATOM 785 CD GLU A 47 68.171 -1.483 19.152 1.00 57.30 C
+ATOM 786 OE1 GLU A 47 67.746 -1.021 20.230 1.00 57.79 O
+ATOM 787 OE2 GLU A 47 67.812 -2.590 18.697 1.00 69.29 O
+ATOM 788 H GLU A 47 70.017 1.300 16.070 1.00 0.00 H
+ATOM 789 HA GLU A 47 70.505 2.527 18.704 1.00 0.00 H
+ATOM 790 1HB GLU A 47 69.858 0.537 19.968 1.00 0.00 H
+ATOM 791 2HB GLU A 47 68.473 1.201 19.113 1.00 0.00 H
+ATOM 792 1HG GLU A 47 68.778 -0.516 17.346 1.00 0.00 H
+ATOM 793 2HG GLU A 47 70.106 -1.203 18.278 1.00 0.00 H
+ATOM 794 N ASN A 48 72.619 1.209 18.964 1.00 51.25 N
+ATOM 795 CA ASN A 48 73.941 0.583 19.031 1.00 42.23 C
+ATOM 796 C ASN A 48 74.746 0.734 17.743 1.00 48.56 C
+ATOM 797 O ASN A 48 75.388 -0.210 17.283 1.00 39.64 O
+ATOM 798 CB ASN A 48 73.805 -0.903 19.380 1.00 54.12 C
+ATOM 799 CG ASN A 48 72.898 -1.140 20.565 1.00 52.72 C
+ATOM 800 OD1 ASN A 48 72.157 -0.251 20.990 1.00 64.05 O
+ATOM 801 ND2 ASN A 48 72.932 -2.351 21.110 1.00 53.66 N
+ATOM 802 H ASN A 48 72.361 1.890 19.664 1.00 0.00 H
+ATOM 803 HA ASN A 48 74.519 1.077 19.814 1.00 0.00 H
+ATOM 804 1HB ASN A 48 73.409 -1.444 18.520 1.00 0.00 H
+ATOM 805 2HB ASN A 48 74.789 -1.316 19.602 1.00 0.00 H
+ATOM 806 1HD2 ASN A 48 72.351 -2.562 21.897 1.00 0.00 H
+ATOM 807 2HD2 ASN A 48 73.538 -3.052 20.734 1.00 0.00 H
+ATOM 808 N GLY A 49 74.708 1.934 17.170 1.00 47.38 N
+ATOM 809 CA GLY A 49 75.456 2.235 15.964 1.00 42.76 C
+ATOM 810 C GLY A 49 74.998 1.475 14.734 1.00 48.25 C
+ATOM 811 O GLY A 49 75.754 1.332 13.773 1.00 53.74 O
+ATOM 812 H GLY A 49 74.140 2.656 17.590 1.00 0.00 H
+ATOM 813 1HA GLY A 49 75.383 3.301 15.747 1.00 0.00 H
+ATOM 814 2HA GLY A 49 76.510 2.011 16.124 1.00 0.00 H
+ATOM 815 N LYS A 50 73.764 0.982 14.759 1.00 39.00 N
+ATOM 816 CA LYS A 50 73.203 0.278 13.610 1.00 34.19 C
+ATOM 817 C LYS A 50 71.857 0.857 13.181 1.00 30.49 C
+ATOM 818 O LYS A 50 71.107 1.387 13.999 1.00 27.56 O
+ATOM 819 CB LYS A 50 73.084 -1.224 13.886 1.00 35.40 C
+ATOM 820 CG LYS A 50 74.420 -1.924 14.078 1.00 46.16 C
+ATOM 821 CD LYS A 50 74.245 -3.420 14.289 1.00 46.53 C
+ATOM 822 CE LYS A 50 75.592 -4.125 14.352 1.00 47.08 C
+ATOM 823 NZ LYS A 50 75.448 -5.586 14.593 1.00 42.94 N
+ATOM 824 H LYS A 50 73.201 1.096 15.589 1.00 0.00 H
+ATOM 825 HA LYS A 50 73.870 0.418 12.759 1.00 0.00 H
+ATOM 826 1HB LYS A 50 72.486 -1.383 14.784 1.00 0.00 H
+ATOM 827 2HB LYS A 50 72.565 -1.706 13.057 1.00 0.00 H
+ATOM 828 1HG LYS A 50 75.045 -1.764 13.198 1.00 0.00 H
+ATOM 829 2HG LYS A 50 74.929 -1.504 14.945 1.00 0.00 H
+ATOM 830 1HD LYS A 50 73.705 -3.596 15.221 1.00 0.00 H
+ATOM 831 2HD LYS A 50 73.662 -3.838 13.468 1.00 0.00 H
+ATOM 832 1HE LYS A 50 76.125 -3.976 13.414 1.00 0.00 H
+ATOM 833 2HE LYS A 50 76.190 -3.696 15.156 1.00 0.00 H
+ATOM 834 1HZ LYS A 50 76.363 -6.014 14.628 1.00 0.00 H
+ATOM 835 2HZ LYS A 50 74.972 -5.738 15.471 1.00 0.00 H
+ATOM 836 3HZ LYS A 50 74.912 -6.000 13.844 1.00 0.00 H
+ATOM 837 N LYS A 51 71.562 0.747 11.890 1.00 36.49 N
+ATOM 838 CA LYS A 51 70.303 1.228 11.339 1.00 29.94 C
+ATOM 839 C LYS A 51 69.587 0.109 10.592 1.00 25.15 C
+ATOM 840 O LYS A 51 70.083 -0.396 9.585 1.00 28.61 O
+ATOM 841 CB LYS A 51 70.566 2.409 10.401 1.00 24.90 C
+ATOM 842 CG LYS A 51 69.355 2.891 9.622 1.00 31.35 C
+ATOM 843 CD LYS A 51 69.729 4.053 8.714 1.00 47.01 C
+ATOM 844 CE LYS A 51 68.758 4.187 7.554 1.00 45.60 C
+ATOM 845 NZ LYS A 51 68.843 3.018 6.636 1.00 42.91 N
+ATOM 846 H LYS A 51 72.236 0.315 11.274 1.00 0.00 H
+ATOM 847 HA LYS A 51 69.670 1.563 12.162 1.00 0.00 H
+ATOM 848 1HB LYS A 51 70.944 3.254 10.977 1.00 0.00 H
+ATOM 849 2HB LYS A 51 71.335 2.135 9.678 1.00 0.00 H
+ATOM 850 1HG LYS A 51 68.962 2.073 9.018 1.00 0.00 H
+ATOM 851 2HG LYS A 51 68.579 3.211 10.317 1.00 0.00 H
+ATOM 852 1HD LYS A 51 69.724 4.980 9.289 1.00 0.00 H
+ATOM 853 2HD LYS A 51 70.732 3.897 8.318 1.00 0.00 H
+ATOM 854 1HE LYS A 51 67.742 4.265 7.938 1.00 0.00 H
+ATOM 855 2HE LYS A 51 68.982 5.095 6.995 1.00 0.00 H
+ATOM 856 1HZ LYS A 51 68.187 3.137 5.877 1.00 0.00 H
+ATOM 857 2HZ LYS A 51 69.780 2.949 6.264 1.00 0.00 H
+ATOM 858 3HZ LYS A 51 68.620 2.174 7.144 1.00 0.00 H
+ATOM 859 N THR A 52 68.420 -0.277 11.095 1.00 24.48 N
+ATOM 860 CA THR A 52 67.665 -1.388 10.524 1.00 23.99 C
+ATOM 861 C THR A 52 66.337 -0.932 9.930 1.00 20.36 C
+ATOM 862 O THR A 52 65.480 -0.404 10.638 1.00 13.58 O
+ATOM 863 CB THR A 52 67.408 -2.500 11.559 1.00 20.39 C
+ATOM 864 OG1 THR A 52 66.650 -1.974 12.651 1.00 44.40 O
+ATOM 865 CG2 THR A 52 68.718 -3.051 12.086 1.00 16.52 C
+ATOM 866 H THR A 52 68.045 0.213 11.895 1.00 0.00 H
+ATOM 867 HA THR A 52 68.245 -1.817 9.707 1.00 0.00 H
+ATOM 868 HB THR A 52 66.843 -3.307 11.093 1.00 0.00 H
+ATOM 869 HG1 THR A 52 66.470 -1.044 12.496 1.00 0.00 H
+ATOM 870 1HG2 THR A 52 68.516 -3.835 12.815 1.00 0.00 H
+ATOM 871 2HG2 THR A 52 69.298 -3.463 11.260 1.00 0.00 H
+ATOM 872 3HG2 THR A 52 69.284 -2.251 12.562 1.00 0.00 H
+ATOM 873 N ASN A 53 66.174 -1.137 8.628 1.00 18.31 N
+ATOM 874 CA ASN A 53 64.923 -0.822 7.951 1.00 19.32 C
+ATOM 875 C ASN A 53 63.992 -2.026 7.966 1.00 17.83 C
+ATOM 876 O ASN A 53 64.364 -3.114 7.528 1.00 18.42 O
+ATOM 877 CB ASN A 53 65.188 -0.384 6.511 1.00 25.04 C
+ATOM 878 CG ASN A 53 65.939 0.929 6.430 1.00 27.71 C
+ATOM 879 OD1 ASN A 53 65.884 1.747 7.349 1.00 38.79 O
+ATOM 880 ND2 ASN A 53 66.649 1.138 5.328 1.00 41.33 N
+ATOM 881 H ASN A 53 66.939 -1.522 8.093 1.00 0.00 H
+ATOM 882 HA ASN A 53 64.440 -0.000 8.482 1.00 0.00 H
+ATOM 883 1HB ASN A 53 65.767 -1.153 5.997 1.00 0.00 H
+ATOM 884 2HB ASN A 53 64.241 -0.280 5.982 1.00 0.00 H
+ATOM 885 1HD2 ASN A 53 67.166 1.988 5.219 1.00 0.00 H
+ATOM 886 2HD2 ASN A 53 66.668 0.446 4.607 1.00 0.00 H
+ATOM 887 N ILE A 54 62.779 -1.829 8.471 1.00 19.57 N
+ATOM 888 CA ILE A 54 61.832 -2.927 8.607 1.00 19.31 C
+ATOM 889 C ILE A 54 60.555 -2.693 7.810 1.00 16.70 C
+ATOM 890 O ILE A 54 59.938 -1.632 7.902 1.00 13.45 O
+ATOM 891 CB ILE A 54 61.444 -3.143 10.083 1.00 18.24 C
+ATOM 892 CG1 ILE A 54 62.696 -3.230 10.959 1.00 21.04 C
+ATOM 893 CG2 ILE A 54 60.573 -4.382 10.232 1.00 24.52 C
+ATOM 894 CD1 ILE A 54 62.408 -3.541 12.409 1.00 28.71 C
+ATOM 895 H ILE A 54 62.505 -0.903 8.767 1.00 0.00 H
+ATOM 896 HA ILE A 54 62.303 -3.838 8.239 1.00 0.00 H
+ATOM 897 HB ILE A 54 60.890 -2.277 10.444 1.00 0.00 H
+ATOM 898 1HG1 ILE A 54 63.359 -4.002 10.570 1.00 0.00 H
+ATOM 899 2HG1 ILE A 54 63.237 -2.284 10.916 1.00 0.00 H
+ATOM 900 1HG2 ILE A 54 60.310 -4.518 11.281 1.00 0.00 H
+ATOM 901 2HG2 ILE A 54 59.665 -4.261 9.643 1.00 0.00 H
+ATOM 902 3HG2 ILE A 54 61.120 -5.256 9.879 1.00 0.00 H
+ATOM 903 1HD1 ILE A 54 63.345 -3.586 12.965 1.00 0.00 H
+ATOM 904 2HD1 ILE A 54 61.773 -2.760 12.830 1.00 0.00 H
+ATOM 905 3HD1 ILE A 54 61.899 -4.501 12.481 1.00 0.00 H
+ATOM 906 N THR A 55 60.176 -3.688 7.015 1.00 16.56 N
+ATOM 907 CA THR A 55 58.906 -3.668 6.302 1.00 15.14 C
+ATOM 908 C THR A 55 58.027 -4.825 6.764 1.00 15.85 C
+ATOM 909 O THR A 55 58.390 -5.989 6.605 1.00 10.97 O
+ATOM 910 CB THR A 55 59.112 -3.766 4.781 1.00 21.11 C
+ATOM 911 OG1 THR A 55 59.870 -2.640 4.323 1.00 24.13 O
+ATOM 912 CG2 THR A 55 57.771 -3.796 4.064 1.00 23.67 C
+ATOM 913 H THR A 55 60.790 -4.482 6.904 1.00 0.00 H
+ATOM 914 HA THR A 55 58.404 -2.724 6.517 1.00 0.00 H
+ATOM 915 HB THR A 55 59.664 -4.676 4.547 1.00 0.00 H
+ATOM 916 HG1 THR A 55 60.082 -2.073 5.068 1.00 0.00 H
+ATOM 917 1HG2 THR A 55 57.935 -3.866 2.989 1.00 0.00 H
+ATOM 918 2HG2 THR A 55 57.198 -4.659 4.401 1.00 0.00 H
+ATOM 919 3HG2 THR A 55 57.219 -2.884 4.288 1.00 0.00 H
+ATOM 920 N VAL A 56 56.879 -4.502 7.348 1.00 16.43 N
+ATOM 921 CA VAL A 56 55.932 -5.521 7.793 1.00 16.62 C
+ATOM 922 C VAL A 56 54.610 -5.450 7.033 1.00 16.35 C
+ATOM 923 O VAL A 56 53.969 -4.400 6.969 1.00 22.74 O
+ATOM 924 CB VAL A 56 55.678 -5.438 9.305 1.00 9.42 C
+ATOM 925 CG1 VAL A 56 55.514 -4.010 9.708 1.00 26.38 C
+ATOM 926 CG2 VAL A 56 54.452 -6.252 9.691 1.00 8.90 C
+ATOM 927 H VAL A 56 56.655 -3.527 7.488 1.00 0.00 H
+ATOM 928 HA VAL A 56 56.352 -6.503 7.574 1.00 0.00 H
+ATOM 929 HB VAL A 56 56.547 -5.831 9.832 1.00 0.00 H
+ATOM 930 1HG1 VAL A 56 55.334 -3.953 10.782 1.00 0.00 H
+ATOM 931 2HG1 VAL A 56 56.420 -3.456 9.463 1.00 0.00 H
+ATOM 932 3HG1 VAL A 56 54.667 -3.577 9.176 1.00 0.00 H
+ATOM 933 1HG2 VAL A 56 54.291 -6.180 10.766 1.00 0.00 H
+ATOM 934 2HG2 VAL A 56 53.578 -5.865 9.166 1.00 0.00 H
+ATOM 935 3HG2 VAL A 56 54.607 -7.296 9.417 1.00 0.00 H
+ATOM 936 N GLU A 57 54.219 -6.573 6.440 1.00 13.21 N
+ATOM 937 CA GLU A 57 52.946 -6.678 5.738 1.00 13.55 C
+ATOM 938 C GLU A 57 51.816 -7.148 6.653 1.00 18.59 C
+ATOM 939 O GLU A 57 51.844 -8.267 7.163 1.00 10.69 O
+ATOM 940 CB GLU A 57 53.075 -7.606 4.532 1.00 11.82 C
+ATOM 941 CG GLU A 57 54.088 -7.134 3.511 1.00 36.10 C
+ATOM 942 CD GLU A 57 54.192 -8.069 2.325 1.00 55.85 C
+ATOM 943 OE1 GLU A 57 53.496 -9.106 2.322 1.00 66.05 O
+ATOM 944 OE2 GLU A 57 54.971 -7.766 1.397 1.00 54.59 O
+ATOM 945 H GLU A 57 54.827 -7.378 6.479 1.00 0.00 H
+ATOM 946 HA GLU A 57 52.662 -5.686 5.385 1.00 0.00 H
+ATOM 947 1HB GLU A 57 53.366 -8.601 4.868 1.00 0.00 H
+ATOM 948 2HB GLU A 57 52.108 -7.697 4.038 1.00 0.00 H
+ATOM 949 1HG GLU A 57 53.800 -6.144 3.159 1.00 0.00 H
+ATOM 950 2HG GLU A 57 55.061 -7.049 3.993 1.00 0.00 H
+ATOM 951 N VAL A 58 50.831 -6.280 6.865 1.00 14.14 N
+ATOM 952 CA VAL A 58 49.678 -6.610 7.695 1.00 11.93 C
+ATOM 953 C VAL A 58 48.476 -6.912 6.809 1.00 17.50 C
+ATOM 954 O VAL A 58 48.179 -6.172 5.871 1.00 14.84 O
+ATOM 955 CB VAL A 58 49.325 -5.452 8.647 1.00 19.10 C
+ATOM 956 CG1 VAL A 58 48.174 -5.844 9.559 1.00 7.40 C
+ATOM 957 CG2 VAL A 58 50.548 -5.043 9.461 1.00 16.80 C
+ATOM 958 H VAL A 58 50.884 -5.366 6.438 1.00 0.00 H
+ATOM 959 HA VAL A 58 49.925 -7.485 8.298 1.00 0.00 H
+ATOM 960 HB VAL A 58 48.983 -4.601 8.058 1.00 0.00 H
+ATOM 961 1HG1 VAL A 58 47.938 -5.013 10.225 1.00 0.00 H
+ATOM 962 2HG1 VAL A 58 47.299 -6.085 8.957 1.00 0.00 H
+ATOM 963 3HG1 VAL A 58 48.459 -6.713 10.152 1.00 0.00 H
+ATOM 964 1HG2 VAL A 58 50.283 -4.223 10.128 1.00 0.00 H
+ATOM 965 2HG2 VAL A 58 50.895 -5.893 10.049 1.00 0.00 H
+ATOM 966 3HG2 VAL A 58 51.342 -4.720 8.787 1.00 0.00 H
+ATOM 967 N GLU A 59 47.790 -8.020 7.102 1.00 13.21 N
+ATOM 968 CA GLU A 59 46.627 -8.424 6.320 1.00 13.30 C
+ATOM 969 C GLU A 59 45.314 -8.304 7.090 1.00 18.21 C
+ATOM 970 O GLU A 59 45.209 -8.739 8.236 1.00 12.87 O
+ATOM 971 CB GLU A 59 46.804 -9.852 5.801 1.00 13.64 C
+ATOM 972 CG GLU A 59 45.661 -10.340 4.923 1.00 21.57 C
+ATOM 973 CD GLU A 59 45.521 -9.545 3.632 1.00 43.95 C
+ATOM 974 OE1 GLU A 59 46.531 -8.985 3.156 1.00 51.90 O
+ATOM 975 OE2 GLU A 59 44.397 -9.483 3.091 1.00 51.79 O
+ATOM 976 H GLU A 59 48.081 -8.592 7.882 1.00 0.00 H
+ATOM 977 HA GLU A 59 46.533 -7.751 5.467 1.00 0.00 H
+ATOM 978 1HB GLU A 59 47.726 -9.917 5.222 1.00 0.00 H
+ATOM 979 2HB GLU A 59 46.898 -10.537 6.644 1.00 0.00 H
+ATOM 980 1HG GLU A 59 45.830 -11.387 4.674 1.00 0.00 H
+ATOM 981 2HG GLU A 59 44.731 -10.275 5.486 1.00 0.00 H
+ATOM 982 N LYS A 60 44.309 -7.715 6.440 1.00 18.03 N
+ATOM 983 CA LYS A 60 42.967 -7.620 7.001 1.00 20.34 C
+ATOM 984 C LYS A 60 42.096 -8.780 6.532 1.00 28.90 C
+ATOM 985 O LYS A 60 41.798 -8.900 5.343 1.00 27.53 O
+ATOM 986 CB LYS A 60 42.313 -6.297 6.588 1.00 14.81 C
+ATOM 987 CG LYS A 60 40.810 -6.235 6.829 1.00 16.27 C
+ATOM 988 CD LYS A 60 40.200 -4.976 6.218 1.00 27.65 C
+ATOM 989 CE LYS A 60 38.689 -4.917 6.428 1.00 25.52 C
+ATOM 990 NZ LYS A 60 38.320 -4.916 7.867 1.00 29.72 N
+ATOM 991 H LYS A 60 44.490 -7.323 5.527 1.00 0.00 H
+ATOM 992 HA LYS A 60 43.044 -7.649 8.088 1.00 0.00 H
+ATOM 993 1HB LYS A 60 42.774 -5.476 7.138 1.00 0.00 H
+ATOM 994 2HB LYS A 60 42.489 -6.120 5.527 1.00 0.00 H
+ATOM 995 1HG LYS A 60 40.334 -7.110 6.386 1.00 0.00 H
+ATOM 996 2HG LYS A 60 40.613 -6.240 7.901 1.00 0.00 H
+ATOM 997 1HD LYS A 60 40.652 -4.094 6.674 1.00 0.00 H
+ATOM 998 2HD LYS A 60 40.405 -4.955 5.148 1.00 0.00 H
+ATOM 999 1HE LYS A 60 38.293 -4.014 5.966 1.00 0.00 H
+ATOM 1000 2HE LYS A 60 38.221 -5.778 5.950 1.00 0.00 H
+ATOM 1001 1HZ LYS A 60 37.315 -4.877 7.957 1.00 0.00 H
+ATOM 1002 2HZ LYS A 60 38.664 -5.760 8.304 1.00 0.00 H
+ATOM 1003 3HZ LYS A 60 38.730 -4.111 8.320 1.00 0.00 H
+ATOM 1004 N GLN A 61 41.694 -9.629 7.469 1.00 26.48 N
+ATOM 1005 CA GLN A 61 40.840 -10.771 7.161 1.00 23.43 C
+ATOM 1006 C GLN A 61 39.547 -10.651 7.954 1.00 26.73 C
+ATOM 1007 O GLN A 61 39.509 -10.960 9.144 1.00 25.47 O
+ATOM 1008 CB GLN A 61 41.544 -12.090 7.481 1.00 26.77 C
+ATOM 1009 CG GLN A 61 40.714 -13.332 7.173 1.00 38.22 C
+ATOM 1010 CD GLN A 61 40.522 -13.564 5.683 1.00 52.12 C
+ATOM 1011 OE1 GLN A 61 41.265 -14.325 5.063 1.00 52.31 O
+ATOM 1012 NE2 GLN A 61 39.518 -12.914 5.103 1.00 38.40 N
+ATOM 1013 H GLN A 61 41.989 -9.478 8.423 1.00 0.00 H
+ATOM 1014 HA GLN A 61 40.612 -10.755 6.095 1.00 0.00 H
+ATOM 1015 1HB GLN A 61 42.471 -12.155 6.912 1.00 0.00 H
+ATOM 1016 2HB GLN A 61 41.807 -12.115 8.538 1.00 0.00 H
+ATOM 1017 1HG GLN A 61 41.218 -14.205 7.587 1.00 0.00 H
+ATOM 1018 2HG GLN A 61 39.729 -13.220 7.626 1.00 0.00 H
+ATOM 1019 1HE2 GLN A 61 39.346 -13.030 4.124 1.00 0.00 H
+ATOM 1020 2HE2 GLN A 61 38.934 -12.309 5.645 1.00 0.00 H
+ATOM 1021 N GLY A 62 38.490 -10.194 7.290 1.00 36.26 N
+ATOM 1022 CA GLY A 62 37.247 -9.883 7.969 1.00 27.36 C
+ATOM 1023 C GLY A 62 37.422 -8.582 8.727 1.00 31.42 C
+ATOM 1024 O GLY A 62 37.249 -7.501 8.164 1.00 39.02 O
+ATOM 1025 H GLY A 62 38.552 -10.060 6.291 1.00 0.00 H
+ATOM 1026 1HA GLY A 62 36.443 -9.804 7.237 1.00 0.00 H
+ATOM 1027 2HA GLY A 62 36.988 -10.697 8.645 1.00 0.00 H
+ATOM 1028 N ASN A 63 37.771 -8.682 10.005 1.00 32.13 N
+ATOM 1029 CA ASN A 63 38.111 -7.499 10.787 1.00 35.60 C
+ATOM 1030 C ASN A 63 39.301 -7.732 11.715 1.00 37.18 C
+ATOM 1031 O ASN A 63 39.503 -6.994 12.680 1.00 37.37 O
+ATOM 1032 CB ASN A 63 36.912 -6.994 11.587 1.00 28.14 C
+ATOM 1033 CG ASN A 63 37.033 -5.525 11.941 1.00 43.99 C
+ATOM 1034 OD1 ASN A 63 37.587 -4.736 11.176 1.00 48.15 O
+ATOM 1035 ND2 ASN A 63 36.552 -5.159 13.119 1.00 37.78 N
+ATOM 1036 H ASN A 63 37.803 -9.590 10.447 1.00 0.00 H
+ATOM 1037 HA ASN A 63 38.420 -6.708 10.102 1.00 0.00 H
+ATOM 1038 1HB ASN A 63 35.999 -7.145 11.009 1.00 0.00 H
+ATOM 1039 2HB ASN A 63 36.818 -7.573 12.506 1.00 0.00 H
+ATOM 1040 1HD2 ASN A 63 36.605 -4.202 13.405 1.00 0.00 H
+ATOM 1041 2HD2 ASN A 63 36.136 -5.839 13.722 1.00 0.00 H
+ATOM 1042 N THR A 64 40.083 -8.764 11.423 1.00 38.72 N
+ATOM 1043 CA THR A 64 41.312 -9.011 12.164 1.00 33.50 C
+ATOM 1044 C THR A 64 42.508 -8.550 11.344 1.00 28.59 C
+ATOM 1045 O THR A 64 42.557 -8.760 10.132 1.00 24.65 O
+ATOM 1046 CB THR A 64 41.477 -10.499 12.521 1.00 33.77 C
+ATOM 1047 OG1 THR A 64 41.154 -11.306 11.382 1.00 37.54 O
+ATOM 1048 CG2 THR A 64 40.562 -10.873 13.678 1.00 38.73 C
+ATOM 1049 H THR A 64 39.825 -9.391 10.675 1.00 0.00 H
+ATOM 1050 HA THR A 64 41.275 -8.444 13.094 1.00 0.00 H
+ATOM 1051 HB THR A 64 42.511 -10.692 12.805 1.00 0.00 H
+ATOM 1052 HG1 THR A 64 40.906 -10.738 10.648 1.00 0.00 H
+ATOM 1053 1HG2 THR A 64 40.692 -11.928 13.918 1.00 0.00 H
+ATOM 1054 2HG2 THR A 64 40.813 -10.269 14.550 1.00 0.00 H
+ATOM 1055 3HG2 THR A 64 39.526 -10.690 13.396 1.00 0.00 H
+ATOM 1056 N PHE A 65 43.467 -7.916 12.007 1.00 23.25 N
+ATOM 1057 CA PHE A 65 44.682 -7.470 11.340 1.00 19.46 C
+ATOM 1058 C PHE A 65 45.874 -8.308 11.781 1.00 17.36 C
+ATOM 1059 O PHE A 65 46.346 -8.194 12.912 1.00 20.60 O
+ATOM 1060 CB PHE A 65 44.931 -5.987 11.615 1.00 14.39 C
+ATOM 1061 CG PHE A 65 44.008 -5.071 10.863 1.00 22.62 C
+ATOM 1062 CD1 PHE A 65 42.778 -4.718 11.393 1.00 25.12 C
+ATOM 1063 CD2 PHE A 65 44.368 -4.569 9.624 1.00 19.52 C
+ATOM 1064 CE1 PHE A 65 41.924 -3.878 10.701 1.00 23.89 C
+ATOM 1065 CE2 PHE A 65 43.520 -3.728 8.928 1.00 24.80 C
+ATOM 1066 CZ PHE A 65 42.297 -3.382 9.467 1.00 22.02 C
+ATOM 1067 H PHE A 65 43.354 -7.738 12.995 1.00 0.00 H
+ATOM 1068 HA PHE A 65 44.558 -7.609 10.265 1.00 0.00 H
+ATOM 1069 1HB PHE A 65 44.814 -5.790 12.680 1.00 0.00 H
+ATOM 1070 2HB PHE A 65 45.956 -5.734 11.346 1.00 0.00 H
+ATOM 1071 HD1 PHE A 65 42.486 -5.110 12.368 1.00 0.00 H
+ATOM 1072 HD2 PHE A 65 45.334 -4.843 9.198 1.00 0.00 H
+ATOM 1073 HE1 PHE A 65 40.959 -3.609 11.130 1.00 0.00 H
+ATOM 1074 HE2 PHE A 65 43.815 -3.338 7.954 1.00 0.00 H
+ATOM 1075 HZ PHE A 65 41.627 -2.720 8.919 1.00 0.00 H
+ATOM 1076 N THR A 66 46.354 -9.151 10.874 1.00 13.66 N
+ATOM 1077 CA THR A 66 47.402 -10.109 11.195 1.00 18.34 C
+ATOM 1078 C THR A 66 48.661 -9.856 10.373 1.00 11.24 C
+ATOM 1079 O THR A 66 48.593 -9.637 9.164 1.00 10.12 O
+ATOM 1080 CB THR A 66 46.925 -11.556 10.953 1.00 22.80 C
+ATOM 1081 OG1 THR A 66 45.654 -11.757 11.584 1.00 16.69 O
+ATOM 1082 CG2 THR A 66 47.929 -12.556 11.510 1.00 20.29 C
+ATOM 1083 H THR A 66 45.981 -9.126 9.936 1.00 0.00 H
+ATOM 1084 HA THR A 66 47.656 -10.003 12.250 1.00 0.00 H
+ATOM 1085 HB THR A 66 46.810 -11.727 9.883 1.00 0.00 H
+ATOM 1086 HG1 THR A 66 45.381 -10.945 12.018 1.00 0.00 H
+ATOM 1087 1HG2 THR A 66 47.572 -13.570 11.328 1.00 0.00 H
+ATOM 1088 2HG2 THR A 66 48.892 -12.416 11.019 1.00 0.00 H
+ATOM 1089 3HG2 THR A 66 48.042 -12.399 12.582 1.00 0.00 H
+ATOM 1090 N VAL A 67 49.808 -9.882 11.042 1.00 11.29 N
+ATOM 1091 CA VAL A 67 51.092 -9.782 10.366 1.00 12.92 C
+ATOM 1092 C VAL A 67 51.310 -11.043 9.538 1.00 11.98 C
+ATOM 1093 O VAL A 67 51.079 -12.149 10.020 1.00 22.19 O
+ATOM 1094 CB VAL A 67 52.240 -9.636 11.382 1.00 20.44 C
+ATOM 1095 CG1 VAL A 67 53.591 -9.709 10.685 1.00 14.64 C
+ATOM 1096 CG2 VAL A 67 52.100 -8.331 12.153 1.00 17.87 C
+ATOM 1097 H VAL A 67 49.787 -9.974 12.048 1.00 0.00 H
+ATOM 1098 HA VAL A 67 51.080 -8.896 9.730 1.00 0.00 H
+ATOM 1099 HB VAL A 67 52.204 -10.473 12.080 1.00 0.00 H
+ATOM 1100 1HG1 VAL A 67 54.387 -9.604 11.422 1.00 0.00 H
+ATOM 1101 2HG1 VAL A 67 53.689 -10.670 10.181 1.00 0.00 H
+ATOM 1102 3HG1 VAL A 67 53.667 -8.905 9.953 1.00 0.00 H
+ATOM 1103 1HG2 VAL A 67 52.917 -8.241 12.868 1.00 0.00 H
+ATOM 1104 2HG2 VAL A 67 52.132 -7.492 11.457 1.00 0.00 H
+ATOM 1105 3HG2 VAL A 67 51.149 -8.324 12.687 1.00 0.00 H
+ATOM 1106 N LYS A 68 51.737 -10.877 8.289 1.00 16.35 N
+ATOM 1107 CA LYS A 68 51.945 -12.018 7.403 1.00 17.71 C
+ATOM 1108 C LYS A 68 53.386 -12.112 6.909 1.00 17.46 C
+ATOM 1109 O LYS A 68 53.889 -13.207 6.658 1.00 20.65 O
+ATOM 1110 CB LYS A 68 50.974 -11.974 6.217 1.00 17.28 C
+ATOM 1111 CG LYS A 68 49.550 -12.391 6.563 1.00 21.56 C
+ATOM 1112 CD LYS A 68 49.418 -13.904 6.689 1.00 22.92 C
+ATOM 1113 CE LYS A 68 49.174 -14.557 5.334 1.00 37.92 C
+ATOM 1114 NZ LYS A 68 49.013 -16.037 5.440 1.00 34.92 N
+ATOM 1115 H LYS A 68 51.922 -9.946 7.944 1.00 0.00 H
+ATOM 1116 HA LYS A 68 51.759 -12.933 7.967 1.00 0.00 H
+ATOM 1117 1HB LYS A 68 50.940 -10.962 5.812 1.00 0.00 H
+ATOM 1118 2HB LYS A 68 51.335 -12.632 5.426 1.00 0.00 H
+ATOM 1119 1HG LYS A 68 49.256 -11.934 7.509 1.00 0.00 H
+ATOM 1120 2HG LYS A 68 48.870 -12.044 5.786 1.00 0.00 H
+ATOM 1121 1HD LYS A 68 50.332 -14.315 7.121 1.00 0.00 H
+ATOM 1122 2HD LYS A 68 48.585 -14.143 7.351 1.00 0.00 H
+ATOM 1123 1HE LYS A 68 48.273 -14.140 4.886 1.00 0.00 H
+ATOM 1124 2HE LYS A 68 50.013 -14.345 4.672 1.00 0.00 H
+ATOM 1125 1HZ LYS A 68 48.854 -16.426 4.521 1.00 0.00 H
+ATOM 1126 2HZ LYS A 68 49.851 -16.440 5.836 1.00 0.00 H
+ATOM 1127 3HZ LYS A 68 48.225 -16.249 6.035 1.00 0.00 H
+ATOM 1128 N ARG A 69 54.051 -10.967 6.784 1.00 20.53 N
+ATOM 1129 CA ARG A 69 55.433 -10.934 6.307 1.00 23.00 C
+ATOM 1130 C ARG A 69 56.251 -9.824 6.972 1.00 17.98 C
+ATOM 1131 O ARG A 69 55.787 -8.692 7.108 1.00 20.35 O
+ATOM 1132 CB ARG A 69 55.480 -10.793 4.781 1.00 27.52 C
+ATOM 1133 CG ARG A 69 55.094 -12.058 4.018 1.00 35.85 C
+ATOM 1134 CD ARG A 69 55.160 -11.850 2.516 1.00 45.34 C
+ATOM 1135 NE ARG A 69 56.502 -11.483 2.076 1.00 47.72 N
+ATOM 1136 CZ ARG A 69 57.380 -12.338 1.559 1.00 63.53 C
+ATOM 1137 NH1 ARG A 69 57.056 -13.615 1.410 1.00 60.29 N
+ATOM 1138 NH2 ARG A 69 58.579 -11.911 1.187 1.00 48.64 N
+ATOM 1139 H ARG A 69 53.592 -10.100 7.024 1.00 0.00 H
+ATOM 1140 HA ARG A 69 55.917 -11.872 6.582 1.00 0.00 H
+ATOM 1141 1HB ARG A 69 54.807 -9.996 4.469 1.00 0.00 H
+ATOM 1142 2HB ARG A 69 56.487 -10.511 4.472 1.00 0.00 H
+ATOM 1143 1HG ARG A 69 55.777 -12.865 4.283 1.00 0.00 H
+ATOM 1144 2HG ARG A 69 54.075 -12.344 4.280 1.00 0.00 H
+ATOM 1145 1HD ARG A 69 54.875 -12.771 2.008 1.00 0.00 H
+ATOM 1146 2HD ARG A 69 54.477 -11.051 2.229 1.00 0.00 H
+ATOM 1147 HE ARG A 69 56.780 -10.515 2.171 1.00 0.00 H
+ATOM 1148 1HH1 ARG A 69 56.141 -13.940 1.689 1.00 0.00 H
+ATOM 1149 2HH1 ARG A 69 57.724 -14.263 1.017 1.00 0.00 H
+ATOM 1150 1HH2 ARG A 69 58.825 -10.937 1.296 1.00 0.00 H
+ATOM 1151 2HH2 ARG A 69 59.246 -12.559 0.795 1.00 0.00 H
+ATOM 1152 N ILE A 70 57.469 -10.163 7.386 1.00 20.30 N
+ATOM 1153 CA ILE A 70 58.381 -9.200 7.999 1.00 22.11 C
+ATOM 1154 C ILE A 70 59.745 -9.234 7.319 1.00 18.50 C
+ATOM 1155 O ILE A 70 60.372 -10.289 7.225 1.00 21.08 O
+ATOM 1156 CB ILE A 70 58.583 -9.490 9.499 1.00 22.15 C
+ATOM 1157 CG1 ILE A 70 57.243 -9.498 10.235 1.00 14.90 C
+ATOM 1158 CG2 ILE A 70 59.528 -8.470 10.118 1.00 25.61 C
+ATOM 1159 CD1 ILE A 70 57.361 -9.836 11.701 1.00 22.34 C
+ATOM 1160 H ILE A 70 57.769 -11.120 7.271 1.00 0.00 H
+ATOM 1161 HA ILE A 70 57.950 -8.205 7.901 1.00 0.00 H
+ATOM 1162 HB ILE A 70 59.008 -10.486 9.623 1.00 0.00 H
+ATOM 1163 1HG1 ILE A 70 56.773 -8.519 10.145 1.00 0.00 H
+ATOM 1164 2HG1 ILE A 70 56.576 -10.224 9.769 1.00 0.00 H
+ATOM 1165 1HG2 ILE A 70 59.658 -8.690 11.177 1.00 0.00 H
+ATOM 1166 2HG2 ILE A 70 60.494 -8.518 9.616 1.00 0.00 H
+ATOM 1167 3HG2 ILE A 70 59.109 -7.470 10.004 1.00 0.00 H
+ATOM 1168 1HD1 ILE A 70 56.371 -9.823 12.158 1.00 0.00 H
+ATOM 1169 2HD1 ILE A 70 57.799 -10.829 11.812 1.00 0.00 H
+ATOM 1170 3HD1 ILE A 70 57.997 -9.102 12.193 1.00 0.00 H
+ATOM 1171 N THR A 71 60.204 -8.079 6.846 1.00 15.96 N
+ATOM 1172 CA THR A 71 61.505 -7.993 6.190 1.00 14.44 C
+ATOM 1173 C THR A 71 62.436 -6.981 6.859 1.00 15.22 C
+ATOM 1174 O THR A 71 62.120 -5.794 6.944 1.00 15.18 O
+ATOM 1175 CB THR A 71 61.359 -7.633 4.699 1.00 13.44 C
+ATOM 1176 OG1 THR A 71 60.557 -8.623 4.041 1.00 20.27 O
+ATOM 1177 CG2 THR A 71 62.722 -7.565 4.028 1.00 23.87 C
+ATOM 1178 H THR A 71 59.645 -7.243 6.941 1.00 0.00 H
+ATOM 1179 HA THR A 71 61.993 -8.966 6.260 1.00 0.00 H
+ATOM 1180 HB THR A 71 60.866 -6.665 4.605 1.00 0.00 H
+ATOM 1181 HG1 THR A 71 60.289 -9.291 4.677 1.00 0.00 H
+ATOM 1182 1HG2 THR A 71 62.597 -7.309 2.976 1.00 0.00 H
+ATOM 1183 2HG2 THR A 71 63.331 -6.805 4.517 1.00 0.00 H
+ATOM 1184 3HG2 THR A 71 63.216 -8.532 4.109 1.00 0.00 H
+ATOM 1185 N GLU A 72 63.581 -7.462 7.335 1.00 16.84 N
+ATOM 1186 CA GLU A 72 64.570 -6.607 7.990 1.00 11.58 C
+ATOM 1187 C GLU A 72 65.895 -6.547 7.238 1.00 13.92 C
+ATOM 1188 O GLU A 72 66.375 -7.547 6.715 1.00 15.38 O
+ATOM 1189 CB GLU A 72 64.813 -7.032 9.441 1.00 14.54 C
+ATOM 1190 CG GLU A 72 63.752 -6.560 10.414 1.00 28.90 C
+ATOM 1191 CD GLU A 72 64.075 -6.926 11.849 1.00 38.78 C
+ATOM 1192 OE1 GLU A 72 63.256 -7.618 12.489 1.00 44.82 O
+ATOM 1193 OE2 GLU A 72 65.141 -6.501 12.345 1.00 36.73 O
+ATOM 1194 H GLU A 72 63.771 -8.449 7.240 1.00 0.00 H
+ATOM 1195 HA GLU A 72 64.193 -5.584 7.996 1.00 0.00 H
+ATOM 1196 1HB GLU A 72 64.861 -8.120 9.498 1.00 0.00 H
+ATOM 1197 2HB GLU A 72 65.774 -6.643 9.778 1.00 0.00 H
+ATOM 1198 1HG GLU A 72 63.658 -5.477 10.336 1.00 0.00 H
+ATOM 1199 2HG GLU A 72 62.796 -7.001 10.135 1.00 0.00 H
+ATOM 1200 N THR A 73 66.480 -5.353 7.193 1.00 10.37 N
+ATOM 1201 CA THR A 73 67.791 -5.145 6.595 1.00 20.91 C
+ATOM 1202 C THR A 73 68.641 -4.281 7.518 1.00 20.77 C
+ATOM 1203 O THR A 73 68.247 -3.171 7.877 1.00 25.10 O
+ATOM 1204 CB THR A 73 67.693 -4.472 5.217 1.00 20.08 C
+ATOM 1205 OG1 THR A 73 66.934 -3.261 5.328 1.00 21.20 O
+ATOM 1206 CG2 THR A 73 67.020 -5.396 4.220 1.00 21.01 C
+ATOM 1207 H THR A 73 65.990 -4.565 7.591 1.00 0.00 H
+ATOM 1208 HA THR A 73 68.268 -6.116 6.461 1.00 0.00 H
+ATOM 1209 HB THR A 73 68.693 -4.228 4.860 1.00 0.00 H
+ATOM 1210 HG1 THR A 73 66.656 -3.141 6.239 1.00 0.00 H
+ATOM 1211 1HG2 THR A 73 66.960 -4.903 3.250 1.00 0.00 H
+ATOM 1212 2HG2 THR A 73 67.600 -6.314 4.125 1.00 0.00 H
+ATOM 1213 3HG2 THR A 73 66.016 -5.636 4.567 1.00 0.00 H
+ATOM 1214 N VAL A 74 69.806 -4.793 7.897 1.00 15.84 N
+ATOM 1215 CA VAL A 74 70.675 -4.090 8.830 1.00 22.49 C
+ATOM 1216 C VAL A 74 71.848 -3.452 8.100 1.00 23.90 C
+ATOM 1217 O VAL A 74 72.530 -4.104 7.311 1.00 31.44 O
+ATOM 1218 CB VAL A 74 71.240 -5.060 9.884 1.00 27.14 C
+ATOM 1219 CG1 VAL A 74 71.937 -4.293 10.998 1.00 29.33 C
+ATOM 1220 CG2 VAL A 74 70.134 -5.946 10.441 1.00 14.18 C
+ATOM 1221 H VAL A 74 70.098 -5.688 7.532 1.00 0.00 H
+ATOM 1222 HA VAL A 74 70.088 -3.326 9.341 1.00 0.00 H
+ATOM 1223 HB VAL A 74 72.001 -5.686 9.417 1.00 0.00 H
+ATOM 1224 1HG1 VAL A 74 72.330 -4.996 11.733 1.00 0.00 H
+ATOM 1225 2HG1 VAL A 74 72.757 -3.710 10.580 1.00 0.00 H
+ATOM 1226 3HG1 VAL A 74 71.224 -3.625 11.481 1.00 0.00 H
+ATOM 1227 1HG2 VAL A 74 70.551 -6.625 11.184 1.00 0.00 H
+ATOM 1228 2HG2 VAL A 74 69.369 -5.324 10.907 1.00 0.00 H
+ATOM 1229 3HG2 VAL A 74 69.688 -6.524 9.631 1.00 0.00 H
+ATOM 1230 N GLY A 75 72.077 -2.171 8.371 1.00 20.41 N
+ATOM 1231 CA GLY A 75 73.150 -1.435 7.728 1.00 27.86 C
+ATOM 1232 C GLY A 75 74.060 -0.737 8.719 1.00 30.80 C
+ATOM 1233 O GLY A 75 74.010 -1.014 9.919 1.00 28.94 O
+ATOM 1234 H GLY A 75 71.489 -1.698 9.042 1.00 0.00 H
+ATOM 1235 1HA GLY A 75 73.746 -2.117 7.121 1.00 0.00 H
+ATOM 1236 2HA GLY A 75 72.727 -0.691 7.053 1.00 0.00 H
+ATOM 1237 N SER A 76 74.886 0.173 8.208 1.00 47.05 N
+ATOM 1238 CA SER A 76 75.843 0.925 9.019 1.00 33.33 C
+ATOM 1239 C SER A 76 76.791 0.013 9.795 1.00 30.64 C
+ATOM 1240 O SER A 76 77.934 0.378 10.068 1.00 38.97 O
+ATOM 1241 OXT SER A 76 76.424 -1.074 10.146 1.00 0.00 O
+ATOM 1242 CB SER A 76 75.122 1.889 9.967 1.00 35.98 C
+ATOM 1243 OG SER A 76 74.400 2.869 9.243 1.00 45.01 O
+ATOM 1244 H SER A 76 74.842 0.345 7.214 1.00 0.00 H
+ATOM 1245 HA SER A 76 76.478 1.509 8.352 1.00 0.00 H
+ATOM 1246 1HB SER A 76 74.439 1.329 10.605 1.00 0.00 H
+ATOM 1247 2HB SER A 76 75.851 2.375 10.614 1.00 0.00 H
+ATOM 1248 HG SER A 76 74.549 2.676 8.314 1.00 0.00 H
+TER
+HETATM 1250 O HOH A 101 63.172 -9.648 11.869 1.00 27.64 O
+HETATM 1251 H1 HOH A 101 62.242 -9.497 11.698 1.00 0.00 H
+HETATM 1252 H2 HOH A 101 63.189 -10.406 12.454 1.00 0.00 H
+HETATM 1253 O HOH A 102 49.629 6.656 4.374 1.00 19.14 O
+HETATM 1254 H1 HOH A 102 48.681 6.546 4.297 1.00 0.00 H
+HETATM 1255 H2 HOH A 102 49.863 6.172 5.166 1.00 0.00 H
+HETATM 1256 O HOH A 103 57.871 -7.566 4.630 1.00 33.79 O
+HETATM 1257 H1 HOH A 103 56.925 -7.439 4.560 1.00 0.00 H
+HETATM 1258 H2 HOH A 103 58.228 -6.680 4.687 1.00 0.00 H
+HETATM 1259 O HOH A 104 43.751 8.160 5.903 1.00 17.10 O
+HETATM 1260 H1 HOH A 104 42.815 7.997 5.790 1.00 0.00 H
+HETATM 1261 H2 HOH A 104 44.170 7.337 5.652 1.00 0.00 H
+HETATM 1262 O HOH A 105 65.164 9.857 5.856 1.00 24.83 O
+HETATM 1263 H1 HOH A 105 64.220 9.724 5.774 1.00 0.00 H
+HETATM 1264 H2 HOH A 105 65.327 10.697 5.426 1.00 0.00 H
+HETATM 1265 O HOH A 106 54.964 7.696 12.322 1.00 17.84 O
+HETATM 1266 H1 HOH A 106 54.036 7.576 12.120 1.00 0.00 H
+HETATM 1267 H2 HOH A 106 55.325 6.809 12.327 1.00 0.00 H
+HETATM 1268 O HOH A 107 62.319 -7.792 14.569 1.00 25.33 O
+HETATM 1269 H1 HOH A 107 61.393 -7.665 14.364 1.00 0.00 H
+HETATM 1270 H2 HOH A 107 62.782 -7.490 13.787 1.00 0.00 H
+HETATM 1271 O HOH A 108 67.438 11.536 5.370 1.00 30.42 O
+HETATM 1272 H1 HOH A 108 66.496 11.384 5.300 1.00 0.00 H
+HETATM 1273 H2 HOH A 108 67.782 10.734 5.764 1.00 0.00 H
+HETATM 1274 O HOH A 109 62.034 -10.091 22.539 1.00 31.50 O
+HETATM 1275 H1 HOH A 109 61.144 -9.936 22.222 1.00 0.00 H
+HETATM 1276 H2 HOH A 109 62.599 -9.742 21.850 1.00 0.00 H
+HETATM 1277 O HOH A 110 43.686 -11.275 9.918 1.00 16.13 O
+HETATM 1278 H1 HOH A 110 42.784 -11.020 9.726 1.00 0.00 H
+HETATM 1279 H2 HOH A 110 43.690 -12.228 9.827 1.00 0.00 H
+HETATM 1280 O HOH A 111 79.316 2.375 10.586 1.00 32.69 O
+HETATM 1281 H1 HOH A 111 78.367 2.358 10.460 1.00 0.00 H
+HETATM 1282 H2 HOH A 111 79.573 1.453 10.600 1.00 0.00 H
+HETATM 1283 O HOH A 112 69.122 -1.587 5.325 1.00 29.41 O
+HETATM 1284 H1 HOH A 112 68.167 -1.555 5.261 1.00 0.00 H
+HETATM 1285 H2 HOH A 112 69.309 -2.451 5.692 1.00 0.00 H
+HETATM 1286 O HOH A 113 69.294 -0.804 14.778 1.00 31.64 O
+HETATM 1287 H1 HOH A 113 68.357 -0.792 14.581 1.00 0.00 H
+HETATM 1288 H2 HOH A 113 69.340 -0.740 15.732 1.00 0.00 H
+HETATM 1289 O HOH A 114 37.421 -8.053 1.040 1.00 29.02 O
+HETATM 1290 H1 HOH A 114 36.489 -7.834 1.020 1.00 0.00 H
+HETATM 1291 H2 HOH A 114 37.493 -8.842 0.503 1.00 0.00 H
+HETATM 1292 O HOH A 115 44.473 1.897 -0.750 1.00 31.31 O
+HETATM 1293 H1 HOH A 115 43.517 1.876 -0.719 1.00 0.00 H
+HETATM 1294 H2 HOH A 115 44.686 1.769 -1.675 1.00 0.00 H
+HETATM 1295 O HOH A 116 64.822 1.015 24.630 1.00 48.44 O
+HETATM 1296 H1 HOH A 116 63.927 1.014 24.290 1.00 0.00 H
+HETATM 1297 H2 HOH A 116 64.959 0.123 24.949 1.00 0.00 H
+HETATM 1298 O HOH A 117 42.145 -10.736 2.186 1.00 35.67 O
+HETATM 1299 H1 HOH A 117 41.225 -10.474 2.158 1.00 0.00 H
+HETATM 1300 H2 HOH A 117 42.126 -11.689 2.095 1.00 0.00 H
+HETATM 1301 O HOH A 118 47.161 8.235 7.428 1.00 22.07 O
+HETATM 1302 H1 HOH A 118 46.227 8.080 7.284 1.00 0.00 H
+HETATM 1303 H2 HOH A 118 47.258 8.250 8.380 1.00 0.00 H
+HETATM 1304 O HOH A 119 44.525 -0.452 18.395 1.00 27.42 O
+HETATM 1305 H1 HOH A 119 43.638 -0.440 18.035 1.00 0.00 H
+HETATM 1306 H2 HOH A 119 44.858 0.433 18.243 1.00 0.00 H
+HETATM 1307 O HOH A 120 54.654 0.420 0.794 1.00 30.19 O
+HETATM 1308 H1 HOH A 120 53.697 0.430 0.784 1.00 0.00 H
+HETATM 1309 H2 HOH A 120 54.881 -0.433 1.165 1.00 0.00 H
+HETATM 1310 O HOH A 121 40.108 -10.759 0.811 1.00 31.06 O
+HETATM 1311 H1 HOH A 121 39.188 -10.495 0.799 1.00 0.00 H
+HETATM 1312 H2 HOH A 121 40.131 -11.522 1.389 1.00 0.00 H
+HETATM 1313 O HOH A 122 46.365 -2.437 17.312 1.00 24.67 O
+HETATM 1314 H1 HOH A 122 45.465 -2.370 16.993 1.00 0.00 H
+HETATM 1315 H2 HOH A 122 46.554 -3.375 17.304 1.00 0.00 H
+HETATM 1316 O HOH A 123 48.069 -3.244 18.867 1.00 15.04 O
+HETATM 1317 H1 HOH A 123 47.180 -3.168 18.519 1.00 0.00 H
+HETATM 1318 H2 HOH A 123 47.996 -3.883 19.576 1.00 0.00 H
+HETATM 1319 O HOH A 124 74.193 -6.324 12.360 1.00 29.12 O
+HETATM 1320 H1 HOH A 124 73.252 -6.235 12.209 1.00 0.00 H
+HETATM 1321 H2 HOH A 124 74.419 -7.172 11.977 1.00 0.00 H
+HETATM 1322 O HOH A 125 60.879 -0.983 23.624 1.00 36.69 O
+HETATM 1323 H1 HOH A 125 59.984 -0.960 23.286 1.00 0.00 H
+HETATM 1324 H2 HOH A 125 61.419 -0.675 22.896 1.00 0.00 H
+HETATM 1325 O HOH A 126 71.228 4.047 6.104 1.00 42.26 O
+HETATM 1326 H1 HOH A 126 70.275 3.992 6.032 1.00 0.00 H
+HETATM 1327 H2 HOH A 126 71.453 4.878 5.686 1.00 0.00 H
+HETATM 1328 O HOH A 127 56.139 -0.923 0.000 1.00 28.24 O
+HETATM 1329 H1 HOH A 127 55.182 -0.893 0.016 1.00 0.00 H
+HETATM 1330 H2 HOH A 127 56.359 -1.069 -0.920 1.00 0.00 H
+HETATM 1331 O HOH A 128 62.119 -1.035 5.248 1.00 31.35 O
+HETATM 1332 H1 HOH A 128 61.164 -1.013 5.180 1.00 0.00 H
+HETATM 1333 H2 HOH A 128 62.419 -1.216 4.357 1.00 0.00 H
+HETATM 1334 O HOH A 129 47.519 9.598 9.403 1.00 22.17 O
+HETATM 1335 H1 HOH A 129 46.596 9.420 9.222 1.00 0.00 H
+HETATM 1336 H2 HOH A 129 47.620 9.418 10.338 1.00 0.00 H
+HETATM 1337 O HOH A 130 69.294 -4.444 22.649 1.00 37.92 O
+HETATM 1338 H1 HOH A 130 68.385 -4.379 22.355 1.00 0.00 H
+HETATM 1339 H2 HOH A 130 69.231 -4.661 23.579 1.00 0.00 H
+HETATM 1340 O HOH A 131 52.488 5.019 19.053 1.00 36.82 O
+HETATM 1341 H1 HOH A 131 51.592 4.947 18.725 1.00 0.00 H
+HETATM 1342 H2 HOH A 131 52.576 4.294 19.672 1.00 0.00 H
+HETATM 1343 O HOH A 132 58.916 -10.216 23.402 1.00 29.78 O
+HETATM 1344 H1 HOH A 132 58.040 -10.048 23.055 1.00 0.00 H
+HETATM 1345 H2 HOH A 132 59.004 -11.169 23.381 1.00 0.00 H
+HETATM 1346 O HOH A 133 56.139 -9.900 0.000 1.00 46.44 O
+HETATM 1347 H1 HOH A 133 55.199 -9.719 0.001 1.00 0.00 H
+HETATM 1348 H2 HOH A 133 56.314 -10.265 0.867 1.00 0.00 H
+HETATM 1349 O HOH A 134 68.589 0.211 24.439 1.00 31.83 O
+HETATM 1350 H1 HOH A 134 67.686 0.220 24.122 1.00 0.00 H
+HETATM 1351 H2 HOH A 134 68.525 -0.108 25.339 1.00 0.00 H
+TER
diff --git a/7_Simple_Metrics/data/6wvz.pdb b/7_Simple_Metrics/data/6wvz.pdb
index 4c5e236..d6f2220 100644
--- a/7_Simple_Metrics/data/6wvz.pdb
+++ b/7_Simple_Metrics/data/6wvz.pdb
@@ -1,15449 +1,15430 @@
-HEADER TRANSFERASE/IMMUNE SYSTEM 07-MAY-20 6WVZ
-TITLE CRYSTAL STRUCTURE OF ANTI-MET FAB ARM OF AMIVANTAMAB IN COMPLEX WITH
-TITLE 2 HUMAN MET
-COMPND MOL_ID: 1;
-COMPND 2 MOLECULE: HEAVY CHAIN OF ANTI-MET FAB OF AMIVANTAMAB;
-COMPND 3 CHAIN: H;
-COMPND 4 ENGINEERED: YES;
-COMPND 5 MOL_ID: 2;
-COMPND 6 MOLECULE: LIGHT CHAIN OF ANTI-MET FAB OF AMIVANTAMAB;
-COMPND 7 CHAIN: L;
-COMPND 8 ENGINEERED: YES;
-COMPND 9 MOL_ID: 3;
-COMPND 10 MOLECULE: HEPATOCYTE GROWTH FACTOR RECEPTOR;
-COMPND 11 CHAIN: M;
-COMPND 12 SYNONYM: HGF RECEPTOR,HGF/SF RECEPTOR,PROTO-ONCOGENE C-MET,SCATTER
-COMPND 13 FACTOR RECEPTOR,SF RECEPTOR,TYROSINE-PROTEIN KINASE MET;
-COMPND 14 EC: 2.7.10.1;
-COMPND 15 ENGINEERED: YES
-SOURCE MOL_ID: 1;
-SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
-SOURCE 3 ORGANISM_TAXID: 9606;
-SOURCE 4 EXPRESSION_SYSTEM: HOMO SAPIENS;
-SOURCE 5 EXPRESSION_SYSTEM_TAXID: 9606;
-SOURCE 6 EXPRESSION_SYSTEM_CELL_LINE: HEK293;
-SOURCE 7 EXPRESSION_SYSTEM_ORGAN: KIDNEY;
-SOURCE 8 MOL_ID: 2;
-SOURCE 9 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
-SOURCE 10 ORGANISM_TAXID: 9606;
-SOURCE 11 EXPRESSION_SYSTEM: HOMO SAPIENS;
-SOURCE 12 EXPRESSION_SYSTEM_TAXID: 9606;
-SOURCE 13 EXPRESSION_SYSTEM_CELL_LINE: HEK293;
-SOURCE 14 EXPRESSION_SYSTEM_ORGAN: KIDNEY;
-SOURCE 15 MOL_ID: 3;
-SOURCE 16 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
-SOURCE 17 ORGANISM_COMMON: HUMAN;
-SOURCE 18 ORGANISM_TAXID: 9606;
-SOURCE 19 GENE: MET;
-SOURCE 20 EXPRESSION_SYSTEM: TRICHOPLUSIA NI;
-SOURCE 21 EXPRESSION_SYSTEM_TAXID: 7111;
-SOURCE 22 EXPRESSION_SYSTEM_CELL_LINE: TNI PRO;
-SOURCE 23 EXPRESSION_SYSTEM_ORGAN: OVARY
-KEYWDS ANTIGEN-FAB COMPLEX, SEMAPHORIN DOMAIN, PLEXIN SEMAPHORIN INTEGRIN
-KEYWDS 2 CYSTEINE-RICH DOMAIN, ANTITUMOR PROTEIN, TRANSFERASE-IMMUNE SYSTEM
-KEYWDS 3 COMPLEX
-EXPDTA X-RAY DIFFRACTION
-AUTHOR R.M.F.CARDOSO
-REVDAT 1 28-APR-21 6WVZ 0
-JRNL AUTH J.NEIJSSEN,R.M.F.CARDOSO,K.M.CHEVALIER,L.WIEGMAN,T.VALERIUS,
-JRNL AUTH 2 G.M.ANDERSON,S.L.MOORES,J.SCHUURMAN,P.W.H.I.PARREN,
-JRNL AUTH 3 W.R.STROHL,M.L.CHIU
-JRNL TITL DISCOVERY OF AMIVANTAMAB (JNJ-61186372), A BISPECIFIC
-JRNL TITL 2 ANTIBODY TARGETING EGFR AND MET.
-JRNL REF J.BIOL.CHEM. 00641 2021
-JRNL REFN ESSN 1083-351X
-JRNL PMID 33839159
-JRNL DOI 10.1016/J.JBC.2021.100641
-REMARK 2
-REMARK 2 RESOLUTION. 3.10 ANGSTROMS.
-REMARK 3
-REMARK 3 REFINEMENT.
-REMARK 3 PROGRAM : PHENIX 1.10_2155
-REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN
-REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE,
-REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER,
-REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY,
-REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON,
-REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI,
-REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT
-REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART
-REMARK 3
-REMARK 3 REFINEMENT TARGET : NULL
-REMARK 3
-REMARK 3 DATA USED IN REFINEMENT.
-REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 3.10
-REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 40.45
-REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.390
-REMARK 3 COMPLETENESS FOR RANGE (%) : 94.9
-REMARK 3 NUMBER OF REFLECTIONS : 31392
-REMARK 3
-REMARK 3 FIT TO DATA USED IN REFINEMENT.
-REMARK 3 R VALUE (WORKING + TEST SET) : 0.192
-REMARK 3 R VALUE (WORKING SET) : 0.190
-REMARK 3 FREE R VALUE : 0.235
-REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.070
-REMARK 3 FREE R VALUE TEST SET COUNT : 1592
-REMARK 3
-REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS).
-REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE
-REMARK 3 1 3.2007 - 3.1006 0.97 0 166 0.3056 0.3869
-REMARK 3
-REMARK 3 BULK SOLVENT MODELLING.
-REMARK 3 METHOD USED : NULL
-REMARK 3 SOLVENT RADIUS : 1.11
-REMARK 3 SHRINKAGE RADIUS : 0.90
-REMARK 3 K_SOL : NULL
-REMARK 3 B_SOL : NULL
-REMARK 3
-REMARK 3 ERROR ESTIMATES.
-REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.380
-REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 23.040
-REMARK 3
-REMARK 3 B VALUES.
-REMARK 3 FROM WILSON PLOT (A**2) : NULL
-REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL
-REMARK 3 OVERALL ANISOTROPIC B VALUE.
-REMARK 3 B11 (A**2) : NULL
-REMARK 3 B22 (A**2) : NULL
-REMARK 3 B33 (A**2) : NULL
-REMARK 3 B12 (A**2) : NULL
-REMARK 3 B13 (A**2) : NULL
-REMARK 3 B23 (A**2) : NULL
-REMARK 3
-REMARK 3 TWINNING INFORMATION.
-REMARK 3 FRACTION: NULL
-REMARK 3 OPERATOR: NULL
-REMARK 3
-REMARK 3 DEVIATIONS FROM IDEAL VALUES.
-REMARK 3 RMSD COUNT
-REMARK 3 BOND : 0.003 7410
-REMARK 3 ANGLE : 0.875 10151
-REMARK 3 CHIRALITY : 0.057 1193
-REMARK 3 PLANARITY : 0.004 1293
-REMARK 3 DIHEDRAL : 10.041 4365
-REMARK 3
-REMARK 3 TLS DETAILS
-REMARK 3 NUMBER OF TLS GROUPS : 15
-REMARK 3 TLS GROUP : 1
-REMARK 3 SELECTION: CHAIN 'H' AND (RESID 1 THROUGH 32 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -14.2907 -1.4111 -86.3356
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.3225 T22: 0.7425
-REMARK 3 T33: 0.5629 T12: 0.0900
-REMARK 3 T13: -0.1791 T23: -0.1548
-REMARK 3 L TENSOR
-REMARK 3 L11: 4.9680 L22: 3.5697
-REMARK 3 L33: 1.2452 L12: -3.5121
-REMARK 3 L13: -1.7749 L23: 0.1140
-REMARK 3 S TENSOR
-REMARK 3 S11: 0.2439 S12: -0.6169 S13: 0.5059
-REMARK 3 S21: -1.0763 S22: 0.0914 S23: -0.5872
-REMARK 3 S31: -1.3209 S32: 0.4054 S33: -0.3171
-REMARK 3 TLS GROUP : 2
-REMARK 3 SELECTION: CHAIN 'H' AND (RESID 33 THROUGH 64 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -25.3642 -4.0153 -90.8513
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.3357 T22: 0.5547
-REMARK 3 T33: 0.5187 T12: 0.2607
-REMARK 3 T13: -0.1692 T23: -0.0085
-REMARK 3 L TENSOR
-REMARK 3 L11: 5.0047 L22: 5.4653
-REMARK 3 L33: 4.1220 L12: 1.8575
-REMARK 3 L13: 1.9185 L23: -0.1942
-REMARK 3 S TENSOR
-REMARK 3 S11: 0.1669 S12: 0.1438 S13: 0.5239
-REMARK 3 S21: -0.2954 S22: -0.0285 S23: 0.3312
-REMARK 3 S31: -1.8459 S32: -0.5318 S33: -0.0865
-REMARK 3 TLS GROUP : 3
-REMARK 3 SELECTION: CHAIN 'H' AND (RESID 65 THROUGH 91 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -22.4637 4.1711 -87.8574
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.6255 T22: 0.5939
-REMARK 3 T33: 0.5910 T12: 0.1396
-REMARK 3 T13: -0.1839 T23: -0.0319
-REMARK 3 L TENSOR
-REMARK 3 L11: 3.8672 L22: 2.5662
-REMARK 3 L33: 8.5155 L12: -0.8241
-REMARK 3 L13: -1.2941 L23: 0.7836
-REMARK 3 S TENSOR
-REMARK 3 S11: -0.1040 S12: -0.3388 S13: 0.7091
-REMARK 3 S21: -0.0408 S22: 0.0219 S23: -0.0528
-REMARK 3 S31: -1.6841 S32: -0.0849 S33: -0.0327
-REMARK 3 TLS GROUP : 4
-REMARK 3 SELECTION: CHAIN 'H' AND (RESID 92 THROUGH 125 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -20.2546 -5.3535 -82.9547
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.1102 T22: 0.4900
-REMARK 3 T33: 0.5040 T12: -0.0142
-REMARK 3 T13: -0.1508 T23: -0.0257
-REMARK 3 L TENSOR
-REMARK 3 L11: 1.4318 L22: 3.5776
-REMARK 3 L33: 7.4208 L12: 0.2171
-REMARK 3 L13: 1.3331 L23: 2.4338
-REMARK 3 S TENSOR
-REMARK 3 S11: 0.0512 S12: 0.1970 S13: -0.1248
-REMARK 3 S21: -0.4785 S22: -0.0635 S23: -0.1208
-REMARK 3 S31: -0.8203 S32: -0.1432 S33: -0.0760
-REMARK 3 TLS GROUP : 5
-REMARK 3 SELECTION: CHAIN 'H' AND (RESID 126 THROUGH 209 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -20.6451 -7.2042 -53.7263
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.0826 T22: 0.5992
-REMARK 3 T33: 0.5379 T12: -0.0193
-REMARK 3 T13: -0.1441 T23: -0.0752
-REMARK 3 L TENSOR
-REMARK 3 L11: 2.5636 L22: 9.5901
-REMARK 3 L33: 6.4452 L12: -1.2823
-REMARK 3 L13: 1.9546 L23: -2.6558
-REMARK 3 S TENSOR
-REMARK 3 S11: 0.5252 S12: 0.0724 S13: -0.2379
-REMARK 3 S21: -0.8082 S22: -0.6215 S23: 0.1104
-REMARK 3 S31: 0.7699 S32: -0.1009 S33: 0.0794
-REMARK 3 TLS GROUP : 6
-REMARK 3 SELECTION: CHAIN 'H' AND (RESID 210 THROUGH 222 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -17.9031 -2.8787 -45.4249
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.3430 T22: 0.7640
-REMARK 3 T33: 0.5441 T12: -0.2352
-REMARK 3 T13: -0.1037 T23: -0.0441
-REMARK 3 L TENSOR
-REMARK 3 L11: 8.6577 L22: 2.9283
-REMARK 3 L33: 3.5155 L12: -3.2934
-REMARK 3 L13: 4.4398 L23: -0.8929
-REMARK 3 S TENSOR
-REMARK 3 S11: 1.3394 S12: -0.8192 S13: 0.2415
-REMARK 3 S21: 1.0609 S22: -1.1765 S23: 0.9353
-REMARK 3 S31: -1.2578 S32: 1.1017 S33: -0.0838
-REMARK 3 TLS GROUP : 7
-REMARK 3 SELECTION: CHAIN 'L' AND (RESID 1 THROUGH 75 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -27.7921 -24.2265 -86.7492
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.1384 T22: 0.5598
-REMARK 3 T33: 0.5756 T12: 0.2101
-REMARK 3 T13: -0.2262 T23: -0.1484
-REMARK 3 L TENSOR
-REMARK 3 L11: 4.2858 L22: 2.9905
-REMARK 3 L33: 3.9405 L12: 0.4966
-REMARK 3 L13: 0.1081 L23: -2.3888
-REMARK 3 S TENSOR
-REMARK 3 S11: 0.0953 S12: -0.1649 S13: -0.3890
-REMARK 3 S21: 0.3056 S22: -0.2683 S23: 0.1524
-REMARK 3 S31: 0.6598 S32: -0.3206 S33: 0.2131
-REMARK 3 TLS GROUP : 8
-REMARK 3 SELECTION: CHAIN 'L' AND (RESID 76 THROUGH 113 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -28.1189 -22.3225 -78.7048
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.1565 T22: 0.5583
-REMARK 3 T33: 0.5178 T12: 0.0707
-REMARK 3 T13: -0.1926 T23: -0.1326
-REMARK 3 L TENSOR
-REMARK 3 L11: 1.7673 L22: 3.1164
-REMARK 3 L33: 7.1348 L12: 1.8384
-REMARK 3 L13: -1.3638 L23: -2.5372
-REMARK 3 S TENSOR
-REMARK 3 S11: 0.3147 S12: -0.2899 S13: -0.0016
-REMARK 3 S21: 0.3761 S22: -0.3679 S23: 0.2302
-REMARK 3 S31: -0.0615 S32: -0.1000 S33: 0.0624
-REMARK 3 TLS GROUP : 9
-REMARK 3 SELECTION: CHAIN 'L' AND (RESID 114 THROUGH 160 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -35.5842 -10.1616 -51.3035
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.0124 T22: 1.1638
-REMARK 3 T33: 0.7572 T12: -0.1829
-REMARK 3 T13: -0.1352 T23: -0.2507
-REMARK 3 L TENSOR
-REMARK 3 L11: 7.2556 L22: 3.9412
-REMARK 3 L33: 5.4855 L12: -3.9292
-REMARK 3 L13: -1.5353 L23: 4.2522
-REMARK 3 S TENSOR
-REMARK 3 S11: 0.3985 S12: -0.3890 S13: -0.0183
-REMARK 3 S21: -0.1585 S22: -0.4104 S23: 0.7787
-REMARK 3 S31: 0.3835 S32: -0.9445 S33: 0.0699
-REMARK 3 TLS GROUP : 10
-REMARK 3 SELECTION: CHAIN 'L' AND (RESID 161 THROUGH 213 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -35.7026 -13.4123 -51.3368
-REMARK 3 T TENSOR
-REMARK 3 T11: 1.0286 T22: 1.2707
-REMARK 3 T33: 0.8132 T12: -0.1916
-REMARK 3 T13: -0.1306 T23: -0.2200
-REMARK 3 L TENSOR
-REMARK 3 L11: 2.8625 L22: 8.0733
-REMARK 3 L33: 8.5801 L12: -0.6503
-REMARK 3 L13: -1.7213 L23: 3.7384
-REMARK 3 S TENSOR
-REMARK 3 S11: 0.0789 S12: -0.5171 S13: -0.0253
-REMARK 3 S21: 0.4281 S22: -0.7396 S23: 1.3060
-REMARK 3 S31: 0.3401 S32: -0.7310 S33: 0.6542
-REMARK 3 TLS GROUP : 11
-REMARK 3 SELECTION: CHAIN 'M' AND (RESID 40 THROUGH 176 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -31.3356 -25.3964-116.1778
-REMARK 3 T TENSOR
-REMARK 3 T11: 0.9077 T22: 0.8623
-REMARK 3 T33: 0.6899 T12: 0.3970
-REMARK 3 T13: -0.0497 T23: -0.1805
-REMARK 3 L TENSOR
-REMARK 3 L11: 0.8324 L22: 3.2130
-REMARK 3 L33: 7.6867 L12: 0.9427
-REMARK 3 L13: 1.8082 L23: 1.8981
-REMARK 3 S TENSOR
-REMARK 3 S11: -0.1668 S12: -0.0891 S13: 0.0527
-REMARK 3 S21: 0.1170 S22: -0.0747 S23: 0.1999
-REMARK 3 S31: -0.8874 S32: -0.5352 S33: 0.2455
-REMARK 3 TLS GROUP : 12
-REMARK 3 SELECTION: CHAIN 'M' AND (RESID 177 THROUGH 233 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -15.8427 -30.8207-112.1570
-REMARK 3 T TENSOR
-REMARK 3 T11: 0.9915 T22: 0.6879
-REMARK 3 T33: 0.5109 T12: 0.1780
-REMARK 3 T13: -0.0201 T23: -0.1914
-REMARK 3 L TENSOR
-REMARK 3 L11: 5.9401 L22: 1.3054
-REMARK 3 L33: 9.0504 L12: -0.6018
-REMARK 3 L13: -0.3642 L23: -1.4029
-REMARK 3 S TENSOR
-REMARK 3 S11: 0.0519 S12: -0.2881 S13: -0.2110
-REMARK 3 S21: 0.9026 S22: 0.2430 S23: -0.0151
-REMARK 3 S31: -0.6096 S32: 0.9698 S33: -0.2428
-REMARK 3 TLS GROUP : 13
-REMARK 3 SELECTION: CHAIN 'M' AND (RESID 234 THROUGH 376 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -9.9911 -40.4334-130.1734
-REMARK 3 T TENSOR
-REMARK 3 T11: 0.4144 T22: 0.9531
-REMARK 3 T33: 0.5799 T12: 0.0873
-REMARK 3 T13: -0.0180 T23: -0.2515
-REMARK 3 L TENSOR
-REMARK 3 L11: 2.4946 L22: 5.9537
-REMARK 3 L33: 6.5231 L12: 0.7209
-REMARK 3 L13: 1.9732 L23: 0.7829
-REMARK 3 S TENSOR
-REMARK 3 S11: -0.0496 S12: 0.3604 S13: -0.0330
-REMARK 3 S21: 0.2296 S22: 0.3942 S23: -0.4632
-REMARK 3 S31: -0.1948 S32: 1.0863 S33: -0.2965
-REMARK 3 TLS GROUP : 14
-REMARK 3 SELECTION: CHAIN 'M' AND (RESID 377 THROUGH 480 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -10.8105 -42.2672-132.3379
-REMARK 3 T TENSOR
-REMARK 3 T11: 0.6187 T22: 0.9578
-REMARK 3 T33: 0.6514 T12: 0.0975
-REMARK 3 T13: 0.0128 T23: -0.2971
-REMARK 3 L TENSOR
-REMARK 3 L11: 3.6228 L22: 3.6197
-REMARK 3 L33: 5.6765 L12: -0.7159
-REMARK 3 L13: 1.8929 L23: 0.0339
-REMARK 3 S TENSOR
-REMARK 3 S11: -0.1651 S12: 0.2347 S13: -0.1392
-REMARK 3 S21: 0.0289 S22: 0.2208 S23: -0.6121
-REMARK 3 S31: -0.2045 S32: 1.0519 S33: -0.0250
-REMARK 3 TLS GROUP : 15
-REMARK 3 SELECTION: CHAIN 'M' AND (RESID 481 THROUGH 565 )
-REMARK 3 ORIGIN FOR THE GROUP (A): -39.4051 -44.6643-145.0271
-REMARK 3 T TENSOR
-REMARK 3 T11: 0.5088 T22: 0.8559
-REMARK 3 T33: 0.5908 T12: 0.0985
-REMARK 3 T13: -0.0057 T23: -0.1190
-REMARK 3 L TENSOR
-REMARK 3 L11: 5.0897 L22: 6.5761
-REMARK 3 L33: 6.5425 L12: 3.8053
-REMARK 3 L13: 4.1419 L23: 4.2023
-REMARK 3 S TENSOR
-REMARK 3 S11: -0.3161 S12: 0.1791 S13: -0.0666
-REMARK 3 S21: -0.2711 S22: 0.2730 S23: 0.0436
-REMARK 3 S31: -0.0021 S32: -0.2220 S33: 0.0069
-REMARK 3
-REMARK 3 NCS DETAILS
-REMARK 3 NUMBER OF NCS GROUPS : NULL
-REMARK 3
-REMARK 3 OTHER REFINEMENT REMARKS: NULL
-REMARK 4
-REMARK 4 6WVZ COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
-REMARK 100
-REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 11-MAY-20.
-REMARK 100 THE DEPOSITION ID IS D_1000249088.
-REMARK 200
-REMARK 200 EXPERIMENTAL DETAILS
-REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION
-REMARK 200 DATE OF DATA COLLECTION : 09-JUN-14
-REMARK 200 TEMPERATURE (KELVIN) : 100
-REMARK 200 PH : 8.5
-REMARK 200 NUMBER OF CRYSTALS USED : 1
-REMARK 200
-REMARK 200 SYNCHROTRON (Y/N) : Y
-REMARK 200 RADIATION SOURCE : APS
-REMARK 200 BEAMLINE : 17-ID
-REMARK 200 X-RAY GENERATOR MODEL : NULL
-REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M
-REMARK 200 WAVELENGTH OR RANGE (A) : 1.000
-REMARK 200 MONOCHROMATOR : NULL
-REMARK 200 OPTICS : NULL
-REMARK 200
-REMARK 200 DETECTOR TYPE : PIXEL
-REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 6M
-REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000
-REMARK 200 DATA SCALING SOFTWARE : HKL-2000
-REMARK 200
-REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 31529
-REMARK 200 RESOLUTION RANGE HIGH (A) : 3.100
-REMARK 200 RESOLUTION RANGE LOW (A) : 40.450
-REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL
-REMARK 200
-REMARK 200 OVERALL.
-REMARK 200 COMPLETENESS FOR RANGE (%) : 94.9
-REMARK 200 DATA REDUNDANCY : 5.100
-REMARK 200 R MERGE (I) : 0.11000
-REMARK 200 R SYM (I) : 0.11000
-REMARK 200 FOR THE DATA SET : 7.2000
-REMARK 200
-REMARK 200 IN THE HIGHEST RESOLUTION SHELL.
-REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 3.10
-REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 3.15
-REMARK 200 COMPLETENESS FOR SHELL (%) : 96.7
-REMARK 200 DATA REDUNDANCY IN SHELL : 4.50
-REMARK 200 R MERGE FOR SHELL (I) : 0.43100
-REMARK 200 R SYM FOR SHELL (I) : 0.43100
-REMARK 200 FOR SHELL : 2.400
-REMARK 200
-REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH
-REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT
-REMARK 200 SOFTWARE USED: PHASER
-REMARK 200 STARTING MODEL: 1SHY AND 4LEO
-REMARK 200
-REMARK 200 REMARK: NULL
-REMARK 280
-REMARK 280 CRYSTAL
-REMARK 280 SOLVENT CONTENT, VS (%): 68.97
-REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.96
-REMARK 280
-REMARK 280 CRYSTALLIZATION CONDITIONS: 2.5M SODIUM FORMATE, 5% PEG 400, 0.1M
-REMARK 280 TRIS PH 8.5, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 293.15K
-REMARK 290
-REMARK 290 CRYSTALLOGRAPHIC SYMMETRY
-REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 21 2
-REMARK 290
-REMARK 290 SYMOP SYMMETRY
-REMARK 290 NNNMMM OPERATOR
-REMARK 290 1555 X,Y,Z
-REMARK 290 2555 -X,-Y,Z+1/2
-REMARK 290 3555 -Y+1/2,X+1/2,Z+3/4
-REMARK 290 4555 Y+1/2,-X+1/2,Z+1/4
-REMARK 290 5555 -X+1/2,Y+1/2,-Z+3/4
-REMARK 290 6555 X+1/2,-Y+1/2,-Z+1/4
-REMARK 290 7555 Y,X,-Z
-REMARK 290 8555 -Y,-X,-Z+1/2
-REMARK 290
-REMARK 290 WHERE NNN -> OPERATOR NUMBER
-REMARK 290 MMM -> TRANSLATION VECTOR
-REMARK 290
-REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS
-REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM
-REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY
-REMARK 290 RELATED MOLECULES.
-REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000
-REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000
-REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000
-REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000
-REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000
-REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 228.54950
-REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 43.41500
-REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 43.41500
-REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 342.82425
-REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 43.41500
-REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 43.41500
-REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 114.27475
-REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 43.41500
-REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 43.41500
-REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 342.82425
-REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 43.41500
-REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 43.41500
-REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 114.27475
-REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000
-REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000
-REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 0.00000
-REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000
-REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000
-REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 228.54950
-REMARK 290
-REMARK 290 REMARK: NULL
-REMARK 300
-REMARK 300 BIOMOLECULE: 1
-REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
-REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
-REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
-REMARK 300 BURIED SURFACE AREA.
-REMARK 350
-REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
-REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
-REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
-REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
-REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
-REMARK 350
-REMARK 350 BIOMOLECULE: 1
-REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC
-REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC
-REMARK 350 SOFTWARE USED: PISA
-REMARK 350 TOTAL BURIED SURFACE AREA: 7570 ANGSTROM**2
-REMARK 350 SURFACE AREA OF THE COMPLEX: 41660 ANGSTROM**2
-REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -9.0 KCAL/MOL
-REMARK 350 APPLY THE FOLLOWING TO CHAINS: H, L, M, A, B, C, D
-REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000
-REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000
-REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000
-REMARK 465
-REMARK 465 MISSING RESIDUES
-REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE
-REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
-REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)
-REMARK 465
-REMARK 465 M RES C SSSEQI
-REMARK 465 SER H 133
-REMARK 465 SER H 134
-REMARK 465 LYS H 135
-REMARK 465 SER H 136
-REMARK 465 THR H 137
-REMARK 465 SER H 138
-REMARK 465 GLY H 139
-REMARK 465 HIS H 223
-REMARK 465 HIS H 224
-REMARK 465 HIS H 225
-REMARK 465 HIS H 226
-REMARK 465 HIS H 227
-REMARK 465 HIS H 228
-REMARK 465 CYS L 214
-REMARK 465 MET M 39
-REMARK 465 LYS M 303
-REMARK 465 ARG M 304
-REMARK 465 LYS M 305
-REMARK 465 LYS M 306
-REMARK 465 ARG M 307
-REMARK 465 SER M 308
-REMARK 465 THR M 309
-REMARK 465 SER M 407
-REMARK 465 HIS M 566
-REMARK 465 HIS M 567
-REMARK 465 HIS M 568
-REMARK 465 HIS M 569
-REMARK 465 HIS M 570
-REMARK 465 HIS M 571
-REMARK 465 HIS M 572
-REMARK 470
-REMARK 470 MISSING ATOM
-REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER;
-REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER;
-REMARK 470 I=INSERTION CODE):
-REMARK 470 M RES CSSEQI ATOMS
-REMARK 470 GLN H 1 CG CD OE1 NE2
-REMARK 470 LYS H 13 CG CD CE NZ
-REMARK 470 GLU H 23 CG CD OE1 OE2
-REMARK 470 ILE H 34 CD1
-REMARK 470 ASN H 55 OD1 ND2
-REMARK 470 GLN H 62 CG CD OE1 NE2
-REMARK 470 LYS H 63 CG CD CE NZ
-REMARK 470 LYS H 123 CD CE NZ
-REMARK 470 ILE H 201 CD1
-REMARK 470 LYS H 207 CD CE NZ
-REMARK 470 LYS H 212 CG CD CE NZ
-REMARK 470 ARG H 216 CZ NH1 NH2
-REMARK 470 LYS H 220 CG CD CE NZ
-REMARK 470 ASP L 1 CG OD1 OD2
-REMARK 470 ILE L 29 CD1
-REMARK 470 LYS L 42 NZ
-REMARK 470 ILE L 106 CD1
-REMARK 470 LYS L 107 CG CD CE NZ
-REMARK 470 ASP L 122 CG OD1 OD2
-REMARK 470 LEU L 125 CD1 CD2
-REMARK 470 LYS L 126 CG CD CE NZ
-REMARK 470 GLU L 143 CG CD OE1 OE2
-REMARK 470 LYS L 145 CG CD CE NZ
-REMARK 470 LYS L 149 CD CE NZ
-REMARK 470 LEU L 154 CD1 CD2
-REMARK 470 GLU L 165 CG CD OE1 OE2
-REMARK 470 LYS L 169 CG CD CE NZ
-REMARK 470 LYS L 183 CG CD CE NZ
-REMARK 470 ASP L 185 CG OD1 OD2
-REMARK 470 GLU L 187 CG CD OE1 OE2
-REMARK 470 LYS L 188 CG CD CE NZ
-REMARK 470 LYS L 190 CG CD CE NZ
-REMARK 470 VAL L 191 CG1 CG2
-REMARK 470 GLN L 199 CG CD OE1 NE2
-REMARK 470 LEU L 201 CD1 CD2
-REMARK 470 SER L 203 OG
-REMARK 470 SER L 208 OG
-REMARK 470 GLU L 213 CG CD OE1 OE2
-REMARK 470 LYS M 40 CG CD CE NZ
-REMARK 470 GLU M 49 CG CD OE1 OE2
-REMARK 470 GLU M 59 CG CD OE1 OE2
-REMARK 470 ASN M 74 CG OD1 ND2
-REMARK 470 GLU M 76 CG CD OE1 OE2
-REMARK 470 ASP M 77 CG OD1 OD2
-REMARK 470 GLN M 79 CD OE1 NE2
-REMARK 470 LYS M 80 NZ
-REMARK 470 LYS M 85 CG CD CE NZ
-REMARK 470 LYS M 113 CE NZ
-REMARK 470 ASP M 127 CG OD1 OD2
-REMARK 470 ARG M 138 CG CD NE CZ NH1 NH2
-REMARK 470 HIS M 148 CG ND1 CD2 CE1 NE2
-REMARK 470 ASP M 153 CG OD1 OD2
-REMARK 470 ILE M 154 CD1
-REMARK 470 SER M 156 OG
-REMARK 470 GLU M 157 CD OE1 OE2
-REMARK 470 GLN M 171 CD OE1 NE2
-REMARK 470 LYS M 189 CG CD CE NZ
-REMARK 470 ASP M 190 CG OD1 OD2
-REMARK 470 ARG M 191 CG CD NE CZ NH1 NH2
-REMARK 470 ILE M 193 CD1
-REMARK 470 ASP M 208 CG OD1 OD2
-REMARK 470 ILE M 214 CD1
-REMARK 470 LYS M 220 CE NZ
-REMARK 470 LYS M 223 CE NZ
-REMARK 470 ASP M 231 OD1 OD2
-REMARK 470 GLU M 240 CG CD OE1 OE2
-REMARK 470 ARG M 242 CG CD NE CZ NH1 NH2
-REMARK 470 ARG M 266 CZ NH1 NH2
-REMARK 470 ASP M 270 CG OD1 OD2
-REMARK 470 SER M 283 OG
-REMARK 470 ILE M 284 CG1 CG2 CD1
-REMARK 470 ASN M 285 CG OD1 ND2
-REMARK 470 GLU M 297 CG CD OE1 OE2
-REMARK 470 ILE M 299 CD1
-REMARK 470 GLU M 302 CG CD OE1 OE2
-REMARK 470 LYS M 310 CG CD CE NZ
-REMARK 470 LYS M 311 CG CD CE NZ
-REMARK 470 LYS M 324 CE NZ
-REMARK 470 LYS M 350 CD CE NZ
-REMARK 470 GLU M 355 CD OE1 OE2
-REMARK 470 ILE M 367 CD1
-REMARK 470 ILE M 377 CD1
-REMARK 470 LYS M 380 CG CD CE NZ
-REMARK 470 ASN M 381 CG OD1 ND2
-REMARK 470 ASN M 382 OD1 ND2
-REMARK 470 GLU M 395 CG CD OE1 OE2
-REMARK 470 PHE M 398 CG CD1 CD2 CE1 CE2 CZ
-REMARK 470 ARG M 400 CZ NH1 NH2
-REMARK 470 THR M 401 OG1 CG2
-REMARK 470 LEU M 402 CG CD1 CD2
-REMARK 470 ARG M 404 CD NE CZ NH1 NH2
-REMARK 470 ARG M 412 NE CZ NH1 NH2
-REMARK 470 ARG M 413 CG CD NE CZ NH1 NH2
-REMARK 470 LYS M 447 CD CE NZ
-REMARK 470 ASP M 449 CG OD1 OD2
-REMARK 470 GLU M 459 CG CD OE1 OE2
-REMARK 470 SER M 473 OG
-REMARK 470 THR M 495 OG1 CG2
-REMARK 470 LEU M 496 CD1 CD2
-REMARK 470 LYS M 508 CE NZ
-REMARK 470 GLN M 524 CD OE1 NE2
-REMARK 470 SER M 527 OG
-REMARK 470 LEU M 530 CD1 CD2
-REMARK 470 LYS M 544 CE NZ
-REMARK 470 GLU M 549 CD OE1 OE2
-REMARK 470 GLN M 559 OE1 NE2
-REMARK 470 ILE M 560 CD1
-REMARK 470 HIS M 565 CG ND1 CD2 CE1 NE2
-REMARK 500
-REMARK 500 GEOMETRY AND STEREOCHEMISTRY
-REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT
-REMARK 500
-REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.
-REMARK 500
-REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE
-REMARK 500 ND2 ASN M 405 O5 NAG D 1 1.96
-REMARK 500
-REMARK 500 REMARK: NULL
-REMARK 500
-REMARK 500 GEOMETRY AND STEREOCHEMISTRY
-REMARK 500 SUBTOPIC: TORSION ANGLES
-REMARK 500
-REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
-REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
-REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
-REMARK 500
-REMARK 500 STANDARD TABLE:
-REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
-REMARK 500
-REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
-REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
-REMARK 500
-REMARK 500 M RES CSSEQI PSI PHI
-REMARK 500 SER H 7 -165.56 -75.06
-REMARK 500 ARG H 101 -118.12 50.51
-REMARK 500 ASP H 150 74.66 61.19
-REMARK 500 PRO H 155 -169.34 -108.37
-REMARK 500 SER H 183 114.73 -167.40
-REMARK 500 SER L 30 -120.47 60.71
-REMARK 500 ALA L 51 -37.70 67.83
-REMARK 500 ASN L 138 75.25 54.16
-REMARK 500 ARG L 142 31.13 -85.51
-REMARK 500 LYS L 169 -61.61 -95.95
-REMARK 500 LYS L 190 -64.93 -95.16
-REMARK 500 GLN M 53 -87.38 -94.29
-REMARK 500 THR M 86 38.11 -89.79
-REMARK 500 TYR M 126 -136.53 -92.99
-REMARK 500 THR M 268 -145.37 -123.63
-REMARK 500 ASN M 379 -151.13 -150.74
-REMARK 500 ASN M 381 -29.64 -158.35
-REMARK 500 PHE M 389 -70.12 -79.51
-REMARK 500 ASN M 399 39.87 -150.63
-REMARK 500 ASN M 478 107.31 -167.59
-REMARK 500 LEU M 496 -127.24 60.00
-REMARK 500 GLN M 498 15.29 56.61
-REMARK 500 ASN M 499 78.16 -112.72
-REMARK 500 HIS M 542 -71.33 51.62
-REMARK 500
-REMARK 500 REMARK: NULL
-DBREF 6WVZ H 1 228 PDB 6WVZ 6WVZ 1 228
-DBREF 6WVZ L 1 214 PDB 6WVZ 6WVZ 1 214
-DBREF 6WVZ M 39 564 UNP P08581 MET_HUMAN 39 564
-SEQADV 6WVZ HIS M 565 UNP P08581 EXPRESSION TAG
-SEQADV 6WVZ HIS M 566 UNP P08581 EXPRESSION TAG
-SEQADV 6WVZ HIS M 567 UNP P08581 EXPRESSION TAG
-SEQADV 6WVZ HIS M 568 UNP P08581 EXPRESSION TAG
-SEQADV 6WVZ HIS M 569 UNP P08581 EXPRESSION TAG
-SEQADV 6WVZ HIS M 570 UNP P08581 EXPRESSION TAG
-SEQADV 6WVZ HIS M 571 UNP P08581 EXPRESSION TAG
-SEQADV 6WVZ HIS M 572 UNP P08581 EXPRESSION TAG
-SEQRES 1 H 228 GLN VAL GLN LEU VAL GLN SER GLY ALA GLU VAL LYS LYS
-SEQRES 2 H 228 PRO GLY ALA SER VAL LYS VAL SER CYS GLU THR SER GLY
-SEQRES 3 H 228 TYR THR PHE THR SER TYR GLY ILE SER TRP VAL ARG GLN
-SEQRES 4 H 228 ALA PRO GLY HIS GLY LEU GLU TRP MET GLY TRP ILE SER
-SEQRES 5 H 228 ALA TYR ASN GLY TYR THR ASN TYR ALA GLN LYS LEU GLN
-SEQRES 6 H 228 GLY ARG VAL THR MET THR THR ASP THR SER THR SER THR
-SEQRES 7 H 228 ALA TYR MET GLU LEU ARG SER LEU ARG SER ASP ASP THR
-SEQRES 8 H 228 ALA VAL TYR TYR CYS ALA ARG ASP LEU ARG GLY THR ASN
-SEQRES 9 H 228 TYR PHE ASP TYR TRP GLY GLN GLY THR LEU VAL THR VAL
-SEQRES 10 H 228 SER SER ALA SER THR LYS GLY PRO SER VAL PHE PRO LEU
-SEQRES 11 H 228 ALA PRO SER SER LYS SER THR SER GLY GLY THR ALA ALA
-SEQRES 12 H 228 LEU GLY CYS LEU VAL LYS ASP TYR PHE PRO GLU PRO VAL
-SEQRES 13 H 228 THR VAL SER TRP ASN SER GLY ALA LEU THR SER GLY VAL
-SEQRES 14 H 228 HIS THR PHE PRO ALA VAL LEU GLN SER SER GLY LEU TYR
-SEQRES 15 H 228 SER LEU SER SER VAL VAL THR VAL PRO SER SER SER LEU
-SEQRES 16 H 228 GLY THR GLN THR TYR ILE CYS ASN VAL ASN HIS LYS PRO
-SEQRES 17 H 228 SER ASN THR LYS VAL ASP LYS ARG VAL GLU PRO LYS SER
-SEQRES 18 H 228 CYS HIS HIS HIS HIS HIS HIS
-SEQRES 1 L 214 ASP ILE GLN MET THR GLN SER PRO SER SER VAL SER ALA
-SEQRES 2 L 214 SER VAL GLY ASP ARG VAL THR ILE THR CYS ARG ALA SER
-SEQRES 3 L 214 GLN GLY ILE SER ASN TRP LEU ALA TRP PHE GLN HIS LYS
-SEQRES 4 L 214 PRO GLY LYS ALA PRO LYS LEU LEU ILE TYR ALA ALA SER
-SEQRES 5 L 214 SER LEU LEU SER GLY VAL PRO SER ARG PHE SER GLY SER
-SEQRES 6 L 214 GLY SER GLY THR ASP PHE THR LEU THR ILE SER SER LEU
-SEQRES 7 L 214 GLN PRO GLU ASP PHE ALA THR TYR TYR CYS GLN GLN ALA
-SEQRES 8 L 214 ASN SER PHE PRO ILE THR PHE GLY GLN GLY THR ARG LEU
-SEQRES 9 L 214 GLU ILE LYS ARG THR VAL ALA ALA PRO SER VAL PHE ILE
-SEQRES 10 L 214 PHE PRO PRO SER ASP GLU GLN LEU LYS SER GLY THR ALA
-SEQRES 11 L 214 SER VAL VAL CYS LEU LEU ASN ASN PHE TYR PRO ARG GLU
-SEQRES 12 L 214 ALA LYS VAL GLN TRP LYS VAL ASP ASN ALA LEU GLN SER
-SEQRES 13 L 214 GLY ASN SER GLN GLU SER VAL THR GLU GLN ASP SER LYS
-SEQRES 14 L 214 ASP SER THR TYR SER LEU SER SER THR LEU THR LEU SER
-SEQRES 15 L 214 LYS ALA ASP TYR GLU LYS HIS LYS VAL TYR ALA CYS GLU
-SEQRES 16 L 214 VAL THR HIS GLN GLY LEU SER SER PRO VAL THR LYS SER
-SEQRES 17 L 214 PHE ASN ARG GLY GLU CYS
-SEQRES 1 M 534 MET LYS TYR GLN LEU PRO ASN PHE THR ALA GLU THR PRO
-SEQRES 2 M 534 ILE GLN ASN VAL ILE LEU HIS GLU HIS HIS ILE PHE LEU
-SEQRES 3 M 534 GLY ALA THR ASN TYR ILE TYR VAL LEU ASN GLU GLU ASP
-SEQRES 4 M 534 LEU GLN LYS VAL ALA GLU TYR LYS THR GLY PRO VAL LEU
-SEQRES 5 M 534 GLU HIS PRO ASP CYS PHE PRO CYS GLN ASP CYS SER SER
-SEQRES 6 M 534 LYS ALA ASN LEU SER GLY GLY VAL TRP LYS ASP ASN ILE
-SEQRES 7 M 534 ASN MET ALA LEU VAL VAL ASP THR TYR TYR ASP ASP GLN
-SEQRES 8 M 534 LEU ILE SER CYS GLY SER VAL ASN ARG GLY THR CYS GLN
-SEQRES 9 M 534 ARG HIS VAL PHE PRO HIS ASN HIS THR ALA ASP ILE GLN
-SEQRES 10 M 534 SER GLU VAL HIS CYS ILE PHE SER PRO GLN ILE GLU GLU
-SEQRES 11 M 534 PRO SER GLN CYS PRO ASP CYS VAL VAL SER ALA LEU GLY
-SEQRES 12 M 534 ALA LYS VAL LEU SER SER VAL LYS ASP ARG PHE ILE ASN
-SEQRES 13 M 534 PHE PHE VAL GLY ASN THR ILE ASN SER SER TYR PHE PRO
-SEQRES 14 M 534 ASP HIS PRO LEU HIS SER ILE SER VAL ARG ARG LEU LYS
-SEQRES 15 M 534 GLU THR LYS ASP GLY PHE MET PHE LEU THR ASP GLN SER
-SEQRES 16 M 534 TYR ILE ASP VAL LEU PRO GLU PHE ARG ASP SER TYR PRO
-SEQRES 17 M 534 ILE LYS TYR VAL HIS ALA PHE GLU SER ASN ASN PHE ILE
-SEQRES 18 M 534 TYR PHE LEU THR VAL GLN ARG GLU THR LEU ASP ALA GLN
-SEQRES 19 M 534 THR PHE HIS THR ARG ILE ILE ARG PHE CYS SER ILE ASN
-SEQRES 20 M 534 SER GLY LEU HIS SER TYR MET GLU MET PRO LEU GLU CYS
-SEQRES 21 M 534 ILE LEU THR GLU LYS ARG LYS LYS ARG SER THR LYS LYS
-SEQRES 22 M 534 GLU VAL PHE ASN ILE LEU GLN ALA ALA TYR VAL SER LYS
-SEQRES 23 M 534 PRO GLY ALA GLN LEU ALA ARG GLN ILE GLY ALA SER LEU
-SEQRES 24 M 534 ASN ASP ASP ILE LEU PHE GLY VAL PHE ALA GLN SER LYS
-SEQRES 25 M 534 PRO ASP SER ALA GLU PRO MET ASP ARG SER ALA MET CYS
-SEQRES 26 M 534 ALA PHE PRO ILE LYS TYR VAL ASN ASP PHE PHE ASN LYS
-SEQRES 27 M 534 ILE VAL ASN LYS ASN ASN VAL ARG CYS LEU GLN HIS PHE
-SEQRES 28 M 534 TYR GLY PRO ASN HIS GLU HIS CYS PHE ASN ARG THR LEU
-SEQRES 29 M 534 LEU ARG ASN SER SER GLY CYS GLU ALA ARG ARG ASP GLU
-SEQRES 30 M 534 TYR ARG THR GLU PHE THR THR ALA LEU GLN ARG VAL ASP
-SEQRES 31 M 534 LEU PHE MET GLY GLN PHE SER GLU VAL LEU LEU THR SER
-SEQRES 32 M 534 ILE SER THR PHE ILE LYS GLY ASP LEU THR ILE ALA ASN
-SEQRES 33 M 534 LEU GLY THR SER GLU GLY ARG PHE MET GLN VAL VAL VAL
-SEQRES 34 M 534 SER ARG SER GLY PRO SER THR PRO HIS VAL ASN PHE LEU
-SEQRES 35 M 534 LEU ASP SER HIS PRO VAL SER PRO GLU VAL ILE VAL GLU
-SEQRES 36 M 534 HIS THR LEU ASN GLN ASN GLY TYR THR LEU VAL ILE THR
-SEQRES 37 M 534 GLY LYS LYS ILE THR LYS ILE PRO LEU ASN GLY LEU GLY
-SEQRES 38 M 534 CYS ARG HIS PHE GLN SER CYS SER GLN CYS LEU SER ALA
-SEQRES 39 M 534 PRO PRO PHE VAL GLN CYS GLY TRP CYS HIS ASP LYS CYS
-SEQRES 40 M 534 VAL ARG SER GLU GLU CYS LEU SER GLY THR TRP THR GLN
-SEQRES 41 M 534 GLN ILE CYS LEU PRO ALA HIS HIS HIS HIS HIS HIS HIS
-SEQRES 42 M 534 HIS
-HET NAG A 1 14
-HET NAG A 2 14
-HET NAG B 1 14
-HET NAG B 2 14
-HET FUC B 3 10
-HET NAG C 1 14
-HET NAG C 2 14
-HET NAG D 1 14
-HET NAG D 2 14
-HET FUC D 3 10
-HET NAG M 606 14
-HET FMT M 612 3
-HETNAM NAG 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE
-HETNAM FUC ALPHA-L-FUCOPYRANOSE
-HETNAM FMT FORMIC ACID
-HETSYN NAG N-ACETYL-BETA-D-GLUCOSAMINE; 2-ACETAMIDO-2-DEOXY-BETA-
-HETSYN 2 NAG D-GLUCOSE; 2-ACETAMIDO-2-DEOXY-D-GLUCOSE; 2-ACETAMIDO-
-HETSYN 3 NAG 2-DEOXY-GLUCOSE; N-ACETYL-D-GLUCOSAMINE
-HETSYN FUC ALPHA-L-FUCOSE; 6-DEOXY-ALPHA-L-GALACTOPYRANOSE; L-
-HETSYN 2 FUC FUCOSE; FUCOSE
-FORMUL 4 NAG 9(C8 H15 N O6)
-FORMUL 5 FUC 2(C6 H12 O5)
-FORMUL 9 FMT C H2 O2
-FORMUL 10 HOH *52(H2 O)
-HELIX 1 AA1 THR H 28 SER H 31 5 4
-HELIX 2 AA2 GLN H 62 GLN H 65 5 4
-HELIX 3 AA3 ARG H 87 THR H 91 5 5
-HELIX 4 AA4 ARG H 101 ASN H 104 5 4
-HELIX 5 AA5 SER H 193 LEU H 195 5 3
-HELIX 6 AA6 LYS H 207 ASN H 210 5 4
-HELIX 7 AA7 GLN L 79 PHE L 83 5 5
-HELIX 8 AA8 SER L 121 LYS L 126 1 6
-HELIX 9 AA9 LYS L 183 GLU L 187 1 5
-HELIX 10 AB1 ASP M 100 ALA M 105 1 6
-HELIX 11 AB2 VAL M 136 GLY M 139 5 4
-HELIX 12 AB3 SER M 204 HIS M 209 1 6
-HELIX 13 AB4 LEU M 238 ARG M 242 5 5
-HELIX 14 AB5 GLY M 326 ILE M 333 1 8
-HELIX 15 AB6 ILE M 367 ILE M 377 1 11
-HELIX 16 AB7 GLU M 395 ARG M 400 1 6
-HELIX 17 AB8 SER M 525 LEU M 530 1 6
-HELIX 18 AB9 SER M 531 ALA M 532 5 2
-HELIX 19 AC1 PRO M 533 VAL M 536 5 4
-SHEET 1 AA1 4 GLN H 3 GLN H 6 0
-SHEET 2 AA1 4 VAL H 18 SER H 25 -1 O GLU H 23 N VAL H 5
-SHEET 3 AA1 4 THR H 78 LEU H 83 -1 O ALA H 79 N CYS H 22
-SHEET 4 AA1 4 VAL H 68 ASP H 73 -1 N ASP H 73 O THR H 78
-SHEET 1 AA2 6 GLU H 10 LYS H 12 0
-SHEET 2 AA2 6 THR H 113 VAL H 117 1 O THR H 116 N LYS H 12
-SHEET 3 AA2 6 ALA H 92 ASP H 99 -1 N ALA H 92 O VAL H 115
-SHEET 4 AA2 6 GLY H 33 GLN H 39 -1 N GLY H 33 O ASP H 99
-SHEET 5 AA2 6 GLU H 46 SER H 52 -1 O MET H 48 N TRP H 36
-SHEET 6 AA2 6 THR H 58 TYR H 60 -1 O ASN H 59 N TRP H 50
-SHEET 1 AA3 4 GLU H 10 LYS H 12 0
-SHEET 2 AA3 4 THR H 113 VAL H 117 1 O THR H 116 N LYS H 12
-SHEET 3 AA3 4 ALA H 92 ASP H 99 -1 N ALA H 92 O VAL H 115
-SHEET 4 AA3 4 PHE H 106 TRP H 109 -1 O TYR H 108 N ARG H 98
-SHEET 1 AA4 4 SER H 126 LEU H 130 0
-SHEET 2 AA4 4 THR H 141 TYR H 151 -1 O LEU H 147 N PHE H 128
-SHEET 3 AA4 4 TYR H 182 PRO H 191 -1 O VAL H 190 N ALA H 142
-SHEET 4 AA4 4 VAL H 169 THR H 171 -1 N HIS H 170 O VAL H 187
-SHEET 1 AA5 4 SER H 126 LEU H 130 0
-SHEET 2 AA5 4 THR H 141 TYR H 151 -1 O LEU H 147 N PHE H 128
-SHEET 3 AA5 4 TYR H 182 PRO H 191 -1 O VAL H 190 N ALA H 142
-SHEET 4 AA5 4 VAL H 175 LEU H 176 -1 N VAL H 175 O SER H 183
-SHEET 1 AA6 3 THR H 157 TRP H 160 0
-SHEET 2 AA6 3 TYR H 200 HIS H 206 -1 O ASN H 205 N THR H 157
-SHEET 3 AA6 3 THR H 211 VAL H 217 -1 O VAL H 217 N TYR H 200
-SHEET 1 AA7 4 MET L 4 SER L 7 0
-SHEET 2 AA7 4 VAL L 19 ALA L 25 -1 O THR L 22 N SER L 7
-SHEET 3 AA7 4 ASP L 70 ILE L 75 -1 O ILE L 75 N VAL L 19
-SHEET 4 AA7 4 PHE L 62 SER L 67 -1 N SER L 63 O THR L 74
-SHEET 1 AA8 6 SER L 10 ALA L 13 0
-SHEET 2 AA8 6 THR L 102 ILE L 106 1 O ARG L 103 N VAL L 11
-SHEET 3 AA8 6 THR L 85 GLN L 90 -1 N TYR L 86 O THR L 102
-SHEET 4 AA8 6 LEU L 33 HIS L 38 -1 N ALA L 34 O GLN L 89
-SHEET 5 AA8 6 LYS L 45 TYR L 49 -1 O LYS L 45 N GLN L 37
-SHEET 6 AA8 6 SER L 53 LEU L 54 -1 O SER L 53 N TYR L 49
-SHEET 1 AA9 4 SER L 114 PHE L 118 0
-SHEET 2 AA9 4 THR L 129 PHE L 139 -1 O VAL L 133 N PHE L 118
-SHEET 3 AA9 4 TYR L 173 SER L 182 -1 O LEU L 181 N ALA L 130
-SHEET 4 AA9 4 SER L 159 GLN L 160 -1 N GLN L 160 O THR L 178
-SHEET 1 AB1 3 LYS L 145 VAL L 150 0
-SHEET 2 AB1 3 VAL L 191 THR L 197 -1 O ALA L 193 N LYS L 149
-SHEET 3 AB1 3 VAL L 205 ASN L 210 -1 O PHE L 209 N TYR L 192
-SHEET 1 AB2 4 ASN M 45 THR M 47 0
-SHEET 2 AB2 4 LYS M 509 PRO M 514 -1 O ILE M 510 N PHE M 46
-SHEET 3 AB2 4 TYR M 501 THR M 506 -1 N THR M 506 O LYS M 509
-SHEET 4 AB2 4 ILE M 491 GLU M 493 -1 N GLU M 493 O TYR M 501
-SHEET 1 AB3 4 ILE M 52 HIS M 58 0
-SHEET 2 AB3 4 HIS M 61 ALA M 66 -1 O PHE M 63 N ILE M 56
-SHEET 3 AB3 4 TYR M 69 ASN M 74 -1 O TYR M 71 N LEU M 64
-SHEET 4 AB3 4 LYS M 80 ALA M 82 -1 O VAL M 81 N VAL M 72
-SHEET 1 AB4 4 ASN M 117 ASP M 123 0
-SHEET 2 AB4 4 GLN M 129 GLY M 134 -1 O CYS M 133 N MET M 118
-SHEET 3 AB4 4 CYS M 141 VAL M 145 -1 O GLN M 142 N SER M 132
-SHEET 4 AB4 4 GLU M 157 ILE M 161 -1 O GLU M 157 N VAL M 145
-SHEET 1 AB5 4 ALA M 182 LYS M 189 0
-SHEET 2 AB5 4 PHE M 192 ASN M 199 -1 O PHE M 196 N LEU M 185
-SHEET 3 AB5 4 ILE M 214 LEU M 219 -1 O LEU M 219 N ILE M 193
-SHEET 4 AB5 4 PHE M 226 MET M 227 -1 O MET M 227 N ARG M 218
-SHEET 1 AB6 4 ALA M 182 LYS M 189 0
-SHEET 2 AB6 4 PHE M 192 ASN M 199 -1 O PHE M 196 N LEU M 185
-SHEET 3 AB6 4 ILE M 214 LEU M 219 -1 O LEU M 219 N ILE M 193
-SHEET 4 AB6 4 TYR M 234 ILE M 235 -1 O ILE M 235 N ILE M 214
-SHEET 1 AB7 6 LYS M 248 SER M 255 0
-SHEET 2 AB7 6 PHE M 258 ARG M 266 -1 O TYR M 260 N PHE M 253
-SHEET 3 AB7 6 PHE M 274 CYS M 282 -1 O PHE M 281 N ILE M 259
-SHEET 4 AB7 6 HIS M 289 LEU M 300 -1 O HIS M 289 N CYS M 282
-SHEET 5 AB7 6 THR M 418 PHE M 420 1 O PHE M 420 N GLU M 293
-SHEET 6 AB7 6 VAL M 383 CYS M 385 -1 N ARG M 384 O GLU M 419
-SHEET 1 AB8 3 GLU M 312 PHE M 314 0
-SHEET 2 AB8 3 HIS M 289 LEU M 300 -1 N CYS M 298 O PHE M 314
-SHEET 3 AB8 3 LEU M 424 VAL M 427 1 O LEU M 424 N GLU M 297
-SHEET 1 AB9 3 ILE M 316 SER M 323 0
-SHEET 2 AB9 3 ILE M 341 SER M 349 -1 O VAL M 345 N GLN M 318
-SHEET 3 AB9 3 PRO M 356 PRO M 366 -1 O CYS M 363 N GLY M 344
-SHEET 1 AC1 4 LEU M 439 LYS M 447 0
-SHEET 2 AC1 4 LEU M 450 THR M 457 -1 O GLY M 456 N THR M 440
-SHEET 3 AC1 4 ARG M 461 VAL M 467 -1 O MET M 463 N LEU M 455
-SHEET 4 AC1 4 VAL M 477 LEU M 480 -1 O PHE M 479 N PHE M 462
-SHEET 1 AC2 3 LYS M 544 ARG M 547 0
-SHEET 2 AC2 3 CYS M 538 CYS M 541 -1 N CYS M 541 O LYS M 544
-SHEET 3 AC2 3 TRP M 556 THR M 557 -1 O THR M 557 N TRP M 540
-SSBOND 1 CYS H 22 CYS H 96 1555 1555 2.04
-SSBOND 2 CYS H 146 CYS H 202 1555 1555 2.03
-SSBOND 3 CYS L 23 CYS L 88 1555 1555 2.03
-SSBOND 4 CYS L 134 CYS L 194 1555 1555 2.04
-SSBOND 5 CYS M 95 CYS M 101 1555 1555 2.03
-SSBOND 6 CYS M 98 CYS M 160 1555 1555 2.03
-SSBOND 7 CYS M 133 CYS M 141 1555 1555 2.04
-SSBOND 8 CYS M 172 CYS M 175 1555 1555 2.03
-SSBOND 9 CYS M 282 CYS M 409 1555 1555 2.04
-SSBOND 10 CYS M 298 CYS M 363 1555 1555 2.04
-SSBOND 11 CYS M 385 CYS M 397 1555 1555 2.03
-SSBOND 12 CYS M 520 CYS M 538 1555 1555 2.04
-SSBOND 13 CYS M 526 CYS M 561 1555 1555 2.04
-SSBOND 14 CYS M 529 CYS M 545 1555 1555 2.04
-SSBOND 15 CYS M 541 CYS M 551 1555 1555 2.04
-LINK ND2 ASN M 45 C1 NAG A 1 1555 1555 1.44
-LINK ND2 ASN M 106 C1 NAG B 1 1555 1555 1.44
-LINK ND2 ASN M 149 C1 NAG M 606 1555 1555 1.46
-LINK ND2 ASN M 202 C1 NAG C 1 1555 1555 1.45
-LINK ND2 ASN M 405 C1 NAG D 1 1555 1555 1.45
-LINK O4 NAG A 1 C1 NAG A 2 1555 1555 1.43
-LINK O4 NAG B 1 C1 NAG B 2 1555 1555 1.43
-LINK O6 NAG B 1 C1 FUC B 3 1555 1555 1.45
-LINK O4 NAG C 1 C1 NAG C 2 1555 1555 1.44
-LINK O4 NAG D 1 C1 NAG D 2 1555 1555 1.43
-LINK O6 NAG D 1 C1 FUC D 3 1555 1555 1.44
-CISPEP 1 PHE H 152 PRO H 153 0 -3.16
-CISPEP 2 GLU H 154 PRO H 155 0 3.21
-CISPEP 3 SER L 7 PRO L 8 0 0.44
-CISPEP 4 PHE L 94 PRO L 95 0 1.86
-CISPEP 5 TYR L 140 PRO L 141 0 -0.14
-CRYST1 86.830 86.830 457.099 90.00 90.00 90.00 P 43 21 2 8
-ORIGX1 1.000000 0.000000 0.000000 0.00000
-ORIGX2 0.000000 1.000000 0.000000 0.00000
-ORIGX3 0.000000 0.000000 1.000000 0.00000
-SCALE1 0.011517 0.000000 0.000000 0.00000
-SCALE2 0.000000 0.011517 0.000000 0.00000
-SCALE3 0.000000 0.000000 0.002188 0.00000
+HEADER 30-JUL-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 30-JUL-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.26+release.b308454c455
+HETNAM NAG A 1 NAG
+HETNAM NAG B 1 NAG
+HETNAM NAG C 1 NAG
+HETNAM NAG D 1 NAG
+HETNAM NAG A 2 NAG
+HETNAM NAG B 2 NAG
+HETNAM NAG C 2 NAG
+HETNAM NAG D 2 NAG
+HETNAM FUC B 3 FUC
+HETNAM FUC D 3 FUC
+HETNAM HOH H 301 HOH
+HETNAM HOH L 301 HOH
+HETNAM HOH H 302 HOH
+HETNAM HOH L 302 HOH
+HETNAM HOH H 303 HOH
+HETNAM HOH L 303 HOH
+HETNAM HOH H 304 HOH
+HETNAM HOH L 304 HOH
+HETNAM HOH H 305 HOH
+HETNAM HOH L 305 HOH
+HETNAM HOH H 306 HOH
+HETNAM HOH L 306 HOH
+HETNAM HOH H 307 HOH
+HETNAM HOH L 307 HOH
+HETNAM HOH H 308 HOH
+HETNAM HOH L 308 HOH
+HETNAM HOH H 309 HOH
+HETNAM HOH L 309 HOH
+HETNAM HOH L 310 HOH
+HETNAM HOH L 311 HOH
+HETNAM HOH L 312 HOH
+HETNAM HOH L 313 HOH
+HETNAM NAG M 606 NAG
+HETNAM FMT M 612 FMT
+HETNAM HOH M 701 HOH
+HETNAM HOH M 702 HOH
+HETNAM HOH M 703 HOH
+HETNAM HOH M 704 HOH
+HETNAM HOH M 705 HOH
+HETNAM HOH M 706 HOH
+HETNAM HOH M 707 HOH
+HETNAM HOH M 708 HOH
+HETNAM HOH M 709 HOH
+HETNAM HOH M 710 HOH
+HETNAM HOH M 711 HOH
+HETNAM HOH M 712 HOH
+HETNAM HOH M 713 HOH
+HETNAM HOH M 714 HOH
+HETNAM HOH M 715 HOH
+HETNAM HOH M 716 HOH
+HETNAM HOH M 717 HOH
+HETNAM HOH M 718 HOH
+HETNAM HOH M 719 HOH
+HETNAM HOH M 720 HOH
+HETNAM HOH M 721 HOH
+HETNAM HOH M 722 HOH
+HETNAM HOH M 723 HOH
+HETNAM HOH M 724 HOH
+HETNAM HOH M 725 HOH
+HETNAM HOH M 726 HOH
+HETNAM HOH M 727 HOH
+HETNAM HOH M 728 HOH
+HETNAM HOH M 729 HOH
+HETNAM HOH M 730 HOH
+SSBOND CYS H 22 CYS H 96 2.04
+SSBOND CYS L 23 CYS L 88 2.03
+SSBOND CYS M 95 CYS M 101 2.03
+SSBOND CYS M 98 CYS M 160 2.03
+SSBOND CYS M 133 CYS M 141 2.04
+SSBOND CYS L 134 CYS L 194 2.04
+SSBOND CYS H 146 CYS H 202 2.03
+SSBOND CYS M 172 CYS M 175 2.03
+SSBOND CYS M 282 CYS M 409 2.04
+SSBOND CYS M 298 CYS M 363 2.04
+SSBOND CYS M 385 CYS M 397 2.03
+SSBOND CYS M 520 CYS M 538 2.04
+SSBOND CYS M 526 CYS M 561 2.04
+SSBOND CYS M 529 CYS M 545 2.04
+SSBOND CYS M 541 CYS M 551 2.04
ATOM 1 N GLN H 1 -1.914 -13.941 -88.527 1.00 74.77 N
-ANISOU 1 N GLN H 1 10155 10320 7932 -527 288 -267 N
ATOM 2 CA GLN H 1 -3.110 -13.918 -87.691 1.00 86.98 C
-ANISOU 2 CA GLN H 1 11563 12047 9440 -304 -35 -296 C
ATOM 3 C GLN H 1 -4.124 -12.896 -88.200 1.00 99.91 C
-ANISOU 3 C GLN H 1 13754 13302 10907 -224 -201 -430 C
ATOM 4 O GLN H 1 -3.847 -11.698 -88.239 1.00111.50 O
-ANISOU 4 O GLN H 1 15475 14597 12293 -396 -132 -591 O
-ATOM 5 CB GLN H 1 -2.741 -13.610 -86.237 1.00 88.81 C
-ANISOU 5 CB GLN H 1 11291 12761 9692 -361 -108 -382 C
-ATOM 6 N VAL H 2 -5.302 -13.378 -88.585 1.00 94.88 N
-ANISOU 6 N VAL H 2 13279 12524 10249 44 -413 -368 N
-ATOM 7 CA VAL H 2 -6.369 -12.524 -89.098 1.00101.27 C
-ANISOU 7 CA VAL H 2 14597 12996 10886 175 -596 -474 C
-ATOM 8 C VAL H 2 -7.227 -12.061 -87.927 1.00103.76 C
-ANISOU 8 C VAL H 2 14702 13532 11190 284 -849 -534 C
-ATOM 9 O VAL H 2 -7.884 -12.876 -87.269 1.00113.20 O
-ANISOU 9 O VAL H 2 15525 14969 12516 487 -1015 -423 O
-ATOM 10 CB VAL H 2 -7.215 -13.267 -90.141 1.00103.65 C
-ANISOU 10 CB VAL H 2 15163 13040 11178 429 -729 -421 C
-ATOM 11 CG1 VAL H 2 -8.301 -12.362 -90.682 1.00 97.73 C
-ANISOU 11 CG1 VAL H 2 14934 11975 10223 594 -928 -531 C
-ATOM 12 CG2 VAL H 2 -6.332 -13.789 -91.265 1.00115.77 C
-ANISOU 12 CG2 VAL H 2 16895 14395 12696 362 -474 -366 C
-ATOM 13 N GLN H 3 -7.232 -10.754 -87.668 1.00 96.09 N
-ANISOU 13 N GLN H 3 13967 12459 10086 168 -855 -699 N
-ATOM 14 CA GLN H 3 -7.901 -10.215 -86.492 1.00100.34 C
-ANISOU 14 CA GLN H 3 14307 13229 10587 260 -1069 -782 C
-ATOM 15 C GLN H 3 -8.688 -8.960 -86.842 1.00 96.55 C
-ANISOU 15 C GLN H 3 14348 12398 9941 297 -1166 -918 C
-ATOM 16 O GLN H 3 -8.270 -8.165 -87.690 1.00 91.26 O
-ANISOU 16 O GLN H 3 14113 11369 9192 147 -980 -994 O
-ATOM 17 CB GLN H 3 -6.894 -9.890 -85.377 1.00116.60 C
-ANISOU 17 CB GLN H 3 15941 15673 12687 63 -980 -903 C
-ATOM 18 CG GLN H 3 -6.208 -11.109 -84.778 1.00130.43 C
-ANISOU 18 CG GLN H 3 17109 17872 14577 91 -906 -748 C
-ATOM 19 CD GLN H 3 -5.107 -10.740 -83.801 1.00136.00 C
-ANISOU 19 CD GLN H 3 17414 18966 15292 -95 -828 -909 C
-ATOM 20 OE1 GLN H 3 -4.616 -9.611 -83.800 1.00141.61 O
-ANISOU 20 OE1 GLN H 3 18303 19530 15974 -327 -770 -1161 O
-ATOM 21 NE2 GLN H 3 -4.706 -11.697 -82.970 1.00130.84 N
-ANISOU 21 NE2 GLN H 3 16202 18810 14703 22 -818 -772 N
-ATOM 22 N LEU H 4 -9.828 -8.796 -86.173 1.00 99.29 N
-ANISOU 22 N LEU H 4 14636 12844 10246 521 -1427 -918 N
-ATOM 23 CA LEU H 4 -10.626 -7.575 -86.219 1.00 96.29 C
-ANISOU 23 CA LEU H 4 14666 12207 9712 578 -1537 -1044 C
-ATOM 24 C LEU H 4 -10.635 -6.970 -84.823 1.00 97.87 C
-ANISOU 24 C LEU H 4 14560 12732 9894 559 -1631 -1182 C
-ATOM 25 O LEU H 4 -11.003 -7.645 -83.855 1.00101.20 O
-ANISOU 25 O LEU H 4 14541 13544 10367 747 -1778 -1087 O
-ATOM 26 CB LEU H 4 -12.054 -7.854 -86.691 1.00 86.41 C
-ANISOU 26 CB LEU H 4 13641 10773 8420 893 -1782 -940 C
-ATOM 27 CG LEU H 4 -12.283 -8.095 -88.185 1.00 81.21 C
-ANISOU 27 CG LEU H 4 13433 9734 7690 979 -1755 -891 C
-ATOM 28 CD1 LEU H 4 -11.822 -9.486 -88.596 1.00 91.15 C
-ANISOU 28 CD1 LEU H 4 14417 11103 9112 992 -1701 -774 C
-ATOM 29 CD2 LEU H 4 -13.746 -7.891 -88.535 1.00 65.17 C
-ANISOU 29 CD2 LEU H 4 11682 7506 5576 1279 -2032 -881 C
-ATOM 30 N VAL H 5 -10.232 -5.707 -84.720 1.00 95.61 N
-ANISOU 30 N VAL H 5 14500 12280 9547 359 -1531 -1407 N
-ATOM 31 CA VAL H 5 -10.069 -5.022 -83.440 1.00 86.36 C
-ANISOU 31 CA VAL H 5 13053 11406 8355 313 -1615 -1626 C
-ATOM 32 C VAL H 5 -10.929 -3.768 -83.456 1.00 89.81 C
-ANISOU 32 C VAL H 5 13912 11534 8680 374 -1698 -1761 C
-ATOM 33 O VAL H 5 -10.628 -2.808 -84.179 1.00102.77 O
-ANISOU 33 O VAL H 5 15964 12748 10333 185 -1510 -1877 O
-ATOM 34 CB VAL H 5 -8.604 -4.670 -83.161 1.00 75.58 C
-ANISOU 34 CB VAL H 5 11456 10154 7105 -25 -1412 -1849 C
-ATOM 35 CG1 VAL H 5 -8.500 -3.876 -81.880 1.00 71.33 C
-ANISOU 35 CG1 VAL H 5 10661 9910 6532 -44 -1544 -2152 C
-ATOM 36 CG2 VAL H 5 -7.764 -5.935 -83.077 1.00 78.84 C
-ANISOU 36 CG2 VAL H 5 11427 10911 7618 -59 -1329 -1694 C
-ATOM 37 N GLN H 6 -11.987 -3.765 -82.653 1.00 78.13 N
-ANISOU 37 N GLN H 6 12325 10255 7106 653 -1945 -1724 N
-ATOM 38 CA GLN H 6 -12.877 -2.619 -82.577 1.00 79.96 C
-ANISOU 38 CA GLN H 6 12930 10225 7225 743 -2034 -1835 C
-ATOM 39 C GLN H 6 -12.356 -1.605 -81.563 1.00 94.43 C
-ANISOU 39 C GLN H 6 14617 12211 9051 594 -2026 -2177 C
-ATOM 40 O GLN H 6 -11.422 -1.865 -80.802 1.00 99.15 O
-ANISOU 40 O GLN H 6 14775 13192 9705 475 -2010 -2329 O
-ATOM 41 CB GLN H 6 -14.294 -3.061 -82.213 1.00 72.96 C
-ANISOU 41 CB GLN H 6 12002 9456 6265 1126 -2293 -1631 C
-ATOM 42 CG GLN H 6 -14.892 -4.077 -83.164 1.00 78.68 C
-ANISOU 42 CG GLN H 6 12816 10026 7051 1289 -2348 -1357 C
-ATOM 43 CD GLN H 6 -16.355 -4.349 -82.880 1.00 87.09 C
-ANISOU 43 CD GLN H 6 13861 11116 8114 1649 -2595 -1188 C
-ATOM 44 OE1 GLN H 6 -16.914 -5.345 -83.341 1.00 92.14 O
-ANISOU 44 OE1 GLN H 6 14402 11728 8879 1821 -2689 -990 O
-ATOM 45 NE2 GLN H 6 -16.987 -3.460 -82.122 1.00 83.34 N
-ANISOU 45 NE2 GLN H 6 13464 10676 7527 1766 -2696 -1279 N
-ATOM 46 N SER H 7 -12.985 -0.433 -81.555 1.00 98.60 N
-ANISOU 46 N SER H 7 15510 12441 9512 619 -2049 -2318 N
-ATOM 47 CA SER H 7 -12.590 0.647 -80.662 1.00106.30 C
-ANISOU 47 CA SER H 7 16397 13486 10508 483 -2050 -2697 C
-ATOM 48 C SER H 7 -13.059 0.337 -79.241 1.00122.83 C
-ANISOU 48 C SER H 7 18071 16144 12455 770 -2320 -2748 C
-ATOM 49 O SER H 7 -13.429 -0.793 -78.911 1.00131.03 O
-ANISOU 49 O SER H 7 18810 17544 13433 1025 -2444 -2476 O
-ATOM 50 CB SER H 7 -13.141 1.977 -81.170 1.00102.85 C
-ANISOU 50 CB SER H 7 16501 12507 10069 436 -1950 -2805 C
-ATOM 51 OG SER H 7 -14.556 2.000 -81.109 1.00100.06 O
-ANISOU 51 OG SER H 7 16365 12114 9537 779 -2144 -2607 O
-ATOM 52 N GLY H 8 -13.040 1.348 -78.372 1.00120.59 N
-ANISOU 52 N GLY H 8 17756 15938 12127 754 -2394 -3100 N
-ATOM 53 CA GLY H 8 -13.467 1.163 -77.002 1.00114.26 C
-ANISOU 53 CA GLY H 8 16591 15685 11136 1076 -2636 -3168 C
-ATOM 54 C GLY H 8 -14.955 1.386 -76.823 1.00106.21 C
-ANISOU 54 C GLY H 8 15824 14571 9959 1431 -2782 -2965 C
-ATOM 55 O GLY H 8 -15.668 1.767 -77.750 1.00110.06 O
-ANISOU 55 O GLY H 8 16776 14564 10478 1417 -2718 -2809 O
-ATOM 56 N ALA H 9 -15.419 1.130 -75.602 1.00 97.23 N
-ANISOU 56 N ALA H 9 14365 13937 8640 1786 -2972 -2954 N
-ATOM 57 CA ALA H 9 -16.812 1.369 -75.266 1.00 90.37 C
-ANISOU 57 CA ALA H 9 13682 13022 7634 2151 -3104 -2769 C
-ATOM 58 C ALA H 9 -17.076 2.867 -75.145 1.00 77.22 C
-ANISOU 58 C ALA H 9 12384 11025 5930 2052 -3099 -3111 C
-ATOM 59 O ALA H 9 -16.166 3.669 -74.921 1.00 80.25 O
-ANISOU 59 O ALA H 9 12753 11371 6367 1778 -3051 -3562 O
-ATOM 60 CB ALA H 9 -17.183 0.657 -73.967 1.00 74.38 C
-ANISOU 60 CB ALA H 9 11136 11567 5558 2534 -3156 -2545 C
-ATOM 61 N GLU H 10 -18.343 3.243 -75.303 1.00 81.08 N
-ANISOU 61 N GLU H 10 13166 11244 6397 2263 -3120 -2881 N
-ATOM 62 CA GLU H 10 -18.710 4.651 -75.314 1.00 94.30 C
-ANISOU 62 CA GLU H 10 15229 12541 8060 2185 -3078 -3138 C
-ATOM 63 C GLU H 10 -20.088 4.834 -74.694 1.00 90.52 C
-ANISOU 63 C GLU H 10 14766 12121 7508 2572 -3160 -2886 C
-ATOM 64 O GLU H 10 -20.964 3.968 -74.802 1.00 93.57 O
-ANISOU 64 O GLU H 10 15053 12578 7921 2844 -3207 -2458 O
-ATOM 65 CB GLU H 10 -18.682 5.230 -76.739 1.00 96.75 C
-ANISOU 65 CB GLU H 10 16112 12188 8462 1924 -2923 -3146 C
-ATOM 66 CG GLU H 10 -17.270 5.431 -77.284 1.00113.34 C
-ANISOU 66 CG GLU H 10 18181 14111 10772 1471 -2710 -3404 C
-ATOM 67 CD GLU H 10 -17.240 5.939 -78.710 1.00126.15 C
-ANISOU 67 CD GLU H 10 20312 15084 12536 1250 -2454 -3287 C
-ATOM 68 OE1 GLU H 10 -18.319 6.237 -79.258 1.00132.71 O
-ANISOU 68 OE1 GLU H 10 21540 15609 13275 1449 -2463 -3050 O
-ATOM 69 OE2 GLU H 10 -16.135 6.024 -79.290 1.00128.07 O
-ANISOU 69 OE2 GLU H 10 20549 15135 12975 907 -2233 -3414 O
-ATOM 70 N VAL H 11 -20.264 5.978 -74.041 1.00 87.75 N
-ANISOU 70 N VAL H 11 14523 11711 7108 2588 -3161 -3175 N
-ATOM 71 CA VAL H 11 -21.534 6.375 -73.448 1.00 87.61 C
-ANISOU 71 CA VAL H 11 14584 11694 7010 2943 -3222 -2998 C
-ATOM 72 C VAL H 11 -21.925 7.723 -74.040 1.00 82.29 C
-ANISOU 72 C VAL H 11 14450 10456 6360 2800 -3135 -3173 C
-ATOM 73 O VAL H 11 -21.100 8.641 -74.106 1.00 85.27 O
-ANISOU 73 O VAL H 11 14954 10629 6817 2483 -3032 -3603 O
-ATOM 74 CB VAL H 11 -21.450 6.435 -71.909 1.00 86.15 C
-ANISOU 74 CB VAL H 11 13980 12039 6716 3187 -3299 -3151 C
-ATOM 75 CG1 VAL H 11 -20.226 7.220 -71.459 1.00 93.55 C
-ANISOU 75 CG1 VAL H 11 14809 13068 7667 2881 -3287 -3721 C
-ATOM 76 CG2 VAL H 11 -22.720 7.027 -71.320 1.00 86.86 C
-ANISOU 76 CG2 VAL H 11 14215 12067 6721 3541 -3336 -3022 C
-ATOM 77 N LYS H 12 -23.174 7.830 -74.490 1.00 80.66 N
-ANISOU 77 N LYS H 12 14542 9974 6131 3034 -3152 -2838 N
-ATOM 78 CA LYS H 12 -23.678 9.023 -75.153 1.00 85.03 C
-ANISOU 78 CA LYS H 12 15632 9975 6699 2956 -3044 -2904 C
-ATOM 79 C LYS H 12 -25.029 9.415 -74.572 1.00 85.13 C
-ANISOU 79 C LYS H 12 15735 9992 6617 3343 -3130 -2711 C
-ATOM 80 O LYS H 12 -25.766 8.577 -74.045 1.00 81.98 O
-ANISOU 80 O LYS H 12 15055 9901 6192 3679 -3247 -2404 O
-ATOM 81 CB LYS H 12 -23.819 8.810 -76.672 1.00 80.36 C
-ANISOU 81 CB LYS H 12 15430 8936 6168 2838 -2951 -2657 C
-ATOM 82 CG LYS H 12 -22.551 8.356 -77.375 1.00 80.31 C
-ANISOU 82 CG LYS H 12 15384 8878 6252 2489 -2842 -2791 C
-ATOM 83 CD LYS H 12 -21.484 9.441 -77.364 1.00 88.00 C
-ANISOU 83 CD LYS H 12 16493 9593 7351 2119 -2637 -3261 C
-ATOM 84 CE LYS H 12 -20.259 9.016 -78.160 1.00 96.11 C
-ANISOU 84 CE LYS H 12 17530 10492 8495 1784 -2496 -3369 C
-ATOM 85 NZ LYS H 12 -19.174 10.037 -78.155 1.00 88.93 N1+
-ANISOU 85 NZ LYS H 12 16701 9279 7808 1406 -2268 -3835 N1+
-ATOM 86 N LYS H 13 -25.348 10.707 -74.677 1.00 84.36 N
-ANISOU 86 N LYS H 13 16024 9517 6512 3292 -3030 -2885 N
-ATOM 87 CA LYS H 13 -26.678 11.123 -74.268 1.00 84.25 C
-ANISOU 87 CA LYS H 13 16165 9447 6400 3663 -3101 -2679 C
-ATOM 88 C LYS H 13 -27.654 10.991 -75.435 1.00114.11 C
-ANISOU 88 C LYS H 13 20329 12836 10191 3795 -3095 -2284 C
-ATOM 89 O LYS H 13 -27.245 11.032 -76.600 1.00120.14 O
-ANISOU 89 O LYS H 13 21366 13267 11013 3561 -2981 -2254 O
-ATOM 90 CB LYS H 13 -26.657 12.567 -73.775 1.00 88.00 C
-ANISOU 90 CB LYS H 13 16856 9714 6867 3584 -2996 -3036 C
-ATOM 91 N PRO H 14 -28.945 10.811 -75.151 1.00 98.28 N
-ANISOU 91 N PRO H 14 18329 10868 8145 4187 -3204 -1981 N
-ATOM 92 CA PRO H 14 -29.928 10.707 -76.235 1.00 85.06 C
-ANISOU 92 CA PRO H 14 16973 8834 6512 4331 -3215 -1647 C
-ATOM 93 C PRO H 14 -29.891 11.924 -77.146 1.00 90.88 C
-ANISOU 93 C PRO H 14 18304 9056 7169 4176 -3058 -1733 C
-ATOM 94 O PRO H 14 -29.620 13.047 -76.714 1.00 91.47 O
-ANISOU 94 O PRO H 14 18543 8996 7216 4056 -2920 -2001 O
-ATOM 95 CB PRO H 14 -31.264 10.604 -75.493 1.00 78.67 C
-ANISOU 95 CB PRO H 14 16003 8139 5749 4727 -3269 -1444 C
-ATOM 96 CG PRO H 14 -30.907 10.004 -74.181 1.00 92.51 C
-ANISOU 96 CG PRO H 14 17222 10413 7515 4817 -3300 -1524 C
-ATOM 97 CD PRO H 14 -29.551 10.555 -73.833 1.00102.35 C
-ANISOU 97 CD PRO H 14 18487 11778 8624 4531 -3292 -1921 C
-ATOM 98 N GLY H 15 -30.162 11.683 -78.430 1.00 90.27 N
-ANISOU 98 N GLY H 15 18505 8688 7105 4177 -3039 -1505 N
-ATOM 99 CA GLY H 15 -30.119 12.708 -79.445 1.00 82.50 C
-ANISOU 99 CA GLY H 15 18060 7229 6057 4060 -2827 -1502 C
-ATOM 100 C GLY H 15 -28.778 12.858 -80.138 1.00 97.45 C
-ANISOU 100 C GLY H 15 20032 8954 8043 3651 -2583 -1695 C
-ATOM 101 O GLY H 15 -28.736 13.284 -81.297 1.00102.13 O
-ANISOU 101 O GLY H 15 21013 9183 8609 3599 -2392 -1568 O
-ATOM 102 N ALA H 16 -27.683 12.522 -79.458 1.00100.91 N
-ANISOU 102 N ALA H 16 20101 9655 8585 3387 -2571 -1988 N
-ATOM 103 CA ALA H 16 -26.351 12.633 -80.034 1.00 98.13 C
-ANISOU 103 CA ALA H 16 19786 9135 8365 2997 -2333 -2203 C
-ATOM 104 C ALA H 16 -26.070 11.444 -80.945 1.00 98.86 C
-ANISOU 104 C ALA H 16 19822 9310 8430 2985 -2413 -1988 C
-ATOM 105 O ALA H 16 -26.922 10.584 -81.175 1.00 99.61 O
-ANISOU 105 O ALA H 16 19839 9562 8444 3264 -2648 -1695 O
-ATOM 106 CB ALA H 16 -25.297 12.730 -78.935 1.00 97.79 C
-ANISOU 106 CB ALA H 16 19349 9364 8443 2738 -2322 -2636 C
-ATOM 107 N SER H 17 -24.850 11.389 -81.463 1.00100.13 N
-ANISOU 107 N SER H 17 20000 9345 8699 2659 -2207 -2154 N
-ATOM 108 CA SER H 17 -24.427 10.333 -82.367 1.00101.08 C
-ANISOU 108 CA SER H 17 20092 9519 8796 2617 -2239 -1989 C
-ATOM 109 C SER H 17 -23.196 9.633 -81.808 1.00106.30 C
-ANISOU 109 C SER H 17 20329 10496 9564 2338 -2259 -2242 C
-ATOM 110 O SER H 17 -22.547 10.108 -80.871 1.00120.81 O
-ANISOU 110 O SER H 17 21948 12452 11503 2147 -2213 -2584 O
-ATOM 111 CB SER H 17 -24.127 10.889 -83.764 1.00100.23 C
-ANISOU 111 CB SER H 17 20486 8918 8680 2544 -1924 -1874 C
-ATOM 112 OG SER H 17 -22.980 11.716 -83.737 1.00109.52 O
-ANISOU 112 OG SER H 17 21740 9814 10058 2191 -1574 -2164 O
-ATOM 113 N VAL H 18 -22.881 8.489 -82.408 1.00 97.73 N
-ANISOU 113 N VAL H 18 19117 9559 8456 2329 -2341 -2086 N
-ATOM 114 CA VAL H 18 -21.742 7.676 -82.002 1.00 93.59 C
-ANISOU 114 CA VAL H 18 18184 9357 8019 2093 -2363 -2258 C
-ATOM 115 C VAL H 18 -21.055 7.154 -83.256 1.00 88.24 C
-ANISOU 115 C VAL H 18 17647 8490 7391 1943 -2190 -2118 C
-ATOM 116 O VAL H 18 -21.716 6.826 -84.248 1.00 77.22 O
-ANISOU 116 O VAL H 18 16531 6931 5879 2154 -2237 -1849 O
-ATOM 117 CB VAL H 18 -22.183 6.522 -81.078 1.00 86.81 C
-ANISOU 117 CB VAL H 18 16798 9056 7129 2305 -2676 -2135 C
-ATOM 118 CG1 VAL H 18 -23.291 5.712 -81.727 1.00 73.22 C
-ANISOU 118 CG1 VAL H 18 15096 7330 5395 2605 -2843 -1743 C
-ATOM 119 CG2 VAL H 18 -21.011 5.631 -80.736 1.00 86.88 C
-ANISOU 119 CG2 VAL H 18 16369 9417 7223 2091 -2676 -2255 C
-ATOM 120 N LYS H 19 -19.724 7.095 -83.221 1.00 90.63 N
-ANISOU 120 N LYS H 19 17754 8819 7861 1598 -1995 -2315 N
-ATOM 121 CA LYS H 19 -18.933 6.587 -84.338 1.00 91.04 C
-ANISOU 121 CA LYS H 19 17909 8712 7970 1445 -1796 -2190 C
-ATOM 122 C LYS H 19 -17.975 5.525 -83.816 1.00 93.13 C
-ANISOU 122 C LYS H 19 17632 9409 8344 1258 -1875 -2275 C
-ATOM 123 O LYS H 19 -17.065 5.831 -83.038 1.00101.67 O
-ANISOU 123 O LYS H 19 18419 10631 9581 999 -1797 -2570 O
-ATOM 124 CB LYS H 19 -18.177 7.712 -85.044 1.00 90.62 C
-ANISOU 124 CB LYS H 19 18229 8138 8066 1203 -1365 -2293 C
-ATOM 125 CG LYS H 19 -17.401 7.249 -86.268 1.00 90.73 C
-ANISOU 125 CG LYS H 19 18403 7960 8111 1102 -1114 -2119 C
-ATOM 126 CD LYS H 19 -17.019 8.410 -87.172 1.00 87.22 C
-ANISOU 126 CD LYS H 19 18446 6922 7772 1011 -649 -2087 C
-ATOM 127 CE LYS H 19 -16.345 7.911 -88.442 1.00102.70 C
-ANISOU 127 CE LYS H 19 20606 8710 9706 998 -392 -1860 C
-ATOM 128 NZ LYS H 19 -16.068 9.001 -89.418 1.00109.95 N1+
-ANISOU 128 NZ LYS H 19 22036 9040 10699 1002 107 -1739 N1+
-ATOM 129 N VAL H 20 -18.181 4.285 -84.255 1.00 87.44 N
-ANISOU 129 N VAL H 20 16769 8896 7557 1402 -2030 -2034 N
-ATOM 130 CA VAL H 20 -17.388 3.129 -83.856 1.00 86.91 C
-ANISOU 130 CA VAL H 20 16197 9240 7585 1282 -2098 -2041 C
-ATOM 131 C VAL H 20 -16.466 2.743 -85.002 1.00 95.52 C
-ANISOU 131 C VAL H 20 17426 10124 8743 1094 -1854 -1957 C
-ATOM 132 O VAL H 20 -16.883 2.716 -86.168 1.00106.47 O
-ANISOU 132 O VAL H 20 19222 11208 10022 1238 -1792 -1765 O
-ATOM 133 CB VAL H 20 -18.302 1.952 -83.465 1.00 84.00 C
-ANISOU 133 CB VAL H 20 15522 9236 7158 1593 -2420 -1821 C
-ATOM 134 CG1 VAL H 20 -17.480 0.732 -83.083 1.00 88.80 C
-ANISOU 134 CG1 VAL H 20 15609 10252 7879 1495 -2446 -1790 C
-ATOM 135 CG2 VAL H 20 -19.227 2.360 -82.329 1.00 83.77 C
-ANISOU 135 CG2 VAL H 20 15368 9403 7058 1818 -2624 -1865 C
-ATOM 136 N SER H 21 -15.212 2.438 -84.675 1.00 91.50 N
-ANISOU 136 N SER H 21 16574 9797 8395 804 -1718 -2102 N
-ATOM 137 CA SER H 21 -14.222 2.021 -85.656 1.00 85.92 C
-ANISOU 137 CA SER H 21 15941 8930 7774 615 -1462 -2020 C
-ATOM 138 C SER H 21 -13.892 0.542 -85.488 1.00 87.90 C
-ANISOU 138 C SER H 21 15748 9598 8052 643 -1606 -1896 C
-ATOM 139 O SER H 21 -14.087 -0.048 -84.422 1.00 89.03 O
-ANISOU 139 O SER H 21 15438 10185 8205 730 -1833 -1924 O
-ATOM 140 CB SER H 21 -12.945 2.862 -85.541 1.00 86.99 C
-ANISOU 140 CB SER H 21 16034 8877 8142 233 -1135 -2273 C
-ATOM 141 OG SER H 21 -12.332 2.699 -84.277 1.00 97.63 O
-ANISOU 141 OG SER H 21 16834 10651 9610 73 -1259 -2534 O
-ATOM 142 N CYS H 22 -13.378 -0.050 -86.569 1.00 94.89 N
-ANISOU 142 N CYS H 22 16774 10332 8947 597 -1442 -1742 N
-ATOM 143 CA CYS H 22 -13.069 -1.480 -86.604 1.00 93.39 C
-ANISOU 143 CA CYS H 22 16215 10464 8803 631 -1537 -1605 C
-ATOM 144 C CYS H 22 -11.858 -1.669 -87.514 1.00 91.80 C
-ANISOU 144 C CYS H 22 16115 10079 8686 403 -1211 -1570 C
-ATOM 145 O CYS H 22 -11.998 -1.685 -88.741 1.00 95.47 O
-ANISOU 145 O CYS H 22 17010 10224 9041 514 -1088 -1426 O
-ATOM 146 CB CYS H 22 -14.267 -2.280 -87.093 1.00 90.02 C
-ANISOU 146 CB CYS H 22 15891 10047 8265 979 -1799 -1399 C
-ATOM 147 SG CYS H 22 -14.041 -4.068 -87.163 1.00 94.35 S
-ANISOU 147 SG CYS H 22 15980 10927 8941 1050 -1911 -1235 S
-ATOM 148 N GLU H 23 -10.681 -1.810 -86.909 1.00 86.45 N
-ANISOU 148 N GLU H 23 15038 9622 8189 118 -1074 -1701 N
-ATOM 149 CA GLU H 23 -9.438 -1.968 -87.654 1.00 81.35 C
-ANISOU 149 CA GLU H 23 14424 8816 7670 -122 -738 -1669 C
-ATOM 150 C GLU H 23 -9.177 -3.452 -87.883 1.00 87.17 C
-ANISOU 150 C GLU H 23 14874 9835 8411 -48 -807 -1488 C
-ATOM 151 O GLU H 23 -9.080 -4.226 -86.924 1.00 84.70 O
-ANISOU 151 O GLU H 23 14044 9974 8165 -37 -983 -1504 O
-ATOM 152 CB GLU H 23 -8.273 -1.320 -86.907 1.00 76.40 C
-ANISOU 152 CB GLU H 23 13485 8258 7284 -478 -554 -1934 C
-ATOM 153 N THR H 24 -9.068 -3.846 -89.148 1.00 91.96 N
-ANISOU 153 N THR H 24 15819 10180 8941 34 -653 -1314 N
-ATOM 154 CA THR H 24 -8.877 -5.237 -89.525 1.00 92.00 C
-ANISOU 154 CA THR H 24 15616 10382 8959 123 -705 -1156 C
-ATOM 155 C THR H 24 -7.448 -5.457 -90.000 1.00102.61 C
-ANISOU 155 C THR H 24 16886 11666 10435 -134 -346 -1121 C
-ATOM 156 O THR H 24 -6.783 -4.531 -90.473 1.00104.78 O
-ANISOU 156 O THR H 24 17437 11615 10758 -309 -28 -1162 O
-ATOM 157 CB THR H 24 -9.852 -5.646 -90.632 1.00 94.90 C
-ANISOU 157 CB THR H 24 16397 10530 9129 454 -842 -1020 C
-ATOM 158 OG1 THR H 24 -9.413 -5.097 -91.880 1.00 98.45 O
-ANISOU 158 OG1 THR H 24 17374 10579 9452 461 -536 -956 O
-ATOM 159 CG2 THR H 24 -11.246 -5.122 -90.330 1.00 98.68 C
-ANISOU 159 CG2 THR H 24 17050 10960 9485 696 -1140 -1059 C
-ATOM 160 N SER H 25 -6.979 -6.697 -89.870 1.00104.28 N
-ANISOU 160 N SER H 25 16710 12176 10737 -147 -371 -1027 N
-ATOM 161 CA SER H 25 -5.648 -7.053 -90.341 1.00106.87 C
-ANISOU 161 CA SER H 25 16944 12473 11191 -364 -37 -964 C
-ATOM 162 C SER H 25 -5.601 -8.546 -90.626 1.00109.28 C
-ANISOU 162 C SER H 25 17017 12990 11513 -231 -108 -804 C
-ATOM 163 O SER H 25 -6.357 -9.327 -90.043 1.00109.81 O
-ANISOU 163 O SER H 25 16789 13332 11601 -54 -398 -771 O
-ATOM 164 CB SER H 25 -4.565 -6.677 -89.323 1.00112.09 C
-ANISOU 164 CB SER H 25 17142 13369 12077 -695 90 -1125 C
-ATOM 165 OG SER H 25 -4.487 -5.273 -89.151 1.00123.98 O
-ANISOU 165 OG SER H 25 18858 14612 13638 -852 200 -1312 O
-ATOM 166 N GLY H 26 -4.702 -8.930 -91.530 1.00110.40 N
-ANISOU 166 N GLY H 26 17288 12980 11678 -307 187 -694 N
-ATOM 167 CA GLY H 26 -4.461 -10.326 -91.836 1.00109.33 C
-ANISOU 167 CA GLY H 26 16926 13019 11597 -217 181 -558 C
-ATOM 168 C GLY H 26 -4.939 -10.784 -93.196 1.00104.38 C
-ANISOU 168 C GLY H 26 16769 12109 10784 56 176 -473 C
-ATOM 169 O GLY H 26 -4.785 -11.969 -93.516 1.00 98.62 O
-ANISOU 169 O GLY H 26 15866 11489 10116 145 163 -391 O
-ATOM 170 N TYR H 27 -5.509 -9.900 -94.008 1.00101.24 N
-ANISOU 170 N TYR H 27 16952 11361 10155 217 187 -499 N
-ATOM 171 CA TYR H 27 -5.994 -10.292 -95.323 1.00106.63 C
-ANISOU 171 CA TYR H 27 18102 11814 10600 541 149 -452 C
-ATOM 172 C TYR H 27 -6.068 -9.057 -96.209 1.00106.12 C
-ANISOU 172 C TYR H 27 18681 11359 10282 653 362 -423 C
-ATOM 173 O TYR H 27 -5.989 -7.921 -95.736 1.00113.89 O
-ANISOU 173 O TYR H 27 19732 12228 11314 489 478 -458 O
-ATOM 174 CB TYR H 27 -7.358 -10.986 -95.231 1.00109.01 C
-ANISOU 174 CB TYR H 27 18323 12225 10871 832 -313 -535 C
-ATOM 175 CG TYR H 27 -8.450 -10.147 -94.602 1.00106.40 C
-ANISOU 175 CG TYR H 27 18056 11884 10489 909 -582 -625 C
-ATOM 176 CD1 TYR H 27 -8.687 -10.192 -93.237 1.00 99.48 C
-ANISOU 176 CD1 TYR H 27 16679 11295 9825 768 -746 -659 C
-ATOM 177 CD2 TYR H 27 -9.247 -9.315 -95.375 1.00117.22 C
-ANISOU 177 CD2 TYR H 27 19992 12971 11575 1160 -661 -661 C
-ATOM 178 CE1 TYR H 27 -9.686 -9.431 -92.657 1.00 99.04 C
-ANISOU 178 CE1 TYR H 27 16688 11229 9714 858 -980 -733 C
-ATOM 179 CE2 TYR H 27 -10.245 -8.547 -94.806 1.00116.23 C
-ANISOU 179 CE2 TYR H 27 19927 12829 11408 1236 -893 -731 C
-ATOM 180 CZ TYR H 27 -10.462 -8.609 -93.448 1.00104.43 C
-ANISOU 180 CZ TYR H 27 17933 11606 10141 1075 -1051 -770 C
-ATOM 181 OH TYR H 27 -11.457 -7.846 -92.883 1.00 98.17 O
-ANISOU 181 OH TYR H 27 17211 10793 9296 1170 -1269 -832 O
-ATOM 182 N THR H 28 -6.210 -9.298 -97.510 1.00 97.99 N
-ANISOU 182 N THR H 28 18122 10125 8983 962 428 -360 N
-ATOM 183 CA THR H 28 -6.472 -8.210 -98.442 1.00105.14 C
-ANISOU 183 CA THR H 28 19680 10680 9588 1193 612 -296 C
-ATOM 184 C THR H 28 -7.846 -7.625 -98.140 1.00 98.20 C
-ANISOU 184 C THR H 28 18951 9784 8578 1388 239 -411 C
-ATOM 185 O THR H 28 -8.862 -8.323 -98.224 1.00 90.63 O
-ANISOU 185 O THR H 28 17940 8960 7536 1642 -183 -519 O
-ATOM 186 CB THR H 28 -6.390 -8.700 -99.886 1.00112.52 C
-ANISOU 186 CB THR H 28 21075 11473 10203 1567 720 -215 C
-ATOM 187 OG1 THR H 28 -7.307 -9.782-100.084 1.00121.35 O
-ANISOU 187 OG1 THR H 28 22090 12778 11240 1837 255 -368 O
-ATOM 188 CG2 THR H 28 -4.979 -9.176-100.211 1.00112.67 C
-ANISOU 188 CG2 THR H 28 20982 11476 10352 1379 1149 -68 C
-ATOM 189 N PHE H 29 -7.871 -6.341 -97.785 1.00 99.39 N
-ANISOU 189 N PHE H 29 19267 9749 8749 1265 406 -395 N
-ATOM 190 CA PHE H 29 -9.079 -5.750 -97.222 1.00102.99 C
-ANISOU 190 CA PHE H 29 19762 10221 9148 1374 71 -503 C
-ATOM 191 C PHE H 29 -10.213 -5.695 -98.239 1.00104.49 C
-ANISOU 191 C PHE H 29 20461 10285 8957 1870 -163 -503 C
-ATOM 192 O PHE H 29 -11.359 -6.031 -97.915 1.00107.12 O
-ANISOU 192 O PHE H 29 20671 10764 9265 2044 -613 -623 O
-ATOM 193 CB PHE H 29 -8.762 -4.355 -96.689 1.00110.39 C
-ANISOU 193 CB PHE H 29 20786 10949 10210 1133 349 -500 C
-ATOM 194 CG PHE H 29 -9.908 -3.705 -95.985 1.00109.60 C
-ANISOU 194 CG PHE H 29 20691 10873 10078 1209 38 -610 C
-ATOM 195 CD1 PHE H 29 -10.445 -4.271 -94.845 1.00114.74 C
-ANISOU 195 CD1 PHE H 29 20836 11866 10893 1116 -350 -739 C
-ATOM 196 CD2 PHE H 29 -10.444 -2.522 -96.458 1.00109.02 C
-ANISOU 196 CD2 PHE H 29 21130 10479 9813 1399 165 -557 C
-ATOM 197 CE1 PHE H 29 -11.500 -3.673 -94.191 1.00120.77 C
-ANISOU 197 CE1 PHE H 29 21609 12652 11627 1206 -616 -822 C
-ATOM 198 CE2 PHE H 29 -11.496 -1.921 -95.809 1.00108.36 C
-ANISOU 198 CE2 PHE H 29 21055 10414 9703 1474 -109 -650 C
-ATOM 199 CZ PHE H 29 -12.026 -2.495 -94.674 1.00116.55 C
-ANISOU 199 CZ PHE H 29 21589 11794 10900 1374 -506 -787 C
-ATOM 200 N THR H 30 -9.916 -5.281 -99.473 1.00105.01 N
-ANISOU 200 N THR H 30 21086 10089 8726 2131 142 -367 N
-ATOM 201 CA THR H 30 -10.972 -5.088-100.464 1.00102.06 C
-ANISOU 201 CA THR H 30 21231 9615 7931 2656 -68 -374 C
-ATOM 202 C THR H 30 -11.666 -6.395-100.826 1.00102.39 C
-ANISOU 202 C THR H 30 21125 9895 7885 2926 -546 -545 C
-ATOM 203 O THR H 30 -12.825 -6.381-101.256 1.00 96.93 O
-ANISOU 203 O THR H 30 20660 9217 6951 3312 -913 -654 O
-ATOM 204 CB THR H 30 -10.400 -4.439-101.725 1.00104.25 C
-ANISOU 204 CB THR H 30 22129 9596 7884 2933 409 -159 C
-ATOM 205 OG1 THR H 30 -9.413 -5.302-102.303 1.00107.28 O
-ANISOU 205 OG1 THR H 30 22463 10029 8270 2913 626 -95 O
-ATOM 206 CG2 THR H 30 -9.762 -3.104-101.394 1.00102.06 C
-ANISOU 206 CG2 THR H 30 21981 9015 7781 2670 914 5 C
-ATOM 207 N SER H 31 -10.984 -7.528-100.659 1.00105.30 N
-ANISOU 207 N SER H 31 21095 10439 8476 2733 -547 -585 N
-ATOM 208 CA SER H 31 -11.528 -8.816-101.073 1.00 99.19 C
-ANISOU 208 CA SER H 31 20163 9839 7685 2977 -945 -763 C
-ATOM 209 C SER H 31 -12.650 -9.311-100.169 1.00 89.00 C
-ANISOU 209 C SER H 31 18418 8736 6664 2947 -1453 -940 C
-ATOM 210 O SER H 31 -13.239 -10.358-100.459 1.00 84.26 O
-ANISOU 210 O SER H 31 17639 8243 6135 3148 -1811 -1119 O
-ATOM 211 CB SER H 31 -10.408 -9.856-101.129 1.00103.25 C
-ANISOU 211 CB SER H 31 20375 10459 8398 2767 -737 -726 C
-ATOM 212 OG SER H 31 -10.851 -11.063-101.724 1.00110.35 O
-ANISOU 212 OG SER H 31 21193 11465 9270 3038 -1065 -912 O
-ATOM 213 N TYR H 32 -12.965 -8.598 -99.093 1.00 88.96 N
-ANISOU 213 N TYR H 32 18211 8756 6833 2718 -1482 -902 N
-ATOM 214 CA TYR H 32 -14.027 -8.993 -98.186 1.00 86.88 C
-ANISOU 214 CA TYR H 32 17521 8659 6830 2714 -1910 -1021 C
-ATOM 215 C TYR H 32 -14.946 -7.806 -97.930 1.00 93.51 C
-ANISOU 215 C TYR H 32 18631 9387 7512 2836 -2025 -1013 C
-ATOM 216 O TYR H 32 -14.583 -6.647 -98.154 1.00107.63 O
-ANISOU 216 O TYR H 32 20824 10983 9087 2808 -1715 -901 O
-ATOM 217 CB TYR H 32 -13.469 -9.514 -96.852 1.00 91.28 C
-ANISOU 217 CB TYR H 32 17421 9448 7814 2309 -1843 -970 C
-ATOM 218 CG TYR H 32 -12.788 -10.867 -96.924 1.00 90.88 C
-ANISOU 218 CG TYR H 32 16987 9546 7996 2211 -1799 -976 C
-ATOM 219 CD1 TYR H 32 -13.423 -12.016 -96.464 1.00 86.26 C
-ANISOU 219 CD1 TYR H 32 15905 9125 7746 2268 -2111 -1059 C
-ATOM 220 CD2 TYR H 32 -11.506 -10.993 -97.442 1.00 91.99 C
-ANISOU 220 CD2 TYR H 32 17247 9641 8063 2066 -1413 -881 C
-ATOM 221 CE1 TYR H 32 -12.799 -13.254 -96.524 1.00 85.73 C
-ANISOU 221 CE1 TYR H 32 15480 9168 7924 2185 -2037 -1053 C
-ATOM 222 CE2 TYR H 32 -10.874 -12.225 -97.506 1.00 92.25 C
-ANISOU 222 CE2 TYR H 32 16936 9806 8310 1984 -1355 -876 C
-ATOM 223 CZ TYR H 32 -11.524 -13.352 -97.046 1.00 88.54 C
-ANISOU 223 CZ TYR H 32 15984 9496 8163 2043 -1667 -965 C
-ATOM 224 OH TYR H 32 -10.894 -14.577 -97.111 1.00 83.72 O
-ANISOU 224 OH TYR H 32 15025 8991 7793 1967 -1577 -950 O
-ATOM 225 N GLY H 33 -16.150 -8.111 -97.455 1.00 73.67 N
-ANISOU 225 N GLY H 33 13549 7792 6651 -96 -727 -687 N
-ATOM 226 CA GLY H 33 -17.079 -7.094 -97.022 1.00 78.33 C
-ANISOU 226 CA GLY H 33 14577 8151 7034 108 -868 -444 C
-ATOM 227 C GLY H 33 -17.178 -7.030 -95.507 1.00 85.75 C
-ANISOU 227 C GLY H 33 15417 8910 8254 140 -1025 -426 C
-ATOM 228 O GLY H 33 -16.784 -7.961 -94.800 1.00 89.90 O
-ANISOU 228 O GLY H 33 15506 9521 9130 59 -1107 -571 O
-ATOM 229 N ILE H 34 -17.720 -5.919 -95.011 1.00 76.11 N
-ANISOU 229 N ILE H 34 14623 7427 6868 259 -1078 -250 N
-ATOM 230 CA ILE H 34 -17.858 -5.685 -93.578 1.00 69.24 C
-ANISOU 230 CA ILE H 34 13758 6383 6168 281 -1194 -246 C
-ATOM 231 C ILE H 34 -19.329 -5.472 -93.255 1.00 65.30 C
-ANISOU 231 C ILE H 34 13392 5861 5560 716 -1344 -182 C
-ATOM 232 O ILE H 34 -19.985 -4.621 -93.864 1.00 72.18 O
-ANISOU 232 O ILE H 34 14642 6598 6185 930 -1341 -49 O
-ATOM 233 CB ILE H 34 -17.017 -4.482 -93.114 1.00 66.90 C
-ANISOU 233 CB ILE H 34 13850 5756 5815 -11 -1096 -154 C
-ATOM 234 CG1 ILE H 34 -15.538 -4.857 -93.019 1.00 63.43 C
-ANISOU 234 CG1 ILE H 34 13127 5365 5609 -463 -990 -236 C
-ATOM 235 CG2 ILE H 34 -17.522 -3.969 -91.784 1.00 67.98 C
-ANISOU 235 CG2 ILE H 34 14169 5681 5980 111 -1218 -151 C
-ATOM 236 N SER H 35 -19.844 -6.249 -92.306 1.00 67.20 N
-ANISOU 236 N SER H 35 13302 6236 5995 837 -1481 -263 N
-ATOM 237 CA SER H 35 -21.206 -6.116 -91.817 1.00 73.58 C
-ANISOU 237 CA SER H 35 14144 7070 6744 1224 -1588 -223 C
-ATOM 238 C SER H 35 -21.174 -5.705 -90.352 1.00 72.13 C
-ANISOU 238 C SER H 35 14055 6743 6609 1164 -1590 -259 C
-ATOM 239 O SER H 35 -20.176 -5.902 -89.653 1.00 74.68 O
-ANISOU 239 O SER H 35 14291 7019 7063 817 -1587 -313 O
-ATOM 240 CB SER H 35 -21.988 -7.427 -91.969 1.00 81.22 C
-ANISOU 240 CB SER H 35 14633 8370 7858 1402 -1741 -273 C
-ATOM 241 OG SER H 35 -21.695 -8.045 -93.211 1.00 88.48 O
-ANISOU 241 OG SER H 35 15413 9441 8766 1346 -1742 -313 O
-ATOM 242 N TRP H 36 -22.283 -5.134 -89.885 1.00 71.60 N
-ANISOU 242 N TRP H 36 14157 6616 6433 1507 -1598 -241 N
-ATOM 243 CA TRP H 36 -22.398 -4.718 -88.493 1.00 59.59 C
-ANISOU 243 CA TRP H 36 12758 4991 4893 1486 -1568 -317 C
-ATOM 244 C TRP H 36 -23.633 -5.349 -87.865 1.00 63.66 C
-ANISOU 244 C TRP H 36 12955 5789 5446 1776 -1619 -346 C
-ATOM 245 O TRP H 36 -24.719 -5.312 -88.452 1.00 75.93 O
-ANISOU 245 O TRP H 36 14443 7437 6972 2156 -1642 -297 O
-ATOM 246 CB TRP H 36 -22.451 -3.192 -88.383 1.00 68.84 C
-ANISOU 246 CB TRP H 36 14508 5761 5888 1603 -1469 -317 C
-ATOM 247 CG TRP H 36 -21.126 -2.525 -88.630 1.00 73.03 C
-ANISOU 247 CG TRP H 36 15361 5998 6390 1211 -1421 -281 C
-ATOM 248 CD1 TRP H 36 -20.603 -2.164 -89.835 1.00 90.66 C
-ANISOU 248 CD1 TRP H 36 17767 8116 8565 1102 -1385 -159 C
-ATOM 249 CD2 TRP H 36 -20.158 -2.141 -87.643 1.00 72.52 C
-ANISOU 249 CD2 TRP H 36 15474 5740 6340 839 -1409 -355 C
-ATOM 250 NE1 TRP H 36 -19.372 -1.577 -89.662 1.00 88.99 N
-ANISOU 250 NE1 TRP H 36 17799 7657 8355 683 -1330 -144 N
-ATOM 251 CE2 TRP H 36 -19.076 -1.555 -88.326 1.00 82.06 C
-ANISOU 251 CE2 TRP H 36 16925 6714 7539 520 -1365 -265 C
-ATOM 252 CE3 TRP H 36 -20.101 -2.241 -86.251 1.00 82.00 C
-ANISOU 252 CE3 TRP H 36 16659 6959 7538 715 -1441 -478 C
-ATOM 253 CZ2 TRP H 36 -17.951 -1.069 -87.664 1.00 87.79 C
-ANISOU 253 CZ2 TRP H 36 17847 7210 8300 92 -1373 -294 C
-ATOM 254 CZ3 TRP H 36 -18.982 -1.757 -85.595 1.00 82.98 C
-ANISOU 254 CZ3 TRP H 36 17017 6848 7664 293 -1469 -514 C
-ATOM 255 CH2 TRP H 36 -17.923 -1.178 -86.302 1.00 82.69 C
-ANISOU 255 CH2 TRP H 36 17190 6565 7664 -9 -1445 -421 C
-ATOM 256 N VAL H 37 -23.465 -5.922 -86.669 1.00 57.91 N
-ANISOU 256 N VAL H 37 12025 5203 4775 1570 -1651 -404 N
-ATOM 257 CA VAL H 37 -24.535 -6.636 -85.973 1.00 57.52 C
-ANISOU 257 CA VAL H 37 11632 5472 4752 1745 -1686 -407 C
-ATOM 258 C VAL H 37 -24.530 -6.229 -84.505 1.00 60.95 C
-ANISOU 258 C VAL H 37 12238 5881 5040 1626 -1596 -503 C
-ATOM 259 O VAL H 37 -23.529 -6.428 -83.810 1.00 67.05 O
-ANISOU 259 O VAL H 37 13053 6598 5826 1219 -1662 -516 O
-ATOM 260 CB VAL H 37 -24.381 -8.163 -86.085 1.00 56.85 C
-ANISOU 260 CB VAL H 37 11020 5686 4896 1547 -1875 -339 C
-ATOM 261 CG1 VAL H 37 -25.296 -8.861 -85.081 1.00 54.90 C
-ANISOU 261 CG1 VAL H 37 10456 5748 4654 1590 -1915 -309 C
-ATOM 262 CG2 VAL H 37 -24.678 -8.632 -87.503 1.00 59.97 C
-ANISOU 262 CG2 VAL H 37 11233 6161 5392 1728 -1958 -289 C
-ATOM 263 N ARG H 38 -25.648 -5.701 -84.019 1.00 61.34 N
-ANISOU 263 N ARG H 38 12365 5992 4951 1973 -1452 -579 N
-ATOM 264 CA ARG H 38 -25.758 -5.274 -82.632 1.00 67.71 C
-ANISOU 264 CA ARG H 38 13363 6809 5556 1889 -1319 -718 C
-ATOM 265 C ARG H 38 -26.678 -6.204 -81.850 1.00 73.86 C
-ANISOU 265 C ARG H 38 13710 8040 6313 1917 -1301 -686 C
-ATOM 266 O ARG H 38 -27.531 -6.894 -82.414 1.00 75.00 O
-ANISOU 266 O ARG H 38 13451 8443 6604 2138 -1355 -581 O
-ATOM 267 CB ARG H 38 -26.280 -3.838 -82.536 1.00 73.48 C
-ANISOU 267 CB ARG H 38 14553 7239 6127 2259 -1114 -889 C
-ATOM 268 CG ARG H 38 -27.752 -3.701 -82.861 1.00 69.18 C
-ANISOU 268 CG ARG H 38 13803 6857 5625 2807 -1005 -909 C
-ATOM 269 CD ARG H 38 -28.249 -2.304 -82.558 1.00 73.63 C
-ANISOU 269 CD ARG H 38 14803 7099 6072 3182 -806 -1120 C
-ATOM 270 NE ARG H 38 -29.680 -2.174 -82.804 1.00 76.05 N
-ANISOU 270 NE ARG H 38 14851 7571 6474 3734 -705 -1149 N
-ATOM 271 CZ ARG H 38 -30.355 -1.038 -82.682 1.00 88.88 C
-ANISOU 271 CZ ARG H 38 16748 8934 8090 4188 -545 -1335 C
-ATOM 272 NH1 ARG H 38 -29.725 0.070 -82.318 1.00 88.72 N1+
-ANISOU 272 NH1 ARG H 38 17311 8450 7949 4137 -476 -1514 N1+
-ATOM 273 NH2 ARG H 38 -31.658 -1.007 -82.924 1.00104.51 N
-ANISOU 273 NH2 ARG H 38 18403 11094 10214 4694 -474 -1346 N
-ATOM 274 N GLN H 39 -26.496 -6.206 -80.527 1.00 73.12 N
-ANISOU 274 N GLN H 39 13720 8048 6015 1657 -1234 -768 N
-ATOM 275 CA GLN H 39 -27.315 -7.000 -79.615 1.00 72.08 C
-ANISOU 275 CA GLN H 39 13237 8362 5788 1605 -1183 -726 C
-ATOM 276 C GLN H 39 -27.596 -6.183 -78.364 1.00 72.80 C
-ANISOU 276 C GLN H 39 13668 8473 5521 1614 -921 -952 C
-ATOM 277 O GLN H 39 -26.663 -5.743 -77.687 1.00 86.66 O
-ANISOU 277 O GLN H 39 15810 10018 7097 1284 -953 -1043 O
-ATOM 278 CB GLN H 39 -26.626 -8.316 -79.240 1.00 67.13 C
-ANISOU 278 CB GLN H 39 12293 7932 5280 1104 -1465 -519 C
-ATOM 279 CG GLN H 39 -27.440 -9.180 -78.281 1.00 64.56 C
-ANISOU 279 CG GLN H 39 11622 8069 4839 975 -1443 -417 C
-ATOM 280 CD GLN H 39 -26.698 -10.424 -77.826 1.00 63.84 C
-ANISOU 280 CD GLN H 39 11276 8103 4879 453 -1778 -186 C
-ATOM 281 OE1 GLN H 39 -25.473 -10.416 -77.679 1.00 63.92 O
-ANISOU 281 OE1 GLN H 39 11476 7867 4944 116 -1971 -166 O
-ATOM 282 NE2 GLN H 39 -27.438 -11.509 -77.621 1.00 62.60 N
-ANISOU 282 NE2 GLN H 39 10666 8311 4808 379 -1875 7 N
-ATOM 283 N ALA H 40 -28.888 -5.990 -78.053 1.00 72.82 N
-ANISOU 283 N ALA H 40 13510 8739 5420 1987 -659 -1059 N
-ATOM 284 CA ALA H 40 -29.338 -5.272 -76.873 1.00 77.41 C
-ANISOU 284 CA ALA H 40 14358 9409 5647 2055 -343 -1326 C
-ATOM 285 C ALA H 40 -29.554 -6.239 -75.713 1.00 85.05 C
-ANISOU 285 C ALA H 40 15057 10877 6383 1661 -321 -1225 C
-ATOM 286 O ALA H 40 -29.865 -7.416 -75.929 1.00 99.80 O
-ANISOU 286 O ALA H 40 16422 13070 8428 1523 -489 -953 O
-ATOM 287 CB ALA H 40 -30.635 -4.522 -77.165 1.00 80.95 C
-ANISOU 287 CB ALA H 40 14732 9886 6140 2700 -41 -1518 C
-ATOM 288 N PRO H 41 -29.382 -5.764 -74.479 1.00 81.87 N
-ANISOU 288 N PRO H 41 15009 10529 5567 1447 -135 -1434 N
-ATOM 289 CA PRO H 41 -29.564 -6.640 -73.312 1.00 95.61 C
-ANISOU 289 CA PRO H 41 16555 12763 7011 1014 -116 -1314 C
-ATOM 290 C PRO H 41 -30.943 -7.282 -73.302 1.00101.23 C
-ANISOU 290 C PRO H 41 16697 13994 7770 1254 93 -1219 C
-ATOM 291 O PRO H 41 -31.970 -6.598 -73.340 1.00 97.13 O
-ANISOU 291 O PRO H 41 16122 13569 7213 1753 462 -1463 O
-ATOM 292 CB PRO H 41 -29.369 -5.689 -72.124 1.00100.62 C
-ANISOU 292 CB PRO H 41 17749 13340 7142 896 145 -1660 C
-ATOM 293 CG PRO H 41 -29.528 -4.308 -72.696 1.00 90.02 C
-ANISOU 293 CG PRO H 41 16778 11535 5891 1435 354 -2002 C
-ATOM 294 CD PRO H 41 -28.996 -4.401 -74.082 1.00 85.12 C
-ANISOU 294 CD PRO H 41 16055 10544 5742 1559 45 -1788 C
-ATOM 295 N GLY H 42 -30.956 -8.612 -73.252 1.00 93.97 N
-ANISOU 295 N GLY H 42 15335 13395 6973 892 -166 -857 N
-ATOM 296 CA GLY H 42 -32.185 -9.373 -73.281 1.00 93.17 C
-ANISOU 296 CA GLY H 42 14649 13790 6961 1023 -41 -697 C
-ATOM 297 C GLY H 42 -32.702 -9.703 -74.661 1.00 90.16 C
-ANISOU 297 C GLY H 42 13852 13325 7080 1416 -195 -560 C
-ATOM 298 O GLY H 42 -33.795 -10.271 -74.773 1.00 93.87 O
-ANISOU 298 O GLY H 42 13810 14189 7666 1562 -103 -434 O
-ATOM 299 N HIS H 43 -31.958 -9.370 -75.713 1.00 81.78 N
-ANISOU 299 N HIS H 43 12992 11784 6298 1563 -428 -574 N
-ATOM 300 CA HIS H 43 -32.387 -9.593 -77.085 1.00 82.68 C
-ANISOU 300 CA HIS H 43 12794 11793 6826 1926 -586 -467 C
-ATOM 301 C HIS H 43 -31.321 -10.378 -77.837 1.00 80.59 C
-ANISOU 301 C HIS H 43 12496 11284 6841 1619 -1023 -254 C
-ATOM 302 O HIS H 43 -30.204 -10.583 -77.352 1.00 81.50 O
-ANISOU 302 O HIS H 43 12845 11245 6875 1186 -1196 -209 O
-ATOM 303 CB HIS H 43 -32.673 -8.270 -77.805 1.00 87.43 C
-ANISOU 303 CB HIS H 43 13685 12048 7486 2500 -393 -724 C
-ATOM 304 CG HIS H 43 -33.845 -7.525 -77.253 1.00 94.02 C
-ANISOU 304 CG HIS H 43 14460 13099 8164 2919 30 -962 C
-ATOM 305 ND1 HIS H 43 -33.877 -7.039 -75.965 1.00103.13 N
-ANISOU 305 ND1 HIS H 43 15870 14395 8918 2796 355 -1196 N
-ATOM 306 CD2 HIS H 43 -35.028 -7.181 -77.815 1.00100.48 C
-ANISOU 306 CD2 HIS H 43 14976 14019 9183 3470 181 -1020 C
-ATOM 307 CE1 HIS H 43 -35.030 -6.428 -75.756 1.00114.77 C
-ANISOU 307 CE1 HIS H 43 17189 16055 10362 3273 729 -1419 C
-ATOM 308 NE2 HIS H 43 -35.745 -6.498 -76.863 1.00112.87 N
-ANISOU 308 NE2 HIS H 43 16589 15786 10510 3696 618 -1305 N
-ATOM 309 N GLY H 44 -31.683 -10.813 -79.043 1.00 67.77 N
-ANISOU 309 N GLY H 44 10566 9626 5557 1856 -1205 -138 N
-ATOM 310 CA GLY H 44 -30.790 -11.567 -79.894 1.00 74.19 C
-ANISOU 310 CA GLY H 44 11305 10227 6656 1638 -1577 10 C
-ATOM 311 C GLY H 44 -30.058 -10.687 -80.890 1.00 81.25 C
-ANISOU 311 C GLY H 44 12581 10672 7619 1844 -1590 -128 C
-ATOM 312 O GLY H 44 -30.047 -9.458 -80.802 1.00 82.64 O
-ANISOU 312 O GLY H 44 13155 10629 7614 2084 -1357 -321 O
-ATOM 313 N LEU H 45 -29.437 -11.344 -81.863 1.00 81.06 N
-ANISOU 313 N LEU H 45 12435 10505 7860 1737 -1868 -31 N
-ATOM 314 CA LEU H 45 -28.633 -10.631 -82.845 1.00 78.97 C
-ANISOU 314 CA LEU H 45 12508 9855 7641 1844 -1883 -128 C
-ATOM 315 C LEU H 45 -29.526 -9.905 -83.843 1.00 69.83 C
-ANISOU 315 C LEU H 45 11405 8636 6492 2352 -1781 -176 C
-ATOM 316 O LEU H 45 -30.602 -10.388 -84.207 1.00 65.62 O
-ANISOU 316 O LEU H 45 10507 8356 6071 2580 -1835 -92 O
-ATOM 317 CB LEU H 45 -27.704 -11.603 -83.570 1.00 79.75 C
-ANISOU 317 CB LEU H 45 12429 9864 8010 1572 -2172 -43 C
-ATOM 318 CG LEU H 45 -26.859 -12.468 -82.634 1.00 72.47 C
-ANISOU 318 CG LEU H 45 11377 8988 7172 1084 -2358 45 C
-ATOM 319 CD1 LEU H 45 -25.883 -13.335 -83.420 1.00 74.87 C
-ANISOU 319 CD1 LEU H 45 11499 9146 7801 880 -2624 74 C
-ATOM 320 CD2 LEU H 45 -26.129 -11.591 -81.625 1.00 58.91 C
-ANISOU 320 CD2 LEU H 45 10073 7108 5203 877 -2219 -44 C
-ATOM 321 N GLU H 46 -29.074 -8.730 -84.279 1.00 65.14 N
-ANISOU 321 N GLU H 46 11271 7690 5791 2510 -1665 -288 N
-ATOM 322 CA GLU H 46 -29.831 -7.888 -85.198 1.00 61.74 C
-ANISOU 322 CA GLU H 46 10973 7125 5360 2983 -1604 -309 C
-ATOM 323 C GLU H 46 -28.870 -7.305 -86.221 1.00 64.91 C
-ANISOU 323 C GLU H 46 11756 7157 5751 2927 -1667 -308 C
-ATOM 324 O GLU H 46 -27.920 -6.610 -85.853 1.00 62.36 O
-ANISOU 324 O GLU H 46 11826 6554 5315 2726 -1577 -390 O
-ATOM 325 CB GLU H 46 -30.568 -6.773 -84.447 1.00 65.56 C
-ANISOU 325 CB GLU H 46 11677 7546 5688 3313 -1335 -459 C
-ATOM 326 CG GLU H 46 -31.321 -5.795 -85.336 1.00 99.34 C
-ANISOU 326 CG GLU H 46 16120 11613 10013 3829 -1309 -473 C
-ATOM 327 CD GLU H 46 -32.035 -4.707 -84.547 1.00119.92 C
-ANISOU 327 CD GLU H 46 18919 14120 12523 4193 -1039 -669 C
-ATOM 328 OE1 GLU H 46 -32.134 -4.830 -83.308 1.00120.52 O
-ANISOU 328 OE1 GLU H 46 18933 14396 12462 4058 -840 -801 O
-ATOM 329 OE2 GLU H 46 -32.490 -3.722 -85.167 1.00132.76 O1-
-ANISOU 329 OE2 GLU H 46 20774 15461 14208 4613 -1031 -697 O1-
-ATOM 330 N TRP H 47 -29.109 -7.594 -87.497 1.00 80.72 N
-ANISOU 330 N TRP H 47 13646 9176 7850 3072 -1824 -211 N
-ATOM 331 CA TRP H 47 -28.271 -7.073 -88.569 1.00 73.86 C
-ANISOU 331 CA TRP H 47 13126 8013 6924 3004 -1862 -189 C
-ATOM 332 C TRP H 47 -28.600 -5.606 -88.811 1.00 84.03 C
-ANISOU 332 C TRP H 47 14874 8972 8080 3329 -1752 -201 C
-ATOM 333 O TRP H 47 -29.774 -5.226 -88.875 1.00 94.46 O
-ANISOU 333 O TRP H 47 16122 10340 9430 3750 -1750 -181 O
-ATOM 334 CB TRP H 47 -28.478 -7.889 -89.843 1.00 66.00 C
-ANISOU 334 CB TRP H 47 11883 7174 6018 3038 -2066 -96 C
-ATOM 335 CG TRP H 47 -27.671 -7.450 -91.037 1.00 72.34 C
-ANISOU 335 CG TRP H 47 13020 7754 6711 2941 -2082 -67 C
-ATOM 336 CD1 TRP H 47 -26.359 -7.737 -91.297 1.00 77.10 C
-ANISOU 336 CD1 TRP H 47 13698 8278 7321 2559 -2049 -119 C
-ATOM 337 CD2 TRP H 47 -28.141 -6.688 -92.154 1.00 77.37 C
-ANISOU 337 CD2 TRP H 47 13933 8250 7214 3213 -2140 36 C
-ATOM 338 NE1 TRP H 47 -25.981 -7.182 -92.498 1.00 68.98 N
-ANISOU 338 NE1 TRP H 47 12981 7096 6134 2558 -2035 -64 N
-ATOM 339 CE2 TRP H 47 -27.058 -6.534 -93.043 1.00 74.43 C
-ANISOU 339 CE2 TRP H 47 13826 7737 6718 2943 -2111 48 C
-ATOM 340 CE3 TRP H 47 -29.372 -6.113 -92.485 1.00 75.89 C
-ANISOU 340 CE3 TRP H 47 13782 8043 7010 3654 -2225 132 C
-ATOM 341 CZ2 TRP H 47 -27.171 -5.832 -94.239 1.00 85.16 C
-ANISOU 341 CZ2 TRP H 47 15527 8948 7882 3062 -2166 176 C
-ATOM 342 CZ3 TRP H 47 -29.480 -5.415 -93.668 1.00 77.89 C
-ANISOU 342 CZ3 TRP H 47 14368 8112 7115 3798 -2327 266 C
-ATOM 343 CH2 TRP H 47 -28.387 -5.279 -94.531 1.00 90.35 C
-ANISOU 343 CH2 TRP H 47 16251 9562 8517 3485 -2299 298 C
-ATOM 344 N MET H 48 -27.563 -4.782 -88.935 1.00 80.19 N
-ANISOU 344 N MET H 48 14846 8139 7485 3131 -1678 -226 N
-ATOM 345 CA MET H 48 -27.729 -3.353 -89.172 1.00 73.25 C
-ANISOU 345 CA MET H 48 14467 6864 6502 3385 -1611 -221 C
-ATOM 346 C MET H 48 -27.388 -2.921 -90.587 1.00 79.89 C
-ANISOU 346 C MET H 48 15585 7502 7266 3381 -1718 -61 C
-ATOM 347 O MET H 48 -28.049 -2.030 -91.125 1.00 75.99 O
-ANISOU 347 O MET H 48 15352 6780 6739 3728 -1776 27 O
-ATOM 348 CB MET H 48 -26.878 -2.548 -88.190 1.00 74.86 C
-ANISOU 348 CB MET H 48 15065 6766 6614 3153 -1460 -356 C
-ATOM 349 CG MET H 48 -27.393 -2.571 -86.773 1.00 84.04 C
-ANISOU 349 CG MET H 48 16116 8060 7758 3237 -1324 -534 C
-ATOM 350 SD MET H 48 -26.420 -1.470 -85.741 1.00 91.15 S
-ANISOU 350 SD MET H 48 17585 8545 8505 2974 -1189 -712 S
-ATOM 351 CE MET H 48 -24.804 -2.202 -85.949 1.00 91.57 C
-ANISOU 351 CE MET H 48 17568 8631 8594 2329 -1299 -612 C
-ATOM 352 N GLY H 49 -26.373 -3.514 -91.203 1.00 81.95 N
-ANISOU 352 N GLY H 49 15798 7839 7499 2995 -1746 -18 N
-ATOM 353 CA GLY H 49 -26.002 -3.112 -92.546 1.00 82.38 C
-ANISOU 353 CA GLY H 49 16134 7751 7416 2935 -1806 132 C
-ATOM 354 C GLY H 49 -24.739 -3.806 -93.007 1.00 75.57 C
-ANISOU 354 C GLY H 49 15169 7008 6536 2469 -1754 106 C
-ATOM 355 O GLY H 49 -23.990 -4.399 -92.217 1.00 79.92 O
-ANISOU 355 O GLY H 49 15500 7651 7214 2175 -1687 -16 O
-ATOM 356 N TRP H 50 -24.515 -3.708 -94.315 1.00 78.11 N
-ANISOU 356 N TRP H 50 15652 7329 6695 2404 -1790 225 N
-ATOM 357 CA TRP H 50 -23.364 -4.296 -94.983 1.00 78.69 C
-ANISOU 357 CA TRP H 50 15635 7537 6725 1999 -1699 182 C
-ATOM 358 C TRP H 50 -22.737 -3.262 -95.907 1.00 79.21 C
-ANISOU 358 C TRP H 50 16204 7357 6535 1819 -1614 345 C
-ATOM 359 O TRP H 50 -23.447 -2.475 -96.546 1.00 70.93 O
-ANISOU 359 O TRP H 50 15496 6145 5311 2061 -1724 529 O
-ATOM 360 CB TRP H 50 -23.770 -5.547 -95.776 1.00 77.00 C
-ANISOU 360 CB TRP H 50 15026 7697 6534 2061 -1815 125 C
-ATOM 361 CG TRP H 50 -22.639 -6.216 -96.493 1.00 79.78 C
-ANISOU 361 CG TRP H 50 15250 8206 6858 1694 -1694 17 C
-ATOM 362 CD1 TRP H 50 -21.623 -6.933 -95.932 1.00 83.04 C
-ANISOU 362 CD1 TRP H 50 15352 8696 7504 1393 -1592 -154 C
-ATOM 363 CD2 TRP H 50 -22.422 -6.255 -97.909 1.00 79.73 C
-ANISOU 363 CD2 TRP H 50 15401 8314 6581 1597 -1658 56 C
-ATOM 364 NE1 TRP H 50 -20.778 -7.403 -96.908 1.00 80.38 N
-ANISOU 364 NE1 TRP H 50 14937 8507 7098 1145 -1466 -252 N
-ATOM 365 CE2 TRP H 50 -21.247 -7.001 -98.130 1.00 83.59 C
-ANISOU 365 CE2 TRP H 50 15642 8957 7161 1251 -1483 -136 C
-ATOM 366 CE3 TRP H 50 -23.101 -5.726 -99.009 1.00 78.18 C
-ANISOU 366 CE3 TRP H 50 15534 8108 6063 1762 -1767 238 C
-ATOM 367 CZ2 TRP H 50 -20.740 -7.231 -99.404 1.00 87.05 C
-ANISOU 367 CZ2 TRP H 50 16154 9570 7353 1067 -1357 -189 C
-ATOM 368 CZ3 TRP H 50 -22.595 -5.955-100.272 1.00 85.71 C
-ANISOU 368 CZ3 TRP H 50 16600 9235 6733 1543 -1678 222 C
-ATOM 369 CH2 TRP H 50 -21.426 -6.702-100.460 1.00 86.43 C
-ANISOU 369 CH2 TRP H 50 16439 9507 6892 1200 -1448 -9 C
-ATOM 370 N ILE H 51 -21.404 -3.259 -95.961 1.00 78.85 N
-ANISOU 370 N ILE H 51 16191 7282 6486 1379 -1433 297 N
-ATOM 371 CA ILE H 51 -20.645 -2.355 -96.815 1.00 71.18 C
-ANISOU 371 CA ILE H 51 15656 6121 5269 1103 -1314 462 C
-ATOM 372 C ILE H 51 -19.567 -3.149 -97.541 1.00 89.22 C
-ANISOU 372 C ILE H 51 17683 8695 7520 721 -1129 356 C
-ATOM 373 O ILE H 51 -18.902 -4.013 -96.952 1.00 92.53 O
-ANISOU 373 O ILE H 51 17676 9275 8204 546 -1055 151 O
-ATOM 374 CB ILE H 51 -20.024 -1.183 -96.023 1.00 72.80 C
-ANISOU 374 CB ILE H 51 16243 5904 5513 915 -1244 529 C
-ATOM 375 CG1 ILE H 51 -19.273 -0.239 -96.969 1.00 76.69 C
-ANISOU 375 CG1 ILE H 51 17196 6195 5748 590 -1138 750 C
-ATOM 376 CG2 ILE H 51 -19.092 -1.693 -94.938 1.00 70.28 C
-ANISOU 376 CG2 ILE H 51 15609 5636 5459 623 -1149 335 C
-ATOM 377 CD1 ILE H 51 -18.719 1.003 -96.304 1.00 79.03 C
-ANISOU 377 CD1 ILE H 51 17931 6018 6078 392 -1116 846 C
-ATOM 378 N SER H 52 -19.415 -2.858 -98.832 1.00 87.44 N
-ANISOU 378 N SER H 52 17717 8538 6967 597 -1059 493 N
-ATOM 379 CA SER H 52 -18.427 -3.477 -99.706 1.00 89.95 C
-ANISOU 379 CA SER H 52 17849 9151 7176 242 -826 381 C
-ATOM 380 C SER H 52 -17.391 -2.418-100.063 1.00 93.42 C
-ANISOU 380 C SER H 52 18677 9394 7425 -182 -612 565 C
-ATOM 381 O SER H 52 -17.695 -1.469-100.793 1.00 93.74 O
-ANISOU 381 O SER H 52 19224 9264 7127 -196 -659 845 O
-ATOM 382 CB SER H 52 -19.097 -4.043-100.957 1.00 87.92 C
-ANISOU 382 CB SER H 52 17591 9191 6623 393 -899 378 C
-ATOM 383 OG SER H 52 -18.185 -4.154-102.036 1.00 94.13 O
-ANISOU 383 OG SER H 52 18435 10199 7131 24 -630 343 O
-ATOM 384 N ALA H 53 -16.171 -2.579 -99.541 1.00 94.99 N
-ANISOU 384 N ALA H 53 18629 9605 7859 -544 -405 435 N
-ATOM 385 CA ALA H 53 -15.110 -1.617 -99.823 1.00 96.41 C
-ANISOU 385 CA ALA H 53 19114 9617 7900 -1004 -193 613 C
-ATOM 386 C ALA H 53 -14.776 -1.564-101.307 1.00108.39 C
-ANISOU 386 C ALA H 53 20797 11392 8993 -1249 27 712 C
-ATOM 387 O ALA H 53 -14.378 -0.510-101.817 1.00112.08 O
-ANISOU 387 O ALA H 53 21722 11680 9184 -1551 121 996 O
-ATOM 388 CB ALA H 53 -13.860 -1.963 -99.015 1.00 90.11 C
-ANISOU 388 CB ALA H 53 17912 8845 7481 -1347 -32 433 C
-ATOM 389 N TYR H 54 -14.929 -2.687-102.012 1.00110.47 N
-ANISOU 389 N TYR H 54 20718 12074 9182 -1148 108 482 N
-ATOM 390 CA TYR H 54 -14.647 -2.727-103.443 1.00103.52 C
-ANISOU 390 CA TYR H 54 19999 11498 7837 -1382 338 526 C
-ATOM 391 C TYR H 54 -15.550 -1.764-104.203 1.00110.21 C
-ANISOU 391 C TYR H 54 21495 12169 8210 -1275 131 907 C
-ATOM 392 O TYR H 54 -15.078 -0.821-104.848 1.00117.17 O
-ANISOU 392 O TYR H 54 22815 12958 8747 -1630 264 1200 O
-ATOM 393 CB TYR H 54 -14.819 -4.156-103.962 1.00 97.44 C
-ANISOU 393 CB TYR H 54 18765 11163 7094 -1218 399 155 C
-ATOM 394 CG TYR H 54 -14.208 -4.402-105.320 1.00116.50 C
-ANISOU 394 CG TYR H 54 21219 13969 9076 -1532 747 64 C
-ATOM 395 CD1 TYR H 54 -12.858 -4.703-105.449 1.00129.07 C
-ANISOU 395 CD1 TYR H 54 22460 15781 10800 -1919 1171 -151 C
-ATOM 396 CD2 TYR H 54 -14.980 -4.347-106.472 1.00129.24 C
-ANISOU 396 CD2 TYR H 54 23205 15755 10143 -1448 654 183 C
-ATOM 397 CE1 TYR H 54 -12.289 -4.932-106.690 1.00136.93 C
-ANISOU 397 CE1 TYR H 54 23476 17179 11374 -2212 1550 -272 C
-ATOM 398 CE2 TYR H 54 -14.420 -4.575-107.719 1.00145.00 C
-ANISOU 398 CE2 TYR H 54 25274 18148 11674 -1765 996 80 C
-ATOM 399 CZ TYR H 54 -13.074 -4.867-107.821 1.00146.56 C
-ANISOU 399 CZ TYR H 54 25115 18579 11992 -2143 1471 -162 C
-ATOM 400 OH TYR H 54 -12.511 -5.096-109.057 1.00154.59 O
-ANISOU 400 OH TYR H 54 26186 20029 12521 -2461 1869 -301 O
-ATOM 401 N ASN H 55 -16.860 -1.983-104.125 1.00110.31 N
-ANISOU 401 N ASN H 55 21565 12125 8224 -796 -221 933 N
-ATOM 402 CA ASN H 55 -17.821 -1.194-104.882 1.00106.22 C
-ANISOU 402 CA ASN H 55 21600 11452 7307 -633 -485 1287 C
-ATOM 403 C ASN H 55 -18.249 0.084-104.173 1.00103.74 C
-ANISOU 403 C ASN H 55 21711 10583 7121 -484 -724 1596 C
-ATOM 404 O ASN H 55 -18.749 1.002-104.833 1.00 97.97 O
-ANISOU 404 O ASN H 55 21346 9659 6222 -454 -898 1894 O
-ATOM 405 CB ASN H 55 -19.061 -2.040-105.186 1.00103.37 C
-ANISOU 405 CB ASN H 55 21060 11299 6915 -183 -777 1172 C
-ATOM 406 CG ASN H 55 -18.711 -3.433-105.673 1.00103.12 C
-ANISOU 406 CG ASN H 55 20556 11758 6867 -261 -586 780 C
-ATOM 407 N GLY H 56 -18.059 0.176-102.860 1.00107.64 N
-ANISOU 407 N GLY H 56 22002 10832 8063 -391 -732 1460 N
-ATOM 408 CA GLY H 56 -18.651 1.261-102.108 1.00104.21 C
-ANISOU 408 CA GLY H 56 21937 9877 7780 -147 -977 1660 C
-ATOM 409 C GLY H 56 -20.124 1.083-101.826 1.00 96.58 C
-ANISOU 409 C GLY H 56 20872 8860 6965 453 -1305 1630 C
-ATOM 410 O GLY H 56 -20.748 1.991-101.264 1.00 90.86 O
-ANISOU 410 O GLY H 56 20300 7753 6468 714 -1482 1700 O
-ATOM 411 N TYR H 57 -20.695 -0.061-102.201 1.00 91.40 N
-ANISOU 411 N TYR H 57 19862 8606 6262 665 -1371 1468 N
-ATOM 412 CA TYR H 57 -22.110 -0.322-101.983 1.00 86.20 C
-ANISOU 412 CA TYR H 57 18971 7967 5813 1194 -1663 1422 C
-ATOM 413 C TYR H 57 -22.404 -0.434-100.494 1.00 98.74 C
-ANISOU 413 C TYR H 57 20368 9385 7764 1470 -1707 1262 C
-ATOM 414 O TYR H 57 -21.598 -0.960 -99.721 1.00108.82 O
-ANISOU 414 O TYR H 57 21333 10759 9256 1251 -1507 1031 O
-ATOM 415 CB TYR H 57 -22.523 -1.606-102.705 1.00 84.76 C
-ANISOU 415 CB TYR H 57 18439 8261 5505 1279 -1723 1270 C
-ATOM 416 CG TYR H 57 -24.000 -1.941-102.622 1.00 84.01 C
-ANISOU 416 CG TYR H 57 18045 8237 5637 1762 -2026 1245 C
-ATOM 417 CD1 TYR H 57 -24.920 -1.327-103.464 1.00 92.02 C
-ANISOU 417 CD1 TYR H 57 19189 9185 6590 1923 -2248 1455 C
-ATOM 418 CD2 TYR H 57 -24.471 -2.894-101.726 1.00 79.84 C
-ANISOU 418 CD2 TYR H 57 17079 7866 5390 2020 -2096 1025 C
-ATOM 419 CE1 TYR H 57 -26.270 -1.634-103.402 1.00 94.46 C
-ANISOU 419 CE1 TYR H 57 19184 9581 7124 2329 -2513 1437 C
-ATOM 420 CE2 TYR H 57 -25.820 -3.209-101.657 1.00 89.05 C
-ANISOU 420 CE2 TYR H 57 17925 9130 6779 2411 -2342 1012 C
-ATOM 421 CZ TYR H 57 -26.714 -2.577-102.499 1.00100.38 C
-ANISOU 421 CZ TYR H 57 19481 10500 8159 2563 -2540 1211 C
-ATOM 422 OH TYR H 57 -28.056 -2.886-102.435 1.00106.54 O
-ANISOU 422 OH TYR H 57 19909 11396 9176 2920 -2775 1203 O
-ATOM 423 N THR H 58 -23.562 0.079-100.092 1.00 98.17 N
-ANISOU 423 N THR H 58 20250 9126 7924 1894 -1909 1286 N
-ATOM 424 CA THR H 58 -24.006 0.009 -98.708 1.00 90.97 C
-ANISOU 424 CA THR H 58 19144 8096 7324 2184 -1931 1118 C
-ATOM 425 C THR H 58 -25.473 -0.383 -98.683 1.00 89.31 C
-ANISOU 425 C THR H 58 18568 8069 7298 2656 -2134 1064 C
-ATOM 426 O THR H 58 -26.245 0.027 -99.553 1.00103.83 O
-ANISOU 426 O THR H 58 20457 9903 9092 2811 -2299 1208 O
-ATOM 427 CB THR H 58 -23.816 1.346 -97.978 1.00 87.91 C
-ANISOU 427 CB THR H 58 19126 7224 7052 2185 -1893 1156 C
-ATOM 428 OG1 THR H 58 -24.442 2.399 -98.724 1.00 87.98 O
-ANISOU 428 OG1 THR H 58 19389 7016 7024 2324 -2045 1342 O
-ATOM 429 CG2 THR H 58 -22.338 1.659 -97.797 1.00 88.77 C
-ANISOU 429 CG2 THR H 58 19525 7153 7049 1674 -1692 1193 C
-ATOM 430 N ASN H 59 -25.854 -1.181 -97.689 1.00 81.28 N
-ANISOU 430 N ASN H 59 17168 7224 6492 2850 -2131 877 N
-ATOM 431 CA ASN H 59 -27.260 -1.509 -97.490 1.00 85.52 C
-ANISOU 431 CA ASN H 59 17313 7941 7242 3270 -2286 823 C
-ATOM 432 C ASN H 59 -27.549 -1.540 -95.997 1.00 89.47 C
-ANISOU 432 C ASN H 59 17643 8384 7966 3473 -2204 657 C
-ATOM 433 O ASN H 59 -26.863 -2.237 -95.242 1.00 72.11 O
-ANISOU 433 O ASN H 59 15306 6290 5801 3279 -2099 532 O
-ATOM 434 CB ASN H 59 -27.620 -2.846 -98.151 1.00 88.66 C
-ANISOU 434 CB ASN H 59 17280 8781 7625 3254 -2400 777 C
-ATOM 435 CG ASN H 59 -29.096 -2.951 -98.493 1.00 91.56 C
-ANISOU 435 CG ASN H 59 17326 9306 8155 3597 -2602 822 C
-ATOM 436 OD1 ASN H 59 -29.961 -2.660 -97.668 1.00 92.46 O
-ANISOU 436 OD1 ASN H 59 17254 9379 8500 3906 -2613 776 O
-ATOM 437 ND2 ASN H 59 -29.390 -3.351 -99.725 1.00 92.05 N
-ANISOU 437 ND2 ASN H 59 17330 9561 8084 3527 -2756 913 N
-ATOM 438 N TYR H 60 -28.551 -0.769 -95.578 1.00 94.79 N
-ANISOU 438 N TYR H 60 18312 8910 8794 3838 -2244 646 N
-ATOM 439 CA TYR H 60 -28.915 -0.611 -94.179 1.00 82.84 C
-ANISOU 439 CA TYR H 60 16704 7327 7445 4066 -2134 476 C
-ATOM 440 C TYR H 60 -30.318 -1.153 -93.944 1.00 83.36 C
-ANISOU 440 C TYR H 60 16253 7709 7710 4447 -2216 429 C
-ATOM 441 O TYR H 60 -31.123 -1.277 -94.870 1.00104.47 O
-ANISOU 441 O TYR H 60 18720 10539 10433 4575 -2383 544 O
-ATOM 442 CB TYR H 60 -28.857 0.861 -93.752 1.00 81.49 C
-ANISOU 442 CB TYR H 60 16981 6692 7290 4173 -2064 454 C
-ATOM 443 CG TYR H 60 -27.585 1.570 -94.154 1.00 82.32 C
-ANISOU 443 CG TYR H 60 17595 6465 7218 3769 -2013 549 C
-ATOM 444 CD1 TYR H 60 -26.345 0.965 -93.999 1.00 80.01 C
-ANISOU 444 CD1 TYR H 60 17373 6216 6812 3345 -1908 532 C
-ATOM 445 CD2 TYR H 60 -27.628 2.840 -94.708 1.00 86.87 C
-ANISOU 445 CD2 TYR H 60 18555 6687 7766 3790 -2085 677 C
-ATOM 446 CE1 TYR H 60 -25.182 1.615 -94.375 1.00 80.23 C
-ANISOU 446 CE1 TYR H 60 17822 5966 6695 2940 -1842 633 C
-ATOM 447 CE2 TYR H 60 -26.476 3.496 -95.086 1.00 88.08 C
-ANISOU 447 CE2 TYR H 60 19148 6556 7762 3382 -2039 789 C
-ATOM 448 CZ TYR H 60 -25.256 2.881 -94.919 1.00 84.75 C
-ANISOU 448 CZ TYR H 60 18768 6209 7223 2950 -1902 763 C
-ATOM 449 OH TYR H 60 -24.109 3.541 -95.299 1.00 90.85 O
-ANISOU 449 OH TYR H 60 19935 6727 7858 2511 -1838 886 O
-ATOM 450 N ALA H 61 -30.607 -1.468 -92.687 1.00 76.80 N
-ANISOU 450 N ALA H 61 15220 6972 6990 4603 -2098 269 N
-ATOM 451 CA ALA H 61 -31.918 -1.979 -92.320 1.00 82.65 C
-ANISOU 451 CA ALA H 61 15445 8035 7924 4946 -2134 226 C
-ATOM 452 C ALA H 61 -32.911 -0.832 -92.210 1.00 82.53 C
-ANISOU 452 C ALA H 61 15498 7811 8048 5361 -2118 207 C
-ATOM 453 O ALA H 61 -32.610 0.205 -91.611 1.00 84.76 O
-ANISOU 453 O ALA H 61 16172 7727 8306 5443 -1984 101 O
-ATOM 454 CB ALA H 61 -31.845 -2.746 -91.001 1.00 75.04 C
-ANISOU 454 CB ALA H 61 14225 7288 6999 4919 -1989 70 C
-ATOM 455 N GLN H 62 -34.096 -1.016 -92.794 1.00104.30 N
-ANISOU 455 N GLN H 62 17860 10789 10979 5600 -2268 303 N
-ATOM 456 CA GLN H 62 -35.142 -0.007 -92.686 1.00103.92 C
-ANISOU 456 CA GLN H 62 17780 10567 11138 6024 -2277 291 C
-ATOM 457 C GLN H 62 -35.635 0.167 -91.256 1.00102.04 C
-ANISOU 457 C GLN H 62 17391 10363 11017 6344 -2023 49 C
-ATOM 458 O GLN H 62 -36.318 1.156 -90.968 1.00 96.22 O
-ANISOU 458 O GLN H 62 16699 9407 10452 6698 -1962 -35 O
-ATOM 459 CB GLN H 62 -36.315 -0.361 -93.607 1.00101.59 C
-ANISOU 459 CB GLN H 62 17040 10522 11039 6176 -2514 465 C
-ATOM 460 N LYS H 63 -35.301 -0.759 -90.357 1.00 96.62 N
-ANISOU 460 N LYS H 63 16529 9940 10243 6230 -1873 -73 N
-ATOM 461 CA LYS H 63 -35.677 -0.634 -88.956 1.00 97.72 C
-ANISOU 461 CA LYS H 63 16569 10137 10421 6506 -1589 -330 C
-ATOM 462 C LYS H 63 -34.934 0.489 -88.243 1.00106.70 C
-ANISOU 462 C LYS H 63 18298 10808 11433 6480 -1385 -542 C
-ATOM 463 O LYS H 63 -35.349 0.882 -87.147 1.00119.53 O
-ANISOU 463 O LYS H 63 19905 12427 13085 6731 -1116 -813 O
-ATOM 464 CB LYS H 63 -35.429 -1.959 -88.229 1.00 84.92 C
-ANISOU 464 CB LYS H 63 14585 8969 8711 6219 -1493 -372 C
-ATOM 465 N LEU H 64 -33.863 1.020 -88.830 1.00101.82 N
-ANISOU 465 N LEU H 64 18185 9827 10673 6149 -1491 -441 N
-ATOM 466 CA LEU H 64 -33.036 2.022 -88.175 1.00 91.40 C
-ANISOU 466 CA LEU H 64 17422 8074 9233 6006 -1335 -617 C
-ATOM 467 C LEU H 64 -33.308 3.437 -88.668 1.00 96.71 C
-ANISOU 467 C LEU H 64 18392 8326 10026 6184 -1418 -579 C
-ATOM 468 O LEU H 64 -32.535 4.347 -88.354 1.00108.68 O
-ANISOU 468 O LEU H 64 20396 9444 11452 5999 -1360 -666 O
-ATOM 469 CB LEU H 64 -31.558 1.670 -88.348 1.00 87.09 C
-ANISOU 469 CB LEU H 64 17219 7401 8471 5465 -1380 -536 C
-ATOM 470 CG LEU H 64 -31.197 0.338 -87.683 1.00 86.28 C
-ANISOU 470 CG LEU H 64 16742 7753 8286 5135 -1288 -596 C
-ATOM 471 CD1 LEU H 64 -29.736 -0.016 -87.868 1.00 78.72 C
-ANISOU 471 CD1 LEU H 64 15989 6737 7183 4531 -1331 -520 C
-ATOM 472 CD2 LEU H 64 -31.553 0.358 -86.200 1.00 96.14 C
-ANISOU 472 CD2 LEU H 64 17873 9163 9491 5201 -1011 -890 C
-ATOM 473 N GLN H 65 -34.388 3.640 -89.429 1.00 85.97 N
-ANISOU 473 N GLN H 65 15987 9972 6705 4742 -2025 -640 N
-ATOM 474 CA GLN H 65 -34.842 4.969 -89.849 1.00 89.82 C
-ANISOU 474 CA GLN H 65 16807 10286 7035 5334 -2145 -620 C
-ATOM 475 C GLN H 65 -33.742 5.761 -90.550 1.00 89.43 C
-ANISOU 475 C GLN H 65 17371 9579 7030 5248 -2206 -457 C
-ATOM 476 O GLN H 65 -33.694 6.989 -90.464 1.00 92.40 O
-ANISOU 476 O GLN H 65 18243 9546 7321 5618 -2241 -444 O
-ATOM 477 CB GLN H 65 -35.395 5.766 -88.665 1.00 92.74 C
-ANISOU 477 CB GLN H 65 17281 10654 7300 5769 -2093 -778 C
-ATOM 478 CG GLN H 65 -36.680 5.212 -88.068 1.00107.37 C
-ANISOU 478 CG GLN H 65 18523 13226 9047 5978 -2026 -933 C
-ATOM 479 CD GLN H 65 -36.459 4.548 -86.716 1.00108.92 C
-ANISOU 479 CD GLN H 65 18540 13527 9319 5641 -1850 -1042 C
-ATOM 480 OE1 GLN H 65 -35.329 4.238 -86.341 1.00109.96 O
-ANISOU 480 OE1 GLN H 65 18905 13281 9594 5193 -1797 -990 O
-ATOM 481 NE2 GLN H 65 -37.542 4.339 -85.974 1.00101.23 N
-ANISOU 481 NE2 GLN H 65 17136 13107 8221 5878 -1754 -1186 N
-ATOM 482 N GLY H 66 -32.845 5.063 -91.242 1.00102.14 N
-ANISOU 482 N GLY H 66 18971 11073 8764 4751 -2197 -336 N
-ATOM 483 CA GLY H 66 -31.794 5.735 -91.987 1.00102.92 C
-ANISOU 483 CA GLY H 66 19592 10622 8893 4610 -2229 -170 C
-ATOM 484 C GLY H 66 -30.849 6.552 -91.138 1.00100.96 C
-ANISOU 484 C GLY H 66 19823 9821 8714 4466 -2167 -208 C
-ATOM 485 O GLY H 66 -30.272 7.529 -91.628 1.00 88.24 O
-ANISOU 485 O GLY H 66 18746 7706 7075 4494 -2186 -100 O
-ATOM 486 N ARG H 67 -30.679 6.183 -89.872 1.00111.32 N
-ANISOU 486 N ARG H 67 20972 11223 10099 4291 -2087 -365 N
-ATOM 487 CA ARG H 67 -29.761 6.864 -88.970 1.00103.98 C
-ANISOU 487 CA ARG H 67 20436 9854 9216 4100 -2043 -452 C
-ATOM 488 C ARG H 67 -28.335 6.336 -89.066 1.00108.95 C
-ANISOU 488 C ARG H 67 21080 10327 9988 3488 -2001 -378 C
-ATOM 489 O ARG H 67 -27.461 6.826 -88.346 1.00 82.64 O
-ANISOU 489 O ARG H 67 18014 6699 6687 3249 -1976 -466 O
-ATOM 490 CB ARG H 67 -30.246 6.733 -87.523 1.00 85.63 C
-ANISOU 490 CB ARG H 67 17923 7761 6851 4237 -1984 -663 C
-ATOM 491 CG ARG H 67 -31.629 7.305 -87.252 1.00 91.35 C
-ANISOU 491 CG ARG H 67 18605 8690 7413 4875 -2003 -771 C
-ATOM 492 CD ARG H 67 -32.081 6.956 -85.841 1.00 89.30 C
-ANISOU 492 CD ARG H 67 18069 8757 7102 4945 -1913 -967 C
-ATOM 493 NE ARG H 67 -32.252 5.516 -85.677 1.00 86.09 N
-ANISOU 493 NE ARG H 67 17084 8860 6767 4632 -1838 -929 N
-ATOM 494 CZ ARG H 67 -32.269 4.889 -84.505 1.00 85.12 C
-ANISOU 494 CZ ARG H 67 16719 8994 6629 4485 -1727 -1027 C
-ATOM 495 NH1 ARG H 67 -32.116 5.573 -83.380 1.00 94.91 N1+
-ANISOU 495 NH1 ARG H 67 18206 10081 7776 4626 -1697 -1192 N1+
-ATOM 496 NH2 ARG H 67 -32.430 3.574 -84.459 1.00 82.73 N
-ANISOU 496 NH2 ARG H 67 15964 9082 6389 4193 -1637 -961 N
-ATOM 497 N VAL H 68 -28.076 5.361 -89.936 1.00109.79 N
-ANISOU 497 N VAL H 68 20899 10653 10163 3239 -1994 -240 N
-ATOM 498 CA VAL H 68 -26.792 4.672 -89.978 1.00 97.49 C
-ANISOU 498 CA VAL H 68 19258 9059 8724 2723 -1940 -179 C
-ATOM 499 C VAL H 68 -25.982 5.184 -91.156 1.00102.65 C
-ANISOU 499 C VAL H 68 20224 9393 9386 2533 -1954 -13 C
-ATOM 500 O VAL H 68 -26.526 5.565 -92.200 1.00110.02 O
-ANISOU 500 O VAL H 68 21297 10269 10238 2776 -2002 103 O
-ATOM 501 CB VAL H 68 -26.986 3.146 -90.064 1.00 83.09 C
-ANISOU 501 CB VAL H 68 16933 7674 6964 2569 -1886 -152 C
-ATOM 502 CG1 VAL H 68 -25.739 2.423 -89.575 1.00 71.31 C
-ANISOU 502 CG1 VAL H 68 15339 6190 5566 2156 -1816 -135 C
-ATOM 503 CG2 VAL H 68 -28.204 2.738 -89.276 1.00 78.42 C
-ANISOU 503 CG2 VAL H 68 16041 7433 6322 2834 -1861 -275 C
-ATOM 504 N THR H 69 -24.661 5.190 -90.988 1.00102.81 N
-ANISOU 504 N THR H 69 20337 9248 9480 2100 -1906 3 N
-ATOM 505 CA THR H 69 -23.753 5.618 -92.050 1.00101.20 C
-ANISOU 505 CA THR H 69 20392 8780 9279 1834 -1880 162 C
-ATOM 506 C THR H 69 -22.456 4.836 -91.898 1.00 94.62 C
-ANISOU 506 C THR H 69 19310 8108 8535 1366 -1815 174 C
-ATOM 507 O THR H 69 -21.731 5.023 -90.917 1.00 91.40 O
-ANISOU 507 O THR H 69 18908 7666 8154 1138 -1805 50 O
-ATOM 508 CB THR H 69 -23.498 7.123 -91.988 1.00101.83 C
-ANISOU 508 CB THR H 69 21054 8331 9305 1833 -1880 149 C
-ATOM 509 OG1 THR H 69 -24.717 7.831 -92.244 1.00111.05 O
-ANISOU 509 OG1 THR H 69 22475 9355 10362 2366 -1938 168 O
-ATOM 510 CG2 THR H 69 -22.460 7.526 -93.021 1.00 91.69 C
-ANISOU 510 CG2 THR H 69 20030 6789 8020 1466 -1813 326 C
-ATOM 511 N MET H 70 -22.164 3.969 -92.862 1.00 88.92 N
-ANISOU 511 N MET H 70 18364 7589 7831 1252 -1775 307 N
-ATOM 512 CA MET H 70 -20.956 3.155 -92.839 1.00 80.38 C
-ANISOU 512 CA MET H 70 17029 6701 6812 893 -1703 333 C
-ATOM 513 C MET H 70 -19.956 3.701 -93.846 1.00 87.91 C
-ANISOU 513 C MET H 70 18189 7476 7738 594 -1642 470 C
-ATOM 514 O MET H 70 -20.321 4.015 -94.983 1.00 94.19 O
-ANISOU 514 O MET H 70 19176 8149 8465 703 -1637 610 O
-ATOM 515 CB MET H 70 -21.272 1.694 -93.156 1.00 68.88 C
-ANISOU 515 CB MET H 70 15190 5595 5387 973 -1668 365 C
-ATOM 516 CG MET H 70 -22.160 1.034 -92.129 1.00 73.28 C
-ANISOU 516 CG MET H 70 15524 6350 5969 1181 -1683 247 C
-ATOM 517 SD MET H 70 -22.578 -0.667 -92.522 1.00 71.91 S
-ANISOU 517 SD MET H 70 14991 6496 5834 1208 -1607 274 S
-ATOM 518 CE MET H 70 -23.594 -1.057 -91.104 1.00 73.27 C
-ANISOU 518 CE MET H 70 14995 6832 6014 1395 -1597 145 C
-ATOM 519 N THR H 71 -18.700 3.815 -93.426 1.00 92.61 N
-ANISOU 519 N THR H 71 18725 8101 8361 217 -1593 431 N
-ATOM 520 CA THR H 71 -17.621 4.264 -94.290 1.00 95.21 C
-ANISOU 520 CA THR H 71 19180 8337 8660 -147 -1502 550 C
-ATOM 521 C THR H 71 -16.458 3.288 -94.183 1.00 99.78 C
-ANISOU 521 C THR H 71 19329 9317 9264 -396 -1436 544 C
-ATOM 522 O THR H 71 -16.440 2.394 -93.331 1.00101.04 O
-ANISOU 522 O THR H 71 19170 9760 9461 -285 -1468 451 O
-ATOM 523 CB THR H 71 -17.164 5.688 -93.939 1.00102.32 C
-ANISOU 523 CB THR H 71 20496 8842 9540 -429 -1491 491 C
-ATOM 524 OG1 THR H 71 -16.855 5.767 -92.543 1.00113.94 O
-ANISOU 524 OG1 THR H 71 21847 10400 11044 -542 -1552 269 O
-ATOM 525 CG2 THR H 71 -18.256 6.693 -94.267 1.00104.99 C
-ANISOU 525 CG2 THR H 71 21337 8732 9823 -117 -1530 543 C
-ATOM 526 N THR H 72 -15.472 3.478 -95.058 1.00104.79 N
-ANISOU 526 N THR H 72 19971 9989 9858 -711 -1329 657 N
-ATOM 527 CA THR H 72 -14.364 2.541 -95.174 1.00108.40 C
-ANISOU 527 CA THR H 72 20006 10873 10308 -881 -1249 672 C
-ATOM 528 C THR H 72 -13.112 3.270 -95.638 1.00112.85 C
-ANISOU 528 C THR H 72 20604 11457 10818 -1368 -1137 720 C
-ATOM 529 O THR H 72 -13.155 4.019 -96.619 1.00131.42 O
-ANISOU 529 O THR H 72 23284 13535 13114 -1505 -1056 860 O
-ATOM 530 CB THR H 72 -14.713 1.414 -96.153 1.00113.35 C
-ANISOU 530 CB THR H 72 20470 11682 10914 -622 -1194 785 C
-ATOM 531 OG1 THR H 72 -15.571 0.466 -95.508 1.00111.24 O
-ANISOU 531 OG1 THR H 72 20044 11516 10705 -281 -1265 705 O
-ATOM 532 CG2 THR H 72 -13.460 0.720 -96.638 1.00122.12 C
-ANISOU 532 CG2 THR H 72 21258 13162 11980 -803 -1067 837 C
-ATOM 533 N ASP H 73 -12.005 3.047 -94.930 1.00100.45 N
-ANISOU 533 N ASP H 73 18685 10241 9240 -1628 -1128 610 N
-ATOM 534 CA ASP H 73 -10.689 3.533 -95.331 1.00101.71 C
-ANISOU 534 CA ASP H 73 18726 10582 9336 -2132 -1006 631 C
-ATOM 535 C ASP H 73 -9.879 2.328 -95.794 1.00104.27 C
-ANISOU 535 C ASP H 73 18557 11452 9610 -2041 -914 696 C
-ATOM 536 O ASP H 73 -9.508 1.470 -94.983 1.00106.38 O
-ANISOU 536 O ASP H 73 18435 12108 9875 -1870 -975 601 O
-ATOM 537 CB ASP H 73 -9.994 4.269 -94.186 1.00116.83 C
-ANISOU 537 CB ASP H 73 20579 12565 11246 -2524 -1074 419 C
-ATOM 538 CG ASP H 73 -8.813 5.109 -94.655 1.00125.31 C
-ANISOU 538 CG ASP H 73 21648 13707 12256 -3164 -934 423 C
-ATOM 539 OD1 ASP H 73 -8.094 4.677 -95.580 1.00127.27 O
-ANISOU 539 OD1 ASP H 73 21642 14272 12442 -3278 -786 561 O
-ATOM 540 OD2 ASP H 73 -8.605 6.207 -94.094 1.00127.50 O1-
-ANISOU 540 OD2 ASP H 73 22186 13723 12534 -3575 -958 275 O1-
-ATOM 541 N THR H 74 -9.614 2.268 -97.100 1.00110.47 N
-ANISOU 541 N THR H 74 19386 12259 10327 -2116 -760 866 N
-ATOM 542 CA THR H 74 -8.913 1.130 -97.684 1.00110.65 C
-ANISOU 542 CA THR H 74 18996 12763 10281 -1972 -649 926 C
-ATOM 543 C THR H 74 -7.410 1.212 -97.447 1.00115.38 C
-ANISOU 543 C THR H 74 19158 13878 10802 -2353 -562 864 C
-ATOM 544 O THR H 74 -6.765 0.189 -97.187 1.00109.30 O
-ANISOU 544 O THR H 74 17935 13608 9987 -2138 -547 824 O
-ATOM 545 CB THR H 74 -9.209 1.054 -99.182 1.00110.45 C
-ANISOU 545 CB THR H 74 19184 12606 10177 -1898 -515 1111 C
-ATOM 546 OG1 THR H 74 -10.623 0.936 -99.385 1.00102.99 O
-ANISOU 546 OG1 THR H 74 18575 11276 9280 -1531 -620 1143 O
-ATOM 547 CG2 THR H 74 -8.513 -0.144 -99.800 1.00116.87 C
-ANISOU 547 CG2 THR H 74 19607 13894 10904 -1712 -387 1145 C
-ATOM 548 N SER H 75 -6.838 2.417 -97.537 1.00122.07 N
-ANISOU 548 N SER H 75 20140 14623 11618 -2917 -495 852 N
-ATOM 549 CA SER H 75 -5.401 2.574 -97.333 1.00123.82 C
-ANISOU 549 CA SER H 75 19897 15399 11749 -3364 -408 768 C
-ATOM 550 C SER H 75 -4.982 2.126 -95.939 1.00127.19 C
-ANISOU 550 C SER H 75 19903 16243 12180 -3261 -580 557 C
-ATOM 551 O SER H 75 -3.856 1.650 -95.752 1.00125.36 O
-ANISOU 551 O SER H 75 19110 16679 11843 -3340 -540 496 O
-ATOM 552 CB SER H 75 -4.991 4.027 -97.574 1.00120.15 C
-ANISOU 552 CB SER H 75 19732 14657 11263 -4064 -303 767 C
-ATOM 553 OG SER H 75 -5.705 4.909 -96.727 1.00111.55 O
-ANISOU 553 OG SER H 75 19078 13036 10268 -4166 -452 642 O
-ATOM 554 N THR H 76 -5.872 2.263 -94.955 1.00131.62 N
-ANISOU 554 N THR H 76 20711 16466 12832 -3052 -768 451 N
-ATOM 555 CA THR H 76 -5.636 1.770 -93.606 1.00136.33 C
-ANISOU 555 CA THR H 76 20965 17431 13403 -2866 -940 275 C
-ATOM 556 C THR H 76 -6.432 0.513 -93.281 1.00132.07 C
-ANISOU 556 C THR H 76 20395 16881 12903 -2180 -1013 339 C
-ATOM 557 O THR H 76 -6.243 -0.053 -92.198 1.00130.05 O
-ANISOU 557 O THR H 76 19867 16948 12598 -1945 -1135 241 O
-ATOM 558 CB THR H 76 -5.968 2.856 -92.571 1.00139.59 C
-ANISOU 558 CB THR H 76 21662 17524 13852 -3167 -1088 74 C
-ATOM 559 OG1 THR H 76 -7.381 3.092 -92.561 1.00134.19 O
-ANISOU 559 OG1 THR H 76 21516 16187 13281 -2868 -1146 125 O
-ATOM 560 CG2 THR H 76 -5.245 4.152 -92.907 1.00145.25 C
-ANISOU 560 CG2 THR H 76 22514 18137 14539 -3912 -991 -1 C
-ATOM 561 N SER H 77 -7.313 0.072 -94.184 1.00129.44 N
-ANISOU 561 N SER H 77 20344 16196 12640 -1876 -938 498 N
-ATOM 562 CA SER H 77 -8.096 -1.156 -94.023 1.00117.33 C
-ANISOU 562 CA SER H 77 18816 14617 11149 -1301 -968 555 C
-ATOM 563 C SER H 77 -8.890 -1.152 -92.715 1.00 94.22 C
-ANISOU 563 C SER H 77 16009 11518 8273 -1105 -1135 446 C
-ATOM 564 O SER H 77 -8.871 -2.114 -91.944 1.00 79.30 O
-ANISOU 564 O SER H 77 13914 9867 6349 -758 -1179 434 O
-ATOM 565 CB SER H 77 -7.202 -2.396 -94.122 1.00127.10 C
-ANISOU 565 CB SER H 77 19610 16393 12289 -1017 -884 600 C
-ATOM 566 OG SER H 77 -6.300 -2.476 -93.033 1.00141.77 O
-ANISOU 566 OG SER H 77 21074 18743 14048 -1048 -975 489 O
-ATOM 567 N THR H 78 -9.603 -0.053 -92.471 1.00 89.64 N
-ANISOU 567 N THR H 78 15797 10509 7755 -1304 -1212 376 N
-ATOM 568 CA THR H 78 -10.453 0.068 -91.295 1.00 97.81 C
-ANISOU 568 CA THR H 78 16981 11360 8822 -1117 -1353 263 C
-ATOM 569 C THR H 78 -11.861 0.456 -91.724 1.00 95.43 C
-ANISOU 569 C THR H 78 17120 10524 8617 -956 -1363 311 C
-ATOM 570 O THR H 78 -12.054 1.140 -92.733 1.00 92.20 O
-ANISOU 570 O THR H 78 16976 9825 8229 -1117 -1301 392 O
-ATOM 571 CB THR H 78 -9.914 1.108 -90.292 1.00109.39 C
-ANISOU 571 CB THR H 78 18441 12892 10230 -1482 -1462 60 C
-ATOM 572 OG1 THR H 78 -9.983 2.417 -90.869 1.00124.82 O
-ANISOU 572 OG1 THR H 78 20765 14438 12223 -1885 -1425 35 O
-ATOM 573 CG2 THR H 78 -8.468 0.806 -89.925 1.00109.72 C
-ANISOU 573 CG2 THR H 78 17980 13564 10144 -1677 -1470 -8 C
-ATOM 574 N ALA H 79 -12.844 0.011 -90.947 1.00 92.06 N
-ANISOU 574 N ALA H 79 16753 10005 8222 -620 -1434 271 N
-ATOM 575 CA ALA H 79 -14.246 0.303 -91.202 1.00 88.53 C
-ANISOU 575 CA ALA H 79 16636 9160 7842 -414 -1459 291 C
-ATOM 576 C ALA H 79 -14.791 1.236 -90.128 1.00 90.50 C
-ANISOU 576 C ALA H 79 17102 9202 8082 -423 -1569 130 C
-ATOM 577 O ALA H 79 -14.315 1.243 -88.990 1.00100.12 O
-ANISOU 577 O ALA H 79 18170 10633 9240 -480 -1635 0 O
-ATOM 578 CB ALA H 79 -15.079 -0.982 -91.245 1.00 85.03 C
-ANISOU 578 CB ALA H 79 16085 8788 7435 -38 -1422 360 C
-ATOM 579 N TYR H 80 -15.796 2.030 -90.498 1.00 93.78 N
-ANISOU 579 N TYR H 80 17878 9224 8531 -330 -1590 132 N
-ATOM 580 CA TYR H 80 -16.407 2.968 -89.568 1.00 95.86 C
-ANISOU 580 CA TYR H 80 18405 9243 8773 -276 -1677 -30 C
-ATOM 581 C TYR H 80 -17.922 2.885 -89.663 1.00 97.66 C
-ANISOU 581 C TYR H 80 18781 9300 9027 134 -1698 -5 C
-ATOM 582 O TYR H 80 -18.481 2.727 -90.753 1.00107.86 O
-ANISOU 582 O TYR H 80 20143 10494 10342 267 -1663 131 O
-ATOM 583 CB TYR H 80 -15.957 4.411 -89.834 1.00 98.24 C
-ANISOU 583 CB TYR H 80 19086 9183 9056 -616 -1677 -89 C
-ATOM 584 CG TYR H 80 -14.466 4.626 -89.736 1.00 97.24 C
-ANISOU 584 CG TYR H 80 18789 9265 8894 -1107 -1651 -149 C
-ATOM 585 CD1 TYR H 80 -13.865 4.932 -88.522 1.00 86.53 C
-ANISOU 585 CD1 TYR H 80 17328 8080 7471 -1315 -1733 -373 C
-ATOM 586 CD2 TYR H 80 -13.660 4.537 -90.863 1.00102.65 C
-ANISOU 586 CD2 TYR H 80 19389 10028 9584 -1372 -1543 5 C
-ATOM 587 CE1 TYR H 80 -12.500 5.132 -88.433 1.00 98.51 C
-ANISOU 587 CE1 TYR H 80 18622 9875 8932 -1790 -1721 -454 C
-ATOM 588 CE2 TYR H 80 -12.297 4.736 -90.784 1.00111.13 C
-ANISOU 588 CE2 TYR H 80 20243 11370 10609 -1840 -1506 -59 C
-ATOM 589 CZ TYR H 80 -11.722 5.033 -89.568 1.00115.96 C
-ANISOU 589 CZ TYR H 80 20716 12182 11160 -2057 -1602 -294 C
-ATOM 590 OH TYR H 80 -10.362 5.231 -89.494 1.00129.88 O
-ANISOU 590 OH TYR H 80 22197 14298 12855 -2548 -1578 -382 O
-ATOM 591 N MET H 81 -18.579 3.002 -88.513 1.00 87.30 N
-ANISOU 591 N MET H 81 17489 8000 7681 332 -1755 -149 N
-ATOM 592 CA MET H 81 -20.030 3.002 -88.420 1.00 86.43 C
-ANISOU 592 CA MET H 81 17467 7803 7570 720 -1771 -162 C
-ATOM 593 C MET H 81 -20.470 4.199 -87.589 1.00 94.78 C
-ANISOU 593 C MET H 81 18848 8600 8565 817 -1832 -344 C
-ATOM 594 O MET H 81 -19.874 4.496 -86.552 1.00 93.63 O
-ANISOU 594 O MET H 81 18708 8505 8363 657 -1868 -505 O
-ATOM 595 CB MET H 81 -20.535 1.694 -87.797 1.00 86.90 C
-ANISOU 595 CB MET H 81 17179 8208 7631 919 -1733 -148 C
-ATOM 596 CG MET H 81 -22.018 1.428 -87.968 1.00 94.06 C
-ANISOU 596 CG MET H 81 18057 9138 8543 1252 -1719 -138 C
-ATOM 597 SD MET H 81 -23.016 2.297 -86.749 1.00109.31 S
-ANISOU 597 SD MET H 81 20146 11003 10383 1538 -1766 -330 S
-ATOM 598 CE MET H 81 -23.165 1.042 -85.486 1.00106.95 C
-ANISOU 598 CE MET H 81 19502 11093 10040 1590 -1689 -353 C
-ATOM 599 N GLU H 82 -21.507 4.893 -88.052 1.00102.00 N
-ANISOU 599 N GLU H 82 20038 9253 9465 1104 -1848 -330 N
-ATOM 600 CA GLU H 82 -22.036 6.060 -87.360 1.00100.52 C
-ANISOU 600 CA GLU H 82 20221 8767 9206 1286 -1890 -503 C
-ATOM 601 C GLU H 82 -23.529 5.880 -87.155 1.00 93.82 C
-ANISOU 601 C GLU H 82 19287 8047 8312 1792 -1899 -526 C
-ATOM 602 O GLU H 82 -24.260 5.591 -88.109 1.00104.76 O
-ANISOU 602 O GLU H 82 20595 9498 9712 2009 -1897 -385 O
-ATOM 603 CB GLU H 82 -21.766 7.352 -88.143 1.00117.99 C
-ANISOU 603 CB GLU H 82 22960 10461 11409 1178 -1886 -463 C
-ATOM 604 CG GLU H 82 -22.535 8.563 -87.623 1.00132.98 C
-ANISOU 604 CG GLU H 82 25331 11971 13223 1492 -1912 -619 C
-ATOM 605 CD GLU H 82 -22.284 9.819 -88.441 1.00149.04 C
-ANISOU 605 CD GLU H 82 27975 13415 15239 1401 -1879 -544 C
-ATOM 606 OE1 GLU H 82 -21.194 9.935 -89.040 1.00156.26 O
-ANISOU 606 OE1 GLU H 82 28964 14207 16200 919 -1829 -449 O
-ATOM 607 OE2 GLU H 82 -23.176 10.693 -88.483 1.00152.95 O1-
-ANISOU 607 OE2 GLU H 82 28887 13571 15656 1827 -1887 -571 O1-
-ATOM 608 N LEU H 83 -23.976 6.047 -85.911 1.00 79.27 N
-ANISOU 608 N LEU H 83 17434 6295 6392 1973 -1908 -717 N
-ATOM 609 CA LEU H 83 -25.390 5.987 -85.556 1.00 79.77 C
-ANISOU 609 CA LEU H 83 17396 6529 6385 2452 -1898 -774 C
-ATOM 610 C LEU H 83 -25.787 7.328 -84.950 1.00 83.75 C
-ANISOU 610 C LEU H 83 18350 6691 6781 2718 -1925 -970 C
-ATOM 611 O LEU H 83 -25.300 7.699 -83.874 1.00 85.12 O
-ANISOU 611 O LEU H 83 18651 6801 6890 2586 -1932 -1167 O
-ATOM 612 CB LEU H 83 -25.666 4.835 -84.590 1.00 77.65 C
-ANISOU 612 CB LEU H 83 16683 6730 6090 2468 -1841 -812 C
-ATOM 613 CG LEU H 83 -27.139 4.495 -84.358 1.00 77.99 C
-ANISOU 613 CG LEU H 83 16488 7074 6069 2879 -1793 -839 C
-ATOM 614 CD1 LEU H 83 -27.857 4.251 -85.675 1.00 77.48 C
-ANISOU 614 CD1 LEU H 83 16307 7075 6056 3025 -1810 -691 C
-ATOM 615 CD2 LEU H 83 -27.268 3.288 -83.447 1.00 76.17 C
-ANISOU 615 CD2 LEU H 83 15864 7264 5814 2796 -1697 -836 C
-ATOM 616 N ARG H 84 -26.658 8.053 -85.646 1.00 86.03 N
-ANISOU 616 N ARG H 84 18894 6766 7027 3114 -1944 -922 N
-ATOM 617 CA ARG H 84 -27.152 9.353 -85.219 1.00 96.01 C
-ANISOU 617 CA ARG H 84 20654 7649 8177 3473 -1955 -1088 C
-ATOM 618 C ARG H 84 -28.527 9.209 -84.576 1.00 96.39 C
-ANISOU 618 C ARG H 84 20461 8058 8105 4032 -1935 -1199 C
-ATOM 619 O ARG H 84 -29.174 8.163 -84.661 1.00 99.99 O
-ANISOU 619 O ARG H 84 20385 9032 8576 4117 -1912 -1120 O
-ATOM 620 CB ARG H 84 -27.230 10.319 -86.407 1.00106.49 C
-ANISOU 620 CB ARG H 84 22479 8487 9496 3634 -1976 -939 C
-ATOM 621 CG ARG H 84 -25.975 10.385 -87.256 1.00101.87 C
-ANISOU 621 CG ARG H 84 22077 7613 9016 3081 -1964 -780 C
-ATOM 622 CD ARG H 84 -26.205 11.213 -88.513 1.00 98.55 C
-ANISOU 622 CD ARG H 84 22124 6768 8554 3294 -1964 -575 C
-ATOM 623 NE ARG H 84 -27.303 10.681 -89.315 1.00112.61 N
-ANISOU 623 NE ARG H 84 23586 8920 10279 3760 -2011 -412 N
-ATOM 624 CZ ARG H 84 -27.172 9.719 -90.224 1.00116.78 C
-ANISOU 624 CZ ARG H 84 23717 9790 10863 3580 -2026 -227 C
-ATOM 625 NH1 ARG H 84 -28.231 9.302 -90.907 1.00117.58 N1+
-ANISOU 625 NH1 ARG H 84 23536 10251 10886 3995 -2084 -128 N1+
-ATOM 626 NH2 ARG H 84 -25.987 9.164 -90.448 1.00106.90 N
-ANISOU 626 NH2 ARG H 84 22333 8555 9729 2995 -1985 -162 N
-ATOM 627 N SER H 85 -28.974 10.292 -83.938 1.00 95.61 N
-ANISOU 627 N SER H 85 20774 7675 7878 4403 -1929 -1397 N
-ATOM 628 CA SER H 85 -30.280 10.342 -83.283 1.00101.36 C
-ANISOU 628 CA SER H 85 21313 8741 8457 4993 -1894 -1531 C
-ATOM 629 C SER H 85 -30.458 9.166 -82.324 1.00109.03 C
-ANISOU 629 C SER H 85 21689 10323 9414 4840 -1830 -1593 C
-ATOM 630 O SER H 85 -31.434 8.414 -82.390 1.00119.52 O
-ANISOU 630 O SER H 85 22529 12171 10712 5070 -1786 -1533 O
-ATOM 631 CB SER H 85 -31.406 10.382 -84.317 1.00 98.77 C
-ANISOU 631 CB SER H 85 20849 8595 8083 5504 -1926 -1370 C
-ATOM 632 OG SER H 85 -31.309 11.539 -85.127 1.00120.81 O
-ANISOU 632 OG SER H 85 24263 10797 10841 5738 -1970 -1292 O
-ATOM 633 N LEU H 86 -29.489 9.008 -81.425 1.00 97.48 N
-ANISOU 633 N LEU H 86 20276 8807 7956 4429 -1819 -1712 N
-ATOM 634 CA LEU H 86 -29.487 7.875 -80.513 1.00 93.68 C
-ANISOU 634 CA LEU H 86 19302 8851 7441 4257 -1750 -1727 C
-ATOM 635 C LEU H 86 -30.663 7.944 -79.546 1.00 96.27 C
-ANISOU 635 C LEU H 86 19463 9535 7580 4734 -1661 -1894 C
-ATOM 636 O LEU H 86 -30.986 9.003 -79.002 1.00 99.02 O
-ANISOU 636 O LEU H 86 20185 9653 7786 5084 -1662 -2116 O
-ATOM 637 CB LEU H 86 -28.175 7.826 -79.733 1.00 90.41 C
-ANISOU 637 CB LEU H 86 19008 8327 7017 3787 -1782 -1830 C
-ATOM 638 CG LEU H 86 -26.925 7.469 -80.535 1.00 91.85 C
-ANISOU 638 CG LEU H 86 19189 8341 7367 3260 -1843 -1659 C
-ATOM 639 CD1 LEU H 86 -25.674 7.680 -79.698 1.00 92.85 C
-ANISOU 639 CD1 LEU H 86 19451 8391 7435 2855 -1897 -1822 C
-ATOM 640 CD2 LEU H 86 -27.006 6.037 -81.024 1.00 87.92 C
-ANISOU 640 CD2 LEU H 86 18178 8251 6977 3122 -1791 -1411 C
-ATOM 641 N ARG H 87 -31.304 6.800 -79.341 1.00 98.08 N
-ANISOU 641 N ARG H 87 19144 10322 7799 4738 -1562 -1791 N
-ATOM 642 CA ARG H 87 -32.360 6.633 -78.358 1.00107.51 C
-ANISOU 642 CA ARG H 87 20071 11972 8805 5092 -1435 -1922 C
-ATOM 643 C ARG H 87 -31.906 5.620 -77.317 1.00116.79 C
-ANISOU 643 C ARG H 87 20979 13476 9921 4760 -1335 -1898 C
-ATOM 644 O ARG H 87 -30.911 4.914 -77.498 1.00122.69 O
-ANISOU 644 O ARG H 87 21675 14154 10786 4310 -1367 -1751 O
-ATOM 645 CB ARG H 87 -33.664 6.179 -79.026 1.00110.12 C
-ANISOU 645 CB ARG H 87 19964 12734 9142 5385 -1375 -1820 C
-ATOM 646 CG ARG H 87 -34.261 7.197 -79.985 1.00121.79 C
-ANISOU 646 CG ARG H 87 21683 13981 10611 5848 -1477 -1836 C
-ATOM 647 CD ARG H 87 -34.735 6.538 -81.271 1.00120.21 C
-ANISOU 647 CD ARG H 87 21124 14024 10529 5791 -1519 -1629 C
-ATOM 648 NE ARG H 87 -35.566 5.365 -81.020 1.00118.37 N
-ANISOU 648 NE ARG H 87 20248 14458 10269 5692 -1386 -1593 N
-ATOM 649 CZ ARG H 87 -36.087 4.603 -81.976 1.00122.89 C
-ANISOU 649 CZ ARG H 87 20417 15358 10919 5574 -1398 -1465 C
-ATOM 650 NH1 ARG H 87 -35.863 4.892 -83.250 1.00119.75 N1+
-ANISOU 650 NH1 ARG H 87 20183 14708 10609 5590 -1547 -1348 N1+
-ATOM 651 NH2 ARG H 87 -36.829 3.552 -81.660 1.00129.73 N
-ANISOU 651 NH2 ARG H 87 20733 16804 11756 5414 -1250 -1460 N
-ATOM 652 N SER H 88 -32.644 5.553 -76.206 1.00113.94 N
-ANISOU 652 N SER H 88 20454 13490 9346 5024 -1203 -2034 N
-ATOM 653 CA SER H 88 -32.369 4.523 -75.212 1.00102.21 C
-ANISOU 653 CA SER H 88 18709 12365 7761 4766 -1078 -1968 C
-ATOM 654 C SER H 88 -32.505 3.122 -75.795 1.00102.79 C
-ANISOU 654 C SER H 88 18362 12707 7988 4450 -980 -1685 C
-ATOM 655 O SER H 88 -31.887 2.186 -75.279 1.00 97.80 O
-ANISOU 655 O SER H 88 17624 12196 7337 4140 -908 -1552 O
-ATOM 656 CB SER H 88 -33.299 4.682 -74.011 1.00104.34 C
-ANISOU 656 CB SER H 88 18852 13041 7752 5132 -918 -2142 C
-ATOM 657 OG SER H 88 -34.650 4.501 -74.391 1.00116.46 O
-ANISOU 657 OG SER H 88 20022 14954 9275 5429 -798 -2112 O
-ATOM 658 N ASP H 89 -33.294 2.963 -76.863 1.00110.40 N
-ANISOU 658 N ASP H 89 19105 13760 9083 4535 -977 -1598 N
-ATOM 659 CA ASP H 89 -33.399 1.670 -77.532 1.00112.99 C
-ANISOU 659 CA ASP H 89 19085 14281 9564 4191 -894 -1370 C
-ATOM 660 C ASP H 89 -32.052 1.202 -78.063 1.00104.09 C
-ANISOU 660 C ASP H 89 18134 12803 8611 3779 -991 -1210 C
-ATOM 661 O ASP H 89 -31.806 -0.005 -78.151 1.00117.04 O
-ANISOU 661 O ASP H 89 19582 14561 10326 3461 -887 -1029 O
-ATOM 662 CB ASP H 89 -34.402 1.745 -78.686 1.00133.97 C
-ANISOU 662 CB ASP H 89 21504 17092 12308 4357 -926 -1354 C
-ATOM 663 CG ASP H 89 -35.770 2.230 -78.250 1.00155.37 C
-ANISOU 663 CG ASP H 89 23974 20231 14831 4820 -837 -1517 C
-ATOM 664 OD1 ASP H 89 -36.612 1.383 -77.886 1.00166.26 O
-ANISOU 664 OD1 ASP H 89 24913 22117 16141 4732 -644 -1489 O
-ATOM 665 OD2 ASP H 89 -36.007 3.456 -78.285 1.00160.60 O1-
-ANISOU 665 OD2 ASP H 89 24894 20722 15406 5273 -945 -1674 O1-
-ATOM 666 N ASP H 90 -31.174 2.136 -78.421 1.00 91.17 N
-ANISOU 666 N ASP H 90 16873 10737 7031 3777 -1173 -1277 N
-ATOM 667 CA ASP H 90 -29.915 1.804 -79.076 1.00 79.99 C
-ANISOU 667 CA ASP H 90 15585 9031 5775 3406 -1268 -1137 C
-ATOM 668 C ASP H 90 -28.814 1.401 -78.104 1.00 79.27 C
-ANISOU 668 C ASP H 90 15559 8959 5601 3177 -1260 -1121 C
-ATOM 669 O ASP H 90 -27.712 1.068 -78.553 1.00 77.28 O
-ANISOU 669 O ASP H 90 15362 8545 5456 2889 -1330 -1010 O
-ATOM 670 CB ASP H 90 -29.445 2.985 -79.930 1.00 84.68 C
-ANISOU 670 CB ASP H 90 16544 9178 6454 3453 -1442 -1203 C
-ATOM 671 CG ASP H 90 -30.395 3.291 -81.075 1.00 96.69 C
-ANISOU 671 CG ASP H 90 18010 10687 8043 3693 -1474 -1162 C
-ATOM 672 OD1 ASP H 90 -31.080 2.359 -81.549 1.00 83.72 O
-ANISOU 672 OD1 ASP H 90 16002 9358 6451 3651 -1396 -1051 O
-ATOM 673 OD2 ASP H 90 -30.464 4.466 -81.495 1.00110.28 O1-
-ANISOU 673 OD2 ASP H 90 20068 12086 9746 3926 -1577 -1246 O1-
-ATOM 674 N THR H 91 -29.072 1.428 -76.797 1.00 81.20 N
-ANISOU 674 N THR H 91 15781 9441 5630 3323 -1179 -1230 N
-ATOM 675 CA THR H 91 -28.105 0.917 -75.834 1.00 83.27 C
-ANISOU 675 CA THR H 91 16058 9819 5763 3149 -1170 -1191 C
-ATOM 676 C THR H 91 -27.883 -0.567 -76.088 1.00 82.50 C
-ANISOU 676 C THR H 91 15723 9872 5750 2927 -1044 -907 C
-ATOM 677 O THR H 91 -28.794 -1.374 -75.873 1.00 81.57 O
-ANISOU 677 O THR H 91 15389 10005 5600 2969 -850 -802 O
-ATOM 678 CB THR H 91 -28.586 1.148 -74.399 1.00 83.81 C
-ANISOU 678 CB THR H 91 16133 10169 5542 3385 -1082 -1347 C
-ATOM 679 OG1 THR H 91 -28.746 2.552 -74.165 1.00 96.77 O
-ANISOU 679 OG1 THR H 91 18060 11612 7097 3608 -1195 -1641 O
-ATOM 680 CG2 THR H 91 -27.582 0.588 -73.407 1.00 83.93 C
-ANISOU 680 CG2 THR H 91 16155 10356 5377 3241 -1090 -1289 C
-ATOM 681 N ALA H 92 -26.692 -0.939 -76.552 1.00 67.97 N
-ANISOU 681 N ALA H 92 12658 7124 6043 1187 -1973 -624 N
-ATOM 682 CA ALA H 92 -26.443 -2.319 -76.964 1.00 66.67 C
-ANISOU 682 CA ALA H 92 12228 7048 6057 900 -1891 -568 C
-ATOM 683 C ALA H 92 -24.949 -2.509 -77.202 1.00 60.84 C
-ANISOU 683 C ALA H 92 11673 6017 5428 632 -1829 -403 C
-ATOM 684 O ALA H 92 -24.146 -1.585 -77.031 1.00 67.78 O
-ANISOU 684 O ALA H 92 12851 6656 6245 619 -1833 -334 O
-ATOM 685 CB ALA H 92 -27.243 -2.676 -78.219 1.00 79.58 C
-ANISOU 685 CB ALA H 92 13739 8837 7660 1045 -1972 -669 C
-ATOM 686 N VAL H 93 -24.585 -3.727 -77.602 1.00 56.44 N
-ANISOU 686 N VAL H 93 10928 5496 5022 415 -1776 -363 N
-ATOM 687 CA VAL H 93 -23.221 -4.074 -77.989 1.00 69.73 C
-ANISOU 687 CA VAL H 93 12699 6981 6815 202 -1722 -262 C
-ATOM 688 C VAL H 93 -23.166 -4.182 -79.507 1.00 76.05 C
-ANISOU 688 C VAL H 93 13573 7743 7579 246 -1735 -281 C
-ATOM 689 O VAL H 93 -23.966 -4.904 -80.117 1.00 66.28 O
-ANISOU 689 O VAL H 93 12168 6660 6355 303 -1772 -350 O
-ATOM 690 CB VAL H 93 -22.768 -5.388 -77.331 1.00 67.35 C
-ANISOU 690 CB VAL H 93 12184 6718 6688 -24 -1682 -224 C
-ATOM 691 CG1 VAL H 93 -21.409 -5.812 -77.872 1.00 65.85 C
-ANISOU 691 CG1 VAL H 93 12027 6383 6611 -172 -1649 -179 C
-ATOM 692 CG2 VAL H 93 -22.724 -5.240 -75.823 1.00 73.97 C
-ANISOU 692 CG2 VAL H 93 13014 7564 7526 -83 -1673 -192 C
-ATOM 693 N TYR H 94 -22.217 -3.480 -80.117 1.00 76.46 N
-ANISOU 693 N TYR H 94 13884 7601 7569 187 -1696 -227 N
-ATOM 694 CA TYR H 94 -22.092 -3.409 -81.565 1.00 67.73 C
-ANISOU 694 CA TYR H 94 12928 6436 6371 214 -1690 -237 C
-ATOM 695 C TYR H 94 -20.888 -4.224 -82.014 1.00 73.25 C
-ANISOU 695 C TYR H 94 13518 7111 7202 -26 -1576 -217 C
-ATOM 696 O TYR H 94 -19.779 -4.046 -81.496 1.00 82.04 O
-ANISOU 696 O TYR H 94 14636 8153 8381 -209 -1499 -181 O
-ATOM 697 CB TYR H 94 -21.982 -1.953 -82.024 1.00 64.14 C
-ANISOU 697 CB TYR H 94 12914 5776 5679 305 -1720 -203 C
-ATOM 698 CG TYR H 94 -23.234 -1.158 -81.719 1.00 69.70 C
-ANISOU 698 CG TYR H 94 13744 6509 6230 640 -1875 -267 C
-ATOM 699 CD1 TYR H 94 -23.503 -0.710 -80.431 1.00 77.78 C
-ANISOU 699 CD1 TYR H 94 14729 7557 7266 712 -1903 -281 C
-ATOM 700 CD2 TYR H 94 -24.155 -0.872 -82.714 1.00 60.98 C
-ANISOU 700 CD2 TYR H 94 12784 5430 4957 916 -2009 -338 C
-ATOM 701 CE1 TYR H 94 -24.651 0.004 -80.147 1.00 80.92 C
-ANISOU 701 CE1 TYR H 94 15205 8024 7515 1062 -2045 -382 C
-ATOM 702 CE2 TYR H 94 -25.304 -0.155 -82.440 1.00 70.18 C
-ANISOU 702 CE2 TYR H 94 14025 6661 5977 1285 -2180 -443 C
-ATOM 703 CZ TYR H 94 -25.546 0.280 -81.155 1.00 78.00 C
-ANISOU 703 CZ TYR H 94 14950 7698 6988 1363 -2189 -473 C
-ATOM 704 OH TYR H 94 -26.688 0.994 -80.874 1.00 93.32 O
-ANISOU 704 OH TYR H 94 16937 9744 8776 1771 -2358 -618 O
-ATOM 705 N TYR H 95 -21.124 -5.125 -82.966 1.00 73.23 N
-ANISOU 705 N TYR H 95 13400 7191 7232 -7 -1581 -267 N
-ATOM 706 CA TYR H 95 -20.127 -6.050 -83.485 1.00 69.06 C
-ANISOU 706 CA TYR H 95 12744 6676 6822 -164 -1493 -293 C
-ATOM 707 C TYR H 95 -19.825 -5.728 -84.943 1.00 74.38 C
-ANISOU 707 C TYR H 95 13622 7303 7337 -175 -1425 -313 C
-ATOM 708 O TYR H 95 -20.723 -5.367 -85.714 1.00 69.81 O
-ANISOU 708 O TYR H 95 13215 6714 6597 -15 -1503 -325 O
-ATOM 709 CB TYR H 95 -20.605 -7.505 -83.387 1.00 69.86 C
-ANISOU 709 CB TYR H 95 12585 6883 7074 -149 -1557 -347 C
-ATOM 710 CG TYR H 95 -20.721 -8.073 -81.988 1.00 70.33 C
-ANISOU 710 CG TYR H 95 12479 6970 7273 -206 -1603 -321 C
-ATOM 711 CD1 TYR H 95 -19.592 -8.413 -81.255 1.00 62.43 C
-ANISOU 711 CD1 TYR H 95 11411 5912 6398 -316 -1578 -304 C
-ATOM 712 CD2 TYR H 95 -21.967 -8.311 -81.418 1.00 74.79 C
-ANISOU 712 CD2 TYR H 95 12953 7641 7823 -155 -1676 -331 C
-ATOM 713 CE1 TYR H 95 -19.700 -8.945 -79.981 1.00 71.42 C
-ANISOU 713 CE1 TYR H 95 12467 7044 7626 -363 -1641 -271 C
-ATOM 714 CE2 TYR H 95 -22.084 -8.844 -80.148 1.00 72.49 C
-ANISOU 714 CE2 TYR H 95 12559 7368 7614 -251 -1696 -300 C
-ATOM 715 CZ TYR H 95 -20.949 -9.159 -79.435 1.00 75.99 C
-ANISOU 715 CZ TYR H 95 13008 7700 8164 -348 -1687 -256 C
-ATOM 716 OH TYR H 95 -21.069 -9.689 -78.171 1.00 80.50 O
-ANISOU 716 OH TYR H 95 13546 8260 8781 -437 -1728 -215 O
-ATOM 717 N CYS H 96 -18.557 -5.893 -85.312 1.00 81.48 N
-ANISOU 717 N CYS H 96 14491 8200 8270 -359 -1284 -338 N
-ATOM 718 CA CYS H 96 -18.067 -5.684 -86.668 1.00 79.66 C
-ANISOU 718 CA CYS H 96 14438 7955 7876 -437 -1166 -369 C
-ATOM 719 C CYS H 96 -17.551 -7.014 -87.202 1.00 77.74 C
-ANISOU 719 C CYS H 96 13934 7837 7768 -452 -1119 -482 C
-ATOM 720 O CYS H 96 -16.590 -7.570 -86.660 1.00 81.55 O
-ANISOU 720 O CYS H 96 14174 8393 8418 -541 -1066 -543 O
-ATOM 721 CB CYS H 96 -16.971 -4.619 -86.673 1.00 93.89 C
-ANISOU 721 CB CYS H 96 16430 9687 9556 -685 -1003 -336 C
-ATOM 722 SG CYS H 96 -15.785 -4.688 -88.026 1.00118.30 S
-ANISOU 722 SG CYS H 96 19574 12867 12509 -930 -758 -422 S
-ATOM 723 N ALA H 97 -18.192 -7.526 -88.250 1.00 77.41 N
-ANISOU 723 N ALA H 97 13955 7816 7643 -337 -1165 -527 N
-ATOM 724 CA ALA H 97 -17.848 -8.823 -88.815 1.00 68.82 C
-ANISOU 724 CA ALA H 97 12673 6818 6659 -312 -1151 -647 C
-ATOM 725 C ALA H 97 -17.437 -8.681 -90.273 1.00 68.47 C
-ANISOU 725 C ALA H 97 12804 6801 6410 -360 -1015 -710 C
-ATOM 726 O ALA H 97 -17.774 -7.703 -90.944 1.00 79.47 O
-ANISOU 726 O ALA H 97 14520 8117 7559 -377 -986 -643 O
-ATOM 727 CB ALA H 97 -19.019 -9.805 -88.705 1.00 67.82 C
-ANISOU 727 CB ALA H 97 12445 6698 6625 -161 -1341 -669 C
-ATOM 728 N ARG H 98 -16.698 -9.675 -90.760 1.00 66.37 N
-ANISOU 728 N ARG H 98 12357 6638 6221 -365 -941 -850 N
-ATOM 729 CA ARG H 98 -16.283 -9.734 -92.154 1.00 75.20 C
-ANISOU 729 CA ARG H 98 13609 7822 7143 -406 -794 -943 C
-ATOM 730 C ARG H 98 -16.939 -10.921 -92.846 1.00 75.78 C
-ANISOU 730 C ARG H 98 13653 7898 7244 -225 -929 -1038 C
-ATOM 731 O ARG H 98 -17.304 -11.912 -92.209 1.00 80.58 O
-ANISOU 731 O ARG H 98 14076 8481 8058 -118 -1091 -1071 O
-ATOM 732 CB ARG H 98 -14.762 -9.855 -92.289 1.00 68.73 C
-ANISOU 732 CB ARG H 98 12589 7177 6349 -562 -562 -1084 C
-ATOM 733 CG ARG H 98 -14.257 -11.282 -92.170 1.00 66.93 C
-ANISOU 733 CG ARG H 98 12043 7055 6332 -405 -621 -1268 C
-ATOM 734 CD ARG H 98 -12.940 -11.487 -92.891 1.00 74.15 C
-ANISOU 734 CD ARG H 98 12787 8206 7181 -486 -382 -1480 C
-ATOM 735 NE ARG H 98 -12.596 -12.904 -92.977 1.00 72.77 N
-ANISOU 735 NE ARG H 98 12384 8101 7164 -248 -482 -1684 N
-ATOM 736 CZ ARG H 98 -11.451 -13.367 -93.465 1.00 80.69 C
-ANISOU 736 CZ ARG H 98 13151 9349 8160 -215 -325 -1935 C
-ATOM 737 NH1 ARG H 98 -10.535 -12.523 -93.919 1.00 91.48 N1+
-ANISOU 737 NH1 ARG H 98 14444 10950 9365 -468 -26 -2010 N1+
-ATOM 738 NH2 ARG H 98 -11.223 -14.673 -93.505 1.00 78.91 N
-ANISOU 738 NH2 ARG H 98 12776 9138 8067 65 -468 -2126 N
-ATOM 739 N ASP H 99 -17.085 -10.811 -94.163 1.00 74.11 N
-ANISOU 739 N ASP H 99 13668 7696 6794 -215 -866 -1082 N
-ATOM 740 CA ASP H 99 -17.606 -11.907 -94.964 1.00 84.55 C
-ANISOU 740 CA ASP H 99 14993 9024 8110 -64 -983 -1196 C
-ATOM 741 C ASP H 99 -16.897 -11.924 -96.307 1.00 87.63 C
-ANISOU 741 C ASP H 99 15526 9503 8265 -115 -783 -1315 C
-ATOM 742 O ASP H 99 -16.401 -10.902 -96.786 1.00 87.69 O
-ANISOU 742 O ASP H 99 15741 9536 8043 -282 -584 -1265 O
-ATOM 743 CB ASP H 99 -19.127 -11.803 -95.166 1.00112.35 C
-ANISOU 743 CB ASP H 99 18675 12456 11556 63 -1221 -1121 C
-ATOM 744 CG ASP H 99 -19.538 -10.562 -95.947 1.00125.91 C
-ANISOU 744 CG ASP H 99 20765 14115 12961 64 -1201 -1030 C
-ATOM 745 OD1 ASP H 99 -18.737 -9.611 -96.047 1.00127.92 O
-ANISOU 745 OD1 ASP H 99 21187 14351 13068 -92 -1002 -968 O
-ATOM 746 OD2 ASP H 99 -20.676 -10.538 -96.461 1.00129.67 O
-ANISOU 746 OD2 ASP H 99 21388 14559 13321 216 -1402 -1029 O
-ATOM 747 N LEU H 100 -16.850 -13.106 -96.914 1.00 84.45 N
-ANISOU 747 N LEU H 100 15047 9142 7900 11 -832 -1479 N
-ATOM 748 CA LEU H 100 -16.254 -13.229 -98.236 1.00 80.44 C
-ANISOU 748 CA LEU H 100 14674 8739 7151 -13 -645 -1620 C
-ATOM 749 C LEU H 100 -17.168 -12.561 -99.256 1.00 90.01 C
-ANISOU 749 C LEU H 100 16295 9854 8049 -7 -705 -1526 C
-ATOM 750 O LEU H 100 -18.024 -13.219 -99.855 1.00 91.49 O
-ANISOU 750 O LEU H 100 16583 9984 8194 148 -901 -1579 O
-ATOM 751 CB LEU H 100 -16.013 -14.699 -98.587 1.00 85.04 C
-ANISOU 751 CB LEU H 100 15100 9365 7847 166 -717 -1838 C
-ATOM 752 CG LEU H 100 -15.169 -14.973 -99.833 1.00 75.56 C
-ANISOU 752 CG LEU H 100 13956 8330 6424 168 -488 -2043 C
-ATOM 753 CD1 LEU H 100 -14.028 -13.970 -99.909 1.00 84.72 C
-ANISOU 753 CD1 LEU H 100 15059 9689 7443 -76 -141 -2052 C
-ATOM 754 CD2 LEU H 100 -14.620 -16.385 -99.812 1.00 76.52 C
-ANISOU 754 CD2 LEU H 100 13850 8506 6717 381 -554 -2291 C
-ATOM 755 N ARG H 101 -17.001 -11.249 -99.439 1.00 97.69 N
-ANISOU 755 N ARG H 101 17536 10793 8789 -174 -563 -1391 N
-ATOM 756 CA ARG H 101 -17.809 -10.446-100.355 1.00101.87 C
-ANISOU 756 CA ARG H 101 18539 11191 8976 -146 -647 -1288 C
-ATOM 757 C ARG H 101 -19.304 -10.654-100.148 1.00107.56 C
-ANISOU 757 C ARG H 101 19288 11803 9776 101 -1015 -1237 C
-ATOM 758 O ARG H 101 -19.832 -10.364 -99.070 1.00136.29 O
-ANISOU 758 O ARG H 101 22779 15397 13609 148 -1157 -1141 O
-ATOM 759 CB ARG H 101 -17.427 -10.743-101.804 1.00119.68 C
-ANISOU 759 CB ARG H 101 21029 13517 10927 -177 -494 -1415 C
-ATOM 760 CG ARG H 101 -15.999 -10.353-102.133 1.00134.67 C
-ANISOU 760 CG ARG H 101 22923 15579 12668 -470 -89 -1483 C
-ATOM 761 CD ARG H 101 -15.753 -8.860-101.904 1.00129.94 C
-ANISOU 761 CD ARG H 101 22646 14871 11855 -738 50 -1291 C
-ATOM 762 NE ARG H 101 -16.510 -8.017-102.828 1.00124.21 N
-ANISOU 762 NE ARG H 101 22546 13930 10718 -719 -51 -1156 N
-ATOM 763 CZ ARG H 101 -16.146 -7.771-104.085 1.00120.00 C
-ANISOU 763 CZ ARG H 101 22411 13412 9772 -875 147 -1192 C
-ATOM 764 NH1 ARG H 101 -16.895 -6.992-104.853 1.00129.67 N
-ANISOU 764 NH1 ARG H 101 24261 14396 10610 -818 -3 -1057 N
-ATOM 765 NH2 ARG H 101 -15.035 -8.306-104.576 1.00103.15 N
-ANISOU 765 NH2 ARG H 101 20060 11543 7590 -1069 486 -1378 N
-ATOM 766 N GLY H 102 -19.996 -11.152-101.165 1.00 74.67 N
-ANISOU 766 N GLY H 102 15292 7625 5453 249 -1169 -1320 N
-ATOM 767 CA GLY H 102 -21.433 -11.297-101.087 1.00 84.09 C
-ANISOU 767 CA GLY H 102 16490 8774 6686 461 -1518 -1310 C
-ATOM 768 C GLY H 102 -21.943 -12.541-100.401 1.00 86.11 C
-ANISOU 768 C GLY H 102 16342 9095 7281 521 -1688 -1406 C
-ATOM 769 O GLY H 102 -23.143 -12.817-100.464 1.00 97.07 O
-ANISOU 769 O GLY H 102 17692 10502 8688 651 -1962 -1444 O
-ATOM 770 N THR H 103 -21.074 -13.305 -99.736 1.00 71.06 N
-ANISOU 770 N THR H 103 14148 7226 5627 423 -1547 -1458 N
-ATOM 771 CA THR H 103 -21.513 -14.558 -99.130 1.00 74.41 C
-ANISOU 771 CA THR H 103 14294 7653 6326 453 -1716 -1543 C
-ATOM 772 C THR H 103 -22.339 -14.329 -97.870 1.00 70.77 C
-ANISOU 772 C THR H 103 13632 7193 6065 435 -1867 -1438 C
-ATOM 773 O THR H 103 -23.263 -15.102 -97.596 1.00 67.84 O
-ANISOU 773 O THR H 103 13124 6839 5813 440 -2071 -1492 O
-ATOM 774 CB THR H 103 -20.311 -15.445 -98.803 1.00 80.72 C
-ANISOU 774 CB THR H 103 14908 8460 7301 408 -1560 -1644 C
-ATOM 775 OG1 THR H 103 -19.340 -14.690 -98.064 1.00 86.91 O
-ANISOU 775 OG1 THR H 103 15585 9285 8152 309 -1350 -1560 O
-ATOM 776 CG2 THR H 103 -19.677 -15.980-100.082 1.00 79.86 C
-ANISOU 776 CG2 THR H 103 14946 8391 7007 463 -1447 -1815 C
-ATOM 777 N ASN H 104 -22.023 -13.285 -97.100 1.00 66.94 N
-ANISOU 777 N ASN H 104 13133 6701 5601 388 -1761 -1300 N
-ATOM 778 CA ASN H 104 -22.668 -13.016 -95.813 1.00 78.62 C
-ANISOU 778 CA ASN H 104 14416 8197 7259 372 -1865 -1210 C
-ATOM 779 C ASN H 104 -22.422 -14.149 -94.819 1.00 86.72 C
-ANISOU 779 C ASN H 104 15174 9208 8568 276 -1883 -1242 C
-ATOM 780 O ASN H 104 -23.233 -14.400 -93.924 1.00 93.47 O
-ANISOU 780 O ASN H 104 15864 10093 9557 234 -2010 -1214 O
-ATOM 781 CB ASN H 104 -24.170 -12.754 -95.978 1.00 89.50 C
-ANISOU 781 CB ASN H 104 15804 9651 8553 497 -2110 -1229 C
-ATOM 782 CG ASN H 104 -24.461 -11.608 -96.932 1.00 98.73 C
-ANISOU 782 CG ASN H 104 17309 10792 9410 651 -2154 -1199 C
-ATOM 783 OD1 ASN H 104 -23.656 -10.689 -97.084 1.00107.89 O
-ANISOU 783 OD1 ASN H 104 18708 11856 10428 615 -1985 -1102 O
-ATOM 784 ND2 ASN H 104 -25.615 -11.661 -97.582 1.00 97.68 N
-ANISOU 784 ND2 ASN H 104 17223 10740 9151 811 -2395 -1290 N
-ATOM 785 N TYR H 105 -21.300 -14.847 -94.979 1.00 86.92 N
-ANISOU 785 N TYR H 105 15173 9192 8662 248 -1760 -1316 N
-ATOM 786 CA TYR H 105 -20.856 -15.866 -94.034 1.00 80.56 C
-ANISOU 786 CA TYR H 105 14194 8323 8093 201 -1794 -1348 C
-ATOM 787 C TYR H 105 -19.746 -15.257 -93.184 1.00 79.53 C
-ANISOU 787 C TYR H 105 13955 8207 8055 160 -1629 -1281 C
-ATOM 788 O TYR H 105 -18.618 -15.080 -93.657 1.00 89.90 O
-ANISOU 788 O TYR H 105 15268 9576 9315 172 -1454 -1353 O
-ATOM 789 CB TYR H 105 -20.387 -17.120 -94.766 1.00 65.16 C
-ANISOU 789 CB TYR H 105 12295 6315 6149 268 -1826 -1519 C
-ATOM 790 CG TYR H 105 -21.520 -17.928 -95.364 1.00 67.35 C
-ANISOU 790 CG TYR H 105 12666 6550 6374 262 -2030 -1594 C
-ATOM 791 CD1 TYR H 105 -22.660 -18.214 -94.624 1.00 68.43 C
-ANISOU 791 CD1 TYR H 105 12723 6676 6599 143 -2199 -1538 C
-ATOM 792 CD2 TYR H 105 -21.459 -18.388 -96.673 1.00 76.01 C
-ANISOU 792 CD2 TYR H 105 13923 7644 7315 349 -2043 -1736 C
-ATOM 793 CE1 TYR H 105 -23.700 -18.950 -95.166 1.00 69.94 C
-ANISOU 793 CE1 TYR H 105 12968 6866 6739 85 -2383 -1630 C
-ATOM 794 CE2 TYR H 105 -22.494 -19.122 -97.223 1.00 78.61 C
-ANISOU 794 CE2 TYR H 105 14339 7939 7591 323 -2247 -1818 C
-ATOM 795 CZ TYR H 105 -23.611 -19.400 -96.464 1.00 76.81 C
-ANISOU 795 CZ TYR H 105 14006 7712 7465 178 -2419 -1768 C
-ATOM 796 OH TYR H 105 -24.646 -20.129 -97.006 1.00 86.00 O
-ANISOU 796 OH TYR H 105 15224 8878 8572 102 -2620 -1873 O
-ATOM 797 N PHE H 106 -20.074 -14.935 -91.934 1.00 76.07 N
-ANISOU 797 N PHE H 106 13412 7749 7743 96 -1680 -1163 N
-ATOM 798 CA PHE H 106 -19.204 -14.156 -91.052 1.00 76.65 C
-ANISOU 798 CA PHE H 106 13399 7840 7886 42 -1553 -1084 C
-ATOM 799 C PHE H 106 -18.265 -15.094 -90.306 1.00 79.16 C
-ANISOU 799 C PHE H 106 13574 8111 8392 62 -1575 -1156 C
-ATOM 800 O PHE H 106 -18.622 -15.652 -89.265 1.00 78.91 O
-ANISOU 800 O PHE H 106 13497 7991 8493 35 -1709 -1105 O
-ATOM 801 CB PHE H 106 -20.041 -13.333 -90.082 1.00 71.16 C
-ANISOU 801 CB PHE H 106 12687 7144 7207 -5 -1611 -940 C
-ATOM 802 CG PHE H 106 -21.101 -12.513 -90.751 1.00 76.01 C
-ANISOU 802 CG PHE H 106 13443 7801 7635 55 -1661 -904 C
-ATOM 803 CD1 PHE H 106 -20.781 -11.679 -91.808 1.00 75.97 C
-ANISOU 803 CD1 PHE H 106 13650 7797 7418 87 -1560 -904 C
-ATOM 804 CD2 PHE H 106 -22.421 -12.592 -90.339 1.00 74.84 C
-ANISOU 804 CD2 PHE H 106 13227 7707 7500 80 -1818 -889 C
-ATOM 805 CE1 PHE H 106 -21.750 -10.925 -92.428 1.00 61.34 C
-ANISOU 805 CE1 PHE H 106 11986 5953 5369 194 -1655 -878 C
-ATOM 806 CE2 PHE H 106 -23.399 -11.838 -90.961 1.00 73.81 C
-ANISOU 806 CE2 PHE H 106 13202 7646 7194 201 -1905 -896 C
-ATOM 807 CZ PHE H 106 -23.062 -11.002 -92.005 1.00 61.10 C
-ANISOU 807 CZ PHE H 106 11853 5991 5372 283 -1845 -886 C
-ATOM 808 N ASP H 107 -17.046 -15.249 -90.825 1.00 76.67 N
-ANISOU 808 N ASP H 107 13196 7867 8066 115 -1448 -1288 N
-ATOM 809 CA ASP H 107 -16.098 -16.169 -90.209 1.00 77.59 C
-ANISOU 809 CA ASP H 107 13174 7958 8347 214 -1509 -1405 C
-ATOM 810 C ASP H 107 -15.407 -15.541 -88.998 1.00 71.29 C
-ANISOU 810 C ASP H 107 12226 7201 7662 155 -1473 -1337 C
-ATOM 811 O ASP H 107 -15.392 -16.133 -87.913 1.00 74.68 O
-ANISOU 811 O ASP H 107 12628 7517 8231 199 -1633 -1308 O
-ATOM 812 CB ASP H 107 -15.077 -16.643 -91.248 1.00 70.83 C
-ANISOU 812 CB ASP H 107 12255 7224 7434 338 -1398 -1630 C
-ATOM 813 CG ASP H 107 -14.489 -15.503 -92.056 1.00 84.78 C
-ANISOU 813 CG ASP H 107 13993 9191 9030 215 -1123 -1649 C
-ATOM 814 OD1 ASP H 107 -15.043 -14.386 -92.003 1.00 86.12 O
-ANISOU 814 OD1 ASP H 107 14280 9344 9096 59 -1056 -1476 O
-ATOM 815 OD2 ASP H 107 -13.476 -15.727 -92.750 1.00 89.68 O
-ANISOU 815 OD2 ASP H 107 14494 9985 9595 271 -973 -1851 O
-ATOM 816 N TYR H 108 -14.837 -14.347 -89.154 1.00 63.13 N
-ANISOU 816 N TYR H 108 11132 6308 6546 35 -1273 -1310 N
-ATOM 817 CA TYR H 108 -14.097 -13.690 -88.083 1.00 65.86 C
-ANISOU 817 CA TYR H 108 11332 6709 6983 -47 -1233 -1271 C
-ATOM 818 C TYR H 108 -14.791 -12.398 -87.668 1.00 69.90 C
-ANISOU 818 C TYR H 108 11982 7169 7408 -207 -1184 -1069 C
-ATOM 819 O TYR H 108 -15.246 -11.624 -88.516 1.00 68.19 O
-ANISOU 819 O TYR H 108 11942 6958 7009 -280 -1081 -1011 O
-ATOM 820 CB TYR H 108 -12.651 -13.388 -88.500 1.00 73.29 C
-ANISOU 820 CB TYR H 108 12061 7883 7902 -91 -1037 -1452 C
-ATOM 821 CG TYR H 108 -11.776 -14.612 -88.678 1.00 89.71 C
-ANISOU 821 CG TYR H 108 13941 10056 10087 136 -1108 -1703 C
-ATOM 822 CD1 TYR H 108 -12.214 -15.876 -88.302 1.00 92.66 C
-ANISOU 822 CD1 TYR H 108 14398 10236 10572 354 -1366 -1726 C
-ATOM 823 CD2 TYR H 108 -10.501 -14.499 -89.211 1.00 99.87 C
-ANISOU 823 CD2 TYR H 108 14971 11633 11343 129 -922 -1936 C
-ATOM 824 CE1 TYR H 108 -11.410 -16.991 -88.468 1.00 97.50 C
-ANISOU 824 CE1 TYR H 108 14892 10893 11259 617 -1471 -1970 C
-ATOM 825 CE2 TYR H 108 -9.690 -15.606 -89.378 1.00 99.88 C
-ANISOU 825 CE2 TYR H 108 14769 11748 11431 403 -1007 -2209 C
-ATOM 826 CZ TYR H 108 -10.147 -16.848 -89.006 1.00 96.61 C
-ANISOU 826 CZ TYR H 108 14491 11091 11125 676 -1300 -2223 C
-ATOM 827 OH TYR H 108 -9.336 -17.947 -89.175 1.00 97.96 O
-ANISOU 827 OH TYR H 108 14521 11337 11362 1002 -1422 -2510 O
-ATOM 828 N TRP H 109 -14.844 -12.160 -86.360 1.00 70.84 N
-ANISOU 828 N TRP H 109 12054 7227 7636 -236 -1276 -973 N
-ATOM 829 CA TRP H 109 -15.549 -11.027 -85.778 1.00 67.58 C
-ANISOU 829 CA TRP H 109 11775 6750 7151 -336 -1267 -802 C
-ATOM 830 C TRP H 109 -14.593 -10.135 -84.995 1.00 72.02 C
-ANISOU 830 C TRP H 109 12260 7362 7741 -468 -1186 -789 C
-ATOM 831 O TRP H 109 -13.423 -10.463 -84.777 1.00 67.12 O
-ANISOU 831 O TRP H 109 11431 6853 7218 -479 -1157 -919 O
-ATOM 832 CB TRP H 109 -16.670 -11.497 -84.843 1.00 59.48 C
-ANISOU 832 CB TRP H 109 10785 5617 6199 -279 -1446 -702 C
-ATOM 833 CG TRP H 109 -17.773 -12.249 -85.505 1.00 64.73 C
-ANISOU 833 CG TRP H 109 11520 6252 6824 -212 -1533 -713 C
-ATOM 834 CD1 TRP H 109 -17.660 -13.382 -86.252 1.00 73.07 C
-ANISOU 834 CD1 TRP H 109 12564 7292 7908 -140 -1582 -826 C
-ATOM 835 CD2 TRP H 109 -19.171 -11.947 -85.440 1.00 62.75 C
-ANISOU 835 CD2 TRP H 109 11346 6002 6495 -208 -1599 -634 C
-ATOM 836 NE1 TRP H 109 -18.899 -13.794 -86.676 1.00 76.93 N
-ANISOU 836 NE1 TRP H 109 13131 7759 8340 -133 -1672 -811 N
-ATOM 837 CE2 TRP H 109 -19.845 -12.931 -86.188 1.00 65.19 C
-ANISOU 837 CE2 TRP H 109 11669 6310 6792 -172 -1683 -704 C
-ATOM 838 CE3 TRP H 109 -19.918 -10.935 -84.830 1.00 60.64 C
-ANISOU 838 CE3 TRP H 109 11126 5756 6159 -214 -1605 -540 C
-ATOM 839 CZ2 TRP H 109 -21.227 -12.932 -86.343 1.00 59.20 C
-ANISOU 839 CZ2 TRP H 109 10924 5609 5963 -170 -1767 -691 C
-ATOM 840 CZ3 TRP H 109 -21.289 -10.939 -84.983 1.00 55.06 C
-ANISOU 840 CZ3 TRP H 109 10424 5116 5380 -165 -1689 -539 C
-ATOM 841 CH2 TRP H 109 -21.930 -11.930 -85.734 1.00 64.94 C
-ANISOU 841 CH2 TRP H 109 11642 6402 6629 -156 -1767 -618 C
-ATOM 842 N GLY H 110 -15.122 -8.981 -84.568 1.00 70.32 N
-ANISOU 842 N GLY H 110 12217 7073 7428 -554 -1167 -651 N
-ATOM 843 CA GLY H 110 -14.470 -8.173 -83.561 1.00 72.39 C
-ANISOU 843 CA GLY H 110 12449 7333 7722 -679 -1145 -615 C
-ATOM 844 C GLY H 110 -14.972 -8.521 -82.168 1.00 83.67 C
-ANISOU 844 C GLY H 110 13836 8683 9272 -595 -1317 -540 C
-ATOM 845 O GLY H 110 -15.913 -9.293 -81.997 1.00 90.27 O
-ANISOU 845 O GLY H 110 14686 9468 10146 -480 -1430 -504 O
-ATOM 846 N GLN H 111 -14.321 -7.939 -81.160 1.00 83.53 N
-ANISOU 846 N GLN H 111 13777 8663 9296 -687 -1328 -524 N
-ATOM 847 CA GLN H 111 -14.697 -8.234 -79.783 1.00 68.17 C
-ANISOU 847 CA GLN H 111 11822 6645 7436 -624 -1481 -456 C
-ATOM 848 C GLN H 111 -15.995 -7.551 -79.370 1.00 79.10 C
-ANISOU 848 C GLN H 111 13402 7944 8708 -594 -1503 -326 C
-ATOM 849 O GLN H 111 -16.585 -7.936 -78.354 1.00 84.21 O
-ANISOU 849 O GLN H 111 14048 8555 9391 -547 -1605 -272 O
-ATOM 850 CB GLN H 111 -13.570 -7.832 -78.828 1.00 56.03 C
-ANISOU 850 CB GLN H 111 10180 5142 5966 -717 -1509 -500 C
-ATOM 851 CG GLN H 111 -13.460 -6.339 -78.565 1.00 74.49 C
-ANISOU 851 CG GLN H 111 12680 7441 8183 -885 -1421 -436 C
-ATOM 852 CD GLN H 111 -12.703 -5.599 -79.648 1.00 84.57 C
-ANISOU 852 CD GLN H 111 13978 8795 9359 -1079 -1235 -504 C
-ATOM 853 OE1 GLN H 111 -12.381 -6.161 -80.694 1.00 94.01 O
-ANISOU 853 OE1 GLN H 111 15060 10099 10563 -1070 -1148 -597 O
-ATOM 854 NE2 GLN H 111 -12.408 -4.330 -79.398 1.00 82.17 N
-ANISOU 854 NE2 GLN H 111 13854 8429 8937 -1279 -1167 -462 N
-ATOM 855 N GLY H 112 -16.454 -6.561 -80.134 1.00 86.63 N
-ANISOU 855 N GLY H 112 14538 8873 9505 -609 -1417 -290 N
-ATOM 856 CA GLY H 112 -17.685 -5.856 -79.832 1.00 77.01 C
-ANISOU 856 CA GLY H 112 13493 7604 8166 -509 -1462 -214 C
-ATOM 857 C GLY H 112 -17.494 -4.724 -78.848 1.00 73.26 C
-ANISOU 857 C GLY H 112 13164 7046 7624 -559 -1470 -163 C
-ATOM 858 O GLY H 112 -16.785 -4.888 -77.851 1.00 92.90 O
-ANISOU 858 O GLY H 112 15553 9534 10213 -642 -1503 -165 O
-ATOM 859 N THR H 113 -18.106 -3.571 -79.107 1.00 73.30 N
-ANISOU 859 N THR H 113 13437 6965 7448 -489 -1468 -127 N
-ATOM 860 CA THR H 113 -18.037 -2.449 -78.180 1.00 86.52 C
-ANISOU 860 CA THR H 113 15313 8528 9032 -508 -1496 -88 C
-ATOM 861 C THR H 113 -19.387 -2.248 -77.507 1.00 89.42 C
-ANISOU 861 C THR H 113 15714 8932 9330 -274 -1589 -85 C
-ATOM 862 O THR H 113 -20.438 -2.520 -78.092 1.00 79.90 O
-ANISOU 862 O THR H 113 14467 7816 8076 -97 -1624 -119 O
-ATOM 863 CB THR H 113 -17.629 -1.142 -78.874 1.00 78.08 C
-ANISOU 863 CB THR H 113 14613 7288 7764 -606 -1442 -63 C
-ATOM 864 OG1 THR H 113 -18.702 -0.681 -79.701 1.00 75.83 O
-ANISOU 864 OG1 THR H 113 14567 6945 7301 -384 -1495 -56 O
-ATOM 865 CG2 THR H 113 -16.396 -1.347 -79.731 1.00 69.26 C
-ANISOU 865 CG2 THR H 113 13434 6204 6678 -870 -1304 -94 C
-ATOM 866 N LEU H 114 -19.349 -1.769 -76.267 1.00 85.27 N
-ANISOU 866 N LEU H 114 15241 8366 8790 -276 -1627 -69 N
-ATOM 867 CA LEU H 114 -20.563 -1.433 -75.535 1.00 80.79 C
-ANISOU 867 CA LEU H 114 14703 7867 8127 -56 -1691 -99 C
-ATOM 868 C LEU H 114 -20.886 0.038 -75.761 1.00 77.93 C
-ANISOU 868 C LEU H 114 14723 7341 7547 106 -1744 -112 C
-ATOM 869 O LEU H 114 -20.050 0.908 -75.498 1.00 83.79 O
-ANISOU 869 O LEU H 114 15728 7886 8224 -29 -1741 -74 O
-ATOM 870 CB LEU H 114 -20.397 -1.723 -74.044 1.00 77.88 C
-ANISOU 870 CB LEU H 114 14227 7541 7824 -128 -1705 -84 C
-ATOM 871 CG LEU H 114 -21.489 -1.177 -73.117 1.00 78.99 C
-ANISOU 871 CG LEU H 114 14419 7764 7829 72 -1740 -135 C
-ATOM 872 CD1 LEU H 114 -22.854 -1.758 -73.469 1.00 67.86 C
-ANISOU 872 CD1 LEU H 114 12792 6600 6393 238 -1731 -214 C
-ATOM 873 CD2 LEU H 114 -21.143 -1.433 -71.651 1.00 81.86 C
-ANISOU 873 CD2 LEU H 114 14735 8139 8228 -43 -1743 -108 C
-ATOM 874 N VAL H 115 -22.090 0.316 -76.253 1.00 72.91 N
-ANISOU 874 N VAL H 115 14136 6780 6784 397 -1813 -181 N
-ATOM 875 CA VAL H 115 -22.577 1.680 -76.420 1.00 75.99 C
-ANISOU 875 CA VAL H 115 14932 7003 6937 651 -1918 -220 C
-ATOM 876 C VAL H 115 -23.784 1.861 -75.513 1.00 78.84 C
-ANISOU 876 C VAL H 115 15166 7558 7230 957 -1989 -341 C
-ATOM 877 O VAL H 115 -24.786 1.141 -75.646 1.00 70.89 O
-ANISOU 877 O VAL H 115 13826 6843 6266 1100 -1994 -435 O
-ATOM 878 CB VAL H 115 -22.929 1.997 -77.880 1.00 77.32 C
-ANISOU 878 CB VAL H 115 15326 7087 6965 801 -1981 -234 C
-ATOM 879 CG1 VAL H 115 -23.519 3.394 -77.985 1.00 81.67 C
-ANISOU 879 CG1 VAL H 115 16361 7431 7239 1130 -2143 -286 C
-ATOM 880 CG2 VAL H 115 -21.692 1.878 -78.751 1.00 78.24 C
-ANISOU 880 CG2 VAL H 115 15577 7038 7111 463 -1871 -130 C
-ATOM 881 N THR H 116 -23.683 2.817 -74.591 1.00 85.13 N
-ANISOU 881 N THR H 116 16218 8215 7912 1038 -2036 -357 N
-ATOM 882 CA THR H 116 -24.703 3.069 -73.580 1.00 82.35 C
-ANISOU 882 CA THR H 116 15753 8061 7475 1318 -2079 -493 C
-ATOM 883 C THR H 116 -25.355 4.413 -73.876 1.00 79.73 C
-ANISOU 883 C THR H 116 15840 7571 6882 1739 -2252 -603 C
-ATOM 884 O THR H 116 -24.662 5.430 -73.963 1.00 79.89 O
-ANISOU 884 O THR H 116 16364 7219 6770 1699 -2321 -535 O
-ATOM 885 CB THR H 116 -24.091 3.067 -72.175 1.00 80.11 C
-ANISOU 885 CB THR H 116 15454 7744 7242 1118 -2015 -447 C
-ATOM 886 OG1 THR H 116 -23.229 1.931 -72.019 1.00 70.07 O
-ANISOU 886 OG1 THR H 116 13918 6518 6189 740 -1906 -330 O
-ATOM 887 CG2 THR H 116 -25.183 3.021 -71.109 1.00 72.44 C
-ANISOU 887 CG2 THR H 116 14265 7067 6193 1346 -2001 -595 C
-ATOM 888 N VAL H 117 -26.677 4.419 -74.032 1.00 78.30 N
-ANISOU 888 N VAL H 117 15464 7672 6613 2139 -2337 -790 N
-ATOM 889 CA VAL H 117 -27.432 5.634 -74.329 1.00 71.20 C
-ANISOU 889 CA VAL H 117 14943 6657 5451 2647 -2552 -943 C
-ATOM 890 C VAL H 117 -28.462 5.833 -73.227 1.00 73.06 C
-ANISOU 890 C VAL H 117 14928 7225 5608 2981 -2569 -1169 C
-ATOM 891 O VAL H 117 -29.391 5.029 -73.080 1.00 73.26 O
-ANISOU 891 O VAL H 117 14405 7723 5708 3055 -2499 -1317 O
-ATOM 892 CB VAL H 117 -28.110 5.580 -75.704 1.00 72.49 C
-ANISOU 892 CB VAL H 117 15122 6881 5540 2917 -2692 -1017 C
-ATOM 893 CG1 VAL H 117 -28.919 6.847 -75.934 1.00 76.49 C
-ANISOU 893 CG1 VAL H 117 16055 7256 5751 3517 -2965 -1199 C
-ATOM 894 CG2 VAL H 117 -27.076 5.405 -76.796 1.00 80.66 C
-ANISOU 894 CG2 VAL H 117 16428 7602 6619 2572 -2647 -803 C
-ATOM 895 N SER H 118 -28.311 6.915 -72.469 1.00 83.10 N
-ANISOU 895 N SER H 118 16604 8262 6708 3166 -2657 -1213 N
-ATOM 896 CA SER H 118 -29.213 7.228 -71.372 1.00 96.09 C
-ANISOU 896 CA SER H 118 18063 10206 8241 3505 -2666 -1448 C
-ATOM 897 C SER H 118 -28.990 8.672 -70.959 1.00101.09 C
-ANISOU 897 C SER H 118 19350 10430 8627 3800 -2849 -1495 C
-ATOM 898 O SER H 118 -27.875 9.191 -71.051 1.00100.09 O
-ANISOU 898 O SER H 118 19729 9822 8479 3517 -2874 -1294 O
-ATOM 899 CB SER H 118 -28.994 6.301 -70.174 1.00100.61 C
-ANISOU 899 CB SER H 118 18198 11056 8975 3116 -2419 -1397 C
-ATOM 900 OG SER H 118 -29.740 6.746 -69.054 1.00105.34 O
-ANISOU 900 OG SER H 118 18702 11901 9420 3412 -2408 -1618 O
-ATOM 901 N SER H 119 -30.060 9.309 -70.489 1.00104.50 N
-ANISOU 901 N SER H 119 19764 11078 8865 4362 -2976 -1786 N
-ATOM 902 CA SER H 119 -29.994 10.693 -70.039 1.00110.26 C
-ANISOU 902 CA SER H 119 21098 11428 9367 4711 -3167 -1853 C
-ATOM 903 C SER H 119 -29.332 10.844 -68.672 1.00108.01 C
-ANISOU 903 C SER H 119 20903 11045 9091 4429 -3034 -1788 C
-ATOM 904 O SER H 119 -29.424 11.920 -68.071 1.00109.37 O
-ANISOU 904 O SER H 119 21400 11002 9154 4704 -3145 -1828 O
-ATOM 905 CB SER H 119 -31.399 11.303 -70.011 1.00112.77 C
-ANISOU 905 CB SER H 119 21254 12051 9541 5445 -3346 -2176 C
-ATOM 906 OG SER H 119 -32.296 10.495 -69.270 1.00110.69 O
-ANISOU 906 OG SER H 119 20322 12473 9264 5546 -3185 -2468 O
-ATOM 907 N ALA H 120 -28.670 9.805 -68.176 1.00102.26 N
-ANISOU 907 N ALA H 120 19825 10466 8566 3873 -2795 -1628 N
-ATOM 908 CA ALA H 120 -27.992 9.854 -66.892 1.00 97.01 C
-ANISOU 908 CA ALA H 120 19235 9714 7912 3584 -2685 -1556 C
-ATOM 909 C ALA H 120 -26.546 10.310 -67.066 1.00106.07 C
-ANISOU 909 C ALA H 120 20909 10299 9093 3162 -2735 -1301 C
-ATOM 910 O ALA H 120 -26.015 10.382 -68.176 1.00114.45 O
-ANISOU 910 O ALA H 120 22194 11091 10199 2998 -2790 -1155 O
-ATOM 911 CB ALA H 120 -28.045 8.487 -66.210 1.00 87.34 C
-ANISOU 911 CB ALA H 120 17361 8934 6891 3210 -2420 -1504 C
-ATOM 912 N SER H 121 -25.907 10.618 -65.942 1.00109.94 N
-ANISOU 912 N SER H 121 21586 10638 9546 2966 -2708 -1264 N
-ATOM 913 CA SER H 121 -24.522 11.061 -65.911 1.00112.81 C
-ANISOU 913 CA SER H 121 22348 10544 9969 2520 -2736 -1045 C
-ATOM 914 C SER H 121 -23.687 10.083 -65.094 1.00110.79 C
-ANISOU 914 C SER H 121 21755 10440 9902 2030 -2576 -928 C
-ATOM 915 O SER H 121 -24.211 9.244 -64.357 1.00117.51 O
-ANISOU 915 O SER H 121 22142 11685 10820 2051 -2443 -986 O
-ATOM 916 CB SER H 121 -24.411 12.477 -65.333 1.00118.15 C
-ANISOU 916 CB SER H 121 23512 10873 10505 2708 -2873 -1034 C
-ATOM 917 OG SER H 121 -25.135 13.403 -66.124 1.00123.28 O
-ANISOU 917 OG SER H 121 24465 11363 11014 3167 -3047 -1075 O
-ATOM 918 N THR H 122 -22.369 10.198 -65.235 1.00104.81 N
-ANISOU 918 N THR H 122 21213 9376 9235 1572 -2588 -758 N
-ATOM 919 CA THR H 122 -21.453 9.298 -64.545 1.00 93.51 C
-ANISOU 919 CA THR H 122 19452 8067 8009 1132 -2480 -641 C
-ATOM 920 C THR H 122 -21.525 9.528 -63.040 1.00 98.72 C
-ANISOU 920 C THR H 122 20180 8774 8555 1194 -2501 -726 C
-ATOM 921 O THR H 122 -21.270 10.640 -62.564 1.00111.99 O
-ANISOU 921 O THR H 122 22334 10158 10061 1257 -2626 -777 O
-ATOM 922 CB THR H 122 -20.027 9.501 -65.051 1.00 86.69 C
-ANISOU 922 CB THR H 122 18786 6907 7244 660 -2505 -497 C
-ATOM 923 OG1 THR H 122 -19.929 9.042 -66.406 1.00104.35 O
-ANISOU 923 OG1 THR H 122 20872 9174 9601 560 -2440 -415 O
-ATOM 924 CG2 THR H 122 -19.039 8.738 -64.186 1.00 75.53 C
-ANISOU 924 CG2 THR H 122 17082 5606 6010 284 -2459 -427 C
-ATOM 925 N LYS H 123 -21.872 8.479 -62.294 1.00 90.04 N
-ANISOU 925 N LYS H 123 18634 8035 7544 1158 -2374 -732 N
-ATOM 926 CA LYS H 123 -21.974 8.544 -60.841 1.00 81.53 C
-ANISOU 926 CA LYS H 123 17597 7044 6339 1192 -2367 -805 C
-ATOM 927 C LYS H 123 -21.296 7.324 -60.241 1.00 85.67 C
-ANISOU 927 C LYS H 123 17790 7723 7040 821 -2290 -673 C
-ATOM 928 O LYS H 123 -21.538 6.197 -60.681 1.00 69.74 O
-ANISOU 928 O LYS H 123 15374 5943 5180 725 -2176 -605 O
-ATOM 929 CB LYS H 123 -23.437 8.615 -60.382 1.00 86.86 C
-ANISOU 929 CB LYS H 123 18127 8049 6825 1627 -2285 -1005 C
-ATOM 930 CG LYS H 123 -23.620 8.733 -58.872 1.00 76.54 C
-ANISOU 930 CG LYS H 123 16889 6856 5336 1675 -2251 -1102 C
-ATOM 931 N GLY H 124 -20.455 7.550 -59.237 1.00 97.25 N
-ANISOU 931 N GLY H 124 19455 9035 8462 629 -2378 -648 N
-ATOM 932 CA GLY H 124 -19.803 6.472 -58.538 1.00 98.93 C
-ANISOU 932 CA GLY H 124 19433 9360 8795 340 -2362 -544 C
-ATOM 933 C GLY H 124 -20.784 5.660 -57.717 1.00 85.92 C
-ANISOU 933 C GLY H 124 17562 8044 7038 444 -2216 -582 C
-ATOM 934 O GLY H 124 -21.807 6.167 -57.246 1.00 77.46 O
-ANISOU 934 O GLY H 124 16565 7118 5748 728 -2142 -730 O
-ATOM 935 N PRO H 125 -20.484 4.380 -57.526 1.00 85.63 N
-ANISOU 935 N PRO H 125 17267 8138 7129 210 -2171 -464 N
-ATOM 936 CA PRO H 125 -21.410 3.504 -56.804 1.00 84.70 C
-ANISOU 936 CA PRO H 125 16971 8327 6885 217 -2008 -480 C
-ATOM 937 C PRO H 125 -21.415 3.780 -55.309 1.00 92.33 C
-ANISOU 937 C PRO H 125 18185 9296 7600 221 -2026 -532 C
-ATOM 938 O PRO H 125 -20.496 4.381 -54.749 1.00 87.35 O
-ANISOU 938 O PRO H 125 17835 8414 6938 163 -2203 -523 O
-ATOM 939 CB PRO H 125 -20.867 2.104 -57.101 1.00 72.63 C
-ANISOU 939 CB PRO H 125 15218 6821 5558 -58 -2013 -318 C
-ATOM 940 CG PRO H 125 -19.409 2.316 -57.312 1.00 74.44 C
-ANISOU 940 CG PRO H 125 15558 6766 5961 -206 -2223 -246 C
-ATOM 941 CD PRO H 125 -19.287 3.657 -57.990 1.00 85.72 C
-ANISOU 941 CD PRO H 125 17153 8026 7389 -71 -2272 -327 C
-ATOM 942 N SER H 126 -22.487 3.325 -54.663 1.00 88.08 N
-ANISOU 942 N SER H 126 14184 10014 9269 244 -1446 -907 N
-ATOM 943 CA SER H 126 -22.617 3.357 -53.211 1.00 89.55 C
-ANISOU 943 CA SER H 126 14248 10259 9519 75 -1406 -976 C
-ATOM 944 C SER H 126 -22.659 1.921 -52.710 1.00 84.53 C
-ANISOU 944 C SER H 126 13484 9730 8905 -70 -1346 -988 C
-ATOM 945 O SER H 126 -23.569 1.164 -53.064 1.00 98.39 O
-ANISOU 945 O SER H 126 15149 11553 10682 -40 -1398 -1098 O
-ATOM 946 CB SER H 126 -23.872 4.120 -52.783 1.00 94.81 C
-ANISOU 946 CB SER H 126 14860 10955 10209 193 -1451 -1179 C
-ATOM 947 OG SER H 126 -23.846 5.452 -53.264 1.00104.29 O
-ANISOU 947 OG SER H 126 16236 12009 11380 350 -1542 -1173 O
-ATOM 948 N VAL H 127 -21.675 1.544 -51.900 1.00 65.73 N
-ANISOU 948 N VAL H 127 11103 7335 6534 -242 -1287 -858 N
-ATOM 949 CA VAL H 127 -21.538 0.176 -51.417 1.00 69.19 C
-ANISOU 949 CA VAL H 127 11477 7831 6982 -377 -1247 -833 C
-ATOM 950 C VAL H 127 -22.188 0.073 -50.044 1.00 76.60 C
-ANISOU 950 C VAL H 127 12368 8840 7896 -530 -1206 -936 C
-ATOM 951 O VAL H 127 -21.826 0.809 -49.118 1.00 78.95 O
-ANISOU 951 O VAL H 127 12766 9090 8142 -600 -1210 -920 O
-ATOM 952 CB VAL H 127 -20.066 -0.253 -51.358 1.00 63.54 C
-ANISOU 952 CB VAL H 127 10780 7056 6308 -437 -1218 -601 C
-ATOM 953 CG1 VAL H 127 -19.967 -1.712 -50.931 1.00 67.96 C
-ANISOU 953 CG1 VAL H 127 11321 7635 6865 -531 -1206 -583 C
-ATOM 954 CG2 VAL H 127 -19.396 -0.027 -52.704 1.00 68.75 C
-ANISOU 954 CG2 VAL H 127 11488 7664 6970 -242 -1153 -459 C
-ATOM 955 N PHE H 128 -23.145 -0.847 -49.907 1.00 74.09 N
-ANISOU 955 N PHE H 128 11934 8614 7602 -590 -1172 -1023 N
-ATOM 956 CA PHE H 128 -23.782 -1.091 -48.628 1.00 62.28 C
-ANISOU 956 CA PHE H 128 10389 7207 6068 -734 -1050 -1072 C
-ATOM 957 C PHE H 128 -23.572 -2.538 -48.201 1.00 74.43 C
-ANISOU 957 C PHE H 128 11936 8740 7603 -938 -1046 -981 C
-ATOM 958 O PHE H 128 -23.580 -3.440 -49.044 1.00 85.07 O
-ANISOU 958 O PHE H 128 13260 10043 9018 -940 -1146 -958 O
-ATOM 959 CB PHE H 128 -25.282 -0.785 -48.687 1.00 59.01 C
-ANISOU 959 CB PHE H 128 9754 6927 5742 -646 -966 -1208 C
-ATOM 960 CG PHE H 128 -25.590 0.639 -49.022 1.00 68.47 C
-ANISOU 960 CG PHE H 128 10972 8106 6938 -405 -978 -1308 C
-ATOM 961 CD1 PHE H 128 -25.117 1.666 -48.224 1.00 62.54 C
-ANISOU 961 CD1 PHE H 128 10448 7272 6042 -352 -921 -1332 C
-ATOM 962 CD2 PHE H 128 -26.359 0.956 -50.128 1.00 83.81 C
-ANISOU 962 CD2 PHE H 128 12760 10070 9012 -230 -1100 -1378 C
-ATOM 963 CE1 PHE H 128 -25.398 2.984 -48.526 1.00 71.55 C
-ANISOU 963 CE1 PHE H 128 11672 8342 7173 -121 -960 -1426 C
-ATOM 964 CE2 PHE H 128 -26.645 2.275 -50.437 1.00 88.39 C
-ANISOU 964 CE2 PHE H 128 13393 10603 9588 14 -1135 -1461 C
-ATOM 965 CZ PHE H 128 -26.162 3.290 -49.635 1.00 79.21 C
-ANISOU 965 CZ PHE H 128 12465 9347 8284 72 -1051 -1487 C
-ATOM 966 N PRO H 129 -23.378 -2.791 -46.911 1.00 76.61 N
-ANISOU 966 N PRO H 129 12318 9021 7768 -1099 -957 -929 N
-ATOM 967 CA PRO H 129 -23.122 -4.161 -46.460 1.00 78.59 C
-ANISOU 967 CA PRO H 129 12629 9231 8002 -1295 -977 -820 C
-ATOM 968 C PRO H 129 -24.389 -5.000 -46.398 1.00 85.94 C
-ANISOU 968 C PRO H 129 13385 10253 9016 -1434 -887 -844 C
-ATOM 969 O PRO H 129 -25.502 -4.492 -46.243 1.00100.27 O
-ANISOU 969 O PRO H 129 14998 12210 10888 -1403 -734 -920 O
-ATOM 970 CB PRO H 129 -22.529 -3.959 -45.061 1.00 64.54 C
-ANISOU 970 CB PRO H 129 11081 7406 6036 -1410 -943 -751 C
-ATOM 971 CG PRO H 129 -23.139 -2.688 -44.592 1.00 64.28 C
-ANISOU 971 CG PRO H 129 11086 7439 5898 -1300 -805 -878 C
-ATOM 972 CD PRO H 129 -23.282 -1.818 -45.810 1.00 72.92 C
-ANISOU 972 CD PRO H 129 12022 8545 7138 -1090 -872 -966 C
-ATOM 973 N LEU H 130 -24.196 -6.313 -46.528 1.00 70.60 N
-ANISOU 973 N LEU H 130 11507 8209 7109 -1585 -994 -754 N
-ATOM 974 CA LEU H 130 -25.251 -7.319 -46.386 1.00 77.55 C
-ANISOU 974 CA LEU H 130 12254 9115 8096 -1814 -972 -713 C
-ATOM 975 C LEU H 130 -24.748 -8.318 -45.350 1.00 94.86 C
-ANISOU 975 C LEU H 130 14678 11205 10159 -2033 -946 -562 C
-ATOM 976 O LEU H 130 -24.093 -9.307 -45.693 1.00106.24 O
-ANISOU 976 O LEU H 130 16303 12457 11604 -2068 -1140 -498 O
-ATOM 977 CB LEU H 130 -25.581 -7.989 -47.712 1.00 81.68 C
-ANISOU 977 CB LEU H 130 12731 9526 8779 -1796 -1230 -758 C
-ATOM 978 CG LEU H 130 -26.201 -7.093 -48.787 1.00 80.35 C
-ANISOU 978 CG LEU H 130 12370 9432 8726 -1593 -1317 -893 C
-ATOM 979 CD1 LEU H 130 -26.450 -7.873 -50.070 1.00 63.95 C
-ANISOU 979 CD1 LEU H 130 10389 7177 6731 -1583 -1644 -938 C
-ATOM 980 CD2 LEU H 130 -27.491 -6.456 -48.279 1.00 81.37 C
-ANISOU 980 CD2 LEU H 130 12126 9785 9007 -1647 -1134 -912 C
-ATOM 981 N ALA H 131 -25.068 -8.052 -44.079 1.00 95.27 N
-ANISOU 981 N ALA H 131 14772 11362 10065 -2147 -699 -505 N
-ATOM 982 CA ALA H 131 -24.486 -8.750 -42.947 1.00 83.36 C
-ANISOU 982 CA ALA H 131 13574 9747 8353 -2321 -679 -359 C
-ATOM 983 C ALA H 131 -25.240 -10.046 -42.653 1.00 86.44 C
-ANISOU 983 C ALA H 131 13937 10091 8813 -2630 -633 -211 C
-ATOM 984 O ALA H 131 -26.439 -10.151 -42.928 1.00 85.20 O
-ANISOU 984 O ALA H 131 13459 10062 8853 -2748 -509 -201 O
-ATOM 985 CB ALA H 131 -24.502 -7.851 -41.716 1.00 82.01 C
-ANISOU 985 CB ALA H 131 13581 9667 7911 -2283 -441 -368 C
-ATOM 986 N PRO H 132 -24.549 -11.054 -42.089 1.00 91.82 N
-ANISOU 986 N PRO H 132 14943 10576 9370 -2780 -764 -67 N
-ATOM 987 CA PRO H 132 -25.167 -12.324 -41.688 1.00104.26 C
-ANISOU 987 CA PRO H 132 16579 12051 10984 -3115 -743 114 C
-ATOM 988 C PRO H 132 -26.295 -12.156 -40.670 1.00107.66 C
-ANISOU 988 C PRO H 132 16878 12687 11340 -3324 -322 237 C
-ATOM 989 O PRO H 132 -26.343 -12.913 -39.699 1.00104.84 O
-ANISOU 989 O PRO H 132 16777 12245 10811 -3567 -212 438 O
-ATOM 990 CB PRO H 132 -24.001 -13.100 -41.065 1.00102.61 C
-ANISOU 990 CB PRO H 132 16820 11592 10576 -3145 -946 236 C
-ATOM 991 CG PRO H 132 -22.784 -12.513 -41.677 1.00 89.84 C
-ANISOU 991 CG PRO H 132 15242 9921 8973 -2814 -1165 118 C
-ATOM 992 CD PRO H 132 -23.092 -11.061 -41.866 1.00 78.90 C
-ANISOU 992 CD PRO H 132 13612 8774 7592 -2637 -985 -40 C
-ATOM 993 N GLY H 140 -25.078 -23.195 -39.044 1.00119.98 N
-ANISOU 993 N GLY H 140 21321 11442 12823 -5430 -2258 1769 N
-ATOM 994 CA GLY H 140 -24.171 -24.038 -39.802 1.00124.72 C
-ANISOU 994 CA GLY H 140 22348 11598 13443 -5156 -2748 1648 C
-ATOM 995 C GLY H 140 -23.388 -23.298 -40.870 1.00123.57 C
-ANISOU 995 C GLY H 140 22034 11566 13352 -4586 -2846 1312 C
-ATOM 996 O GLY H 140 -22.156 -23.287 -40.859 1.00117.97 O
-ANISOU 996 O GLY H 140 21551 10756 12515 -4160 -2971 1245 O
-ATOM 997 N THR H 141 -24.109 -22.673 -41.797 1.00126.96 N
-ANISOU 997 N THR H 141 22043 12207 13990 -4579 -2788 1132 N
-ATOM 998 CA THR H 141 -23.517 -21.935 -42.904 1.00113.74 C
-ANISOU 998 CA THR H 141 20214 10646 12358 -4075 -2844 836 C
-ATOM 999 C THR H 141 -23.981 -20.485 -42.854 1.00110.21 C
-ANISOU 999 C THR H 141 19208 10708 11959 -4025 -2482 737 C
-ATOM 1000 O THR H 141 -25.131 -20.202 -42.501 1.00123.39 O
-ANISOU 1000 O THR H 141 20542 12597 13746 -4385 -2268 834 O
-ATOM 1001 CB THR H 141 -23.899 -22.564 -44.253 1.00107.82 C
-ANISOU 1001 CB THR H 141 19621 9583 11762 -4044 -3208 679 C
-ATOM 1002 OG1 THR H 141 -23.539 -23.951 -44.253 1.00116.93 O
-ANISOU 1002 OG1 THR H 141 21373 10204 12852 -4096 -3562 769 O
-ATOM 1003 CG2 THR H 141 -23.192 -21.863 -45.402 1.00 87.58 C
-ANISOU 1003 CG2 THR H 141 17001 7107 9168 -3477 -3223 400 C
-ATOM 1004 N ALA H 142 -23.084 -19.567 -43.203 1.00 98.94 N
-ANISOU 1004 N ALA H 142 17672 9460 10463 -3571 -2404 567 N
-ATOM 1005 CA ALA H 142 -23.386 -18.145 -43.218 1.00 98.09 C
-ANISOU 1005 CA ALA H 142 17116 9774 10379 -3466 -2109 452 C
-ATOM 1006 C ALA H 142 -23.325 -17.604 -44.641 1.00101.59 C
-ANISOU 1006 C ALA H 142 17393 10261 10946 -3145 -2212 215 C
-ATOM 1007 O ALA H 142 -22.647 -18.156 -45.512 1.00107.09 O
-ANISOU 1007 O ALA H 142 18362 10696 11630 -2868 -2445 129 O
-ATOM 1008 CB ALA H 142 -22.419 -17.360 -42.321 1.00 87.65 C
-ANISOU 1008 CB ALA H 142 15822 8618 8862 -3264 -1948 487 C
-ATOM 1009 N ALA H 143 -24.045 -16.507 -44.867 1.00 94.52 N
-ANISOU 1009 N ALA H 143 16084 9685 10142 -3148 -2016 115 N
-ATOM 1010 CA ALA H 143 -24.058 -15.835 -46.159 1.00 72.04 C
-ANISOU 1010 CA ALA H 143 13089 6904 7379 -2853 -2095 -94 C
-ATOM 1011 C ALA H 143 -23.943 -14.337 -45.936 1.00100.05 C
-ANISOU 1011 C ALA H 143 16316 10803 10895 -2669 -1816 -170 C
-ATOM 1012 O ALA H 143 -24.676 -13.776 -45.117 1.00109.23 O
-ANISOU 1012 O ALA H 143 17233 12199 12071 -2860 -1573 -116 O
-ATOM 1013 CB ALA H 143 -25.335 -16.158 -46.941 1.00 74.51 C
-ANISOU 1013 CB ALA H 143 13254 7156 7900 -3088 -2293 -144 C
-ATOM 1014 N LEU H 144 -23.024 -13.694 -46.656 1.00 84.71 N
-ANISOU 1014 N LEU H 144 14402 8880 8905 -2287 -1832 -277 N
-ATOM 1015 CA LEU H 144 -22.829 -12.255 -46.539 1.00 87.13 C
-ANISOU 1015 CA LEU H 144 14462 9454 9190 -2118 -1630 -342 C
-ATOM 1016 C LEU H 144 -22.515 -11.683 -47.914 1.00 87.31 C
-ANISOU 1016 C LEU H 144 14452 9475 9249 -1786 -1696 -478 C
-ATOM 1017 O LEU H 144 -22.038 -12.390 -48.804 1.00 83.61 O
-ANISOU 1017 O LEU H 144 14222 8793 8754 -1600 -1850 -503 O
-ATOM 1018 CB LEU H 144 -21.714 -11.913 -45.537 1.00 87.55 C
-ANISOU 1018 CB LEU H 144 14613 9534 9117 -2054 -1553 -231 C
-ATOM 1019 CG LEU H 144 -20.321 -12.508 -45.773 1.00 95.49 C
-ANISOU 1019 CG LEU H 144 15824 10343 10114 -1826 -1703 -138 C
-ATOM 1020 CD1 LEU H 144 -19.435 -11.552 -46.560 1.00102.36 C
-ANISOU 1020 CD1 LEU H 144 16545 11300 11047 -1493 -1660 -168 C
-ATOM 1021 CD2 LEU H 144 -19.658 -12.890 -44.458 1.00 95.70 C
-ANISOU 1021 CD2 LEU H 144 16024 10297 10043 -1957 -1758 35 C
-ATOM 1022 N GLY H 145 -22.786 -10.390 -48.087 1.00 78.49 N
-ANISOU 1022 N GLY H 145 13094 8571 8157 -1684 -1566 -561 N
-ATOM 1023 CA GLY H 145 -22.600 -9.825 -49.409 1.00 80.50 C
-ANISOU 1023 CA GLY H 145 13352 8816 8420 -1393 -1622 -668 C
-ATOM 1024 C GLY H 145 -22.455 -8.319 -49.399 1.00 81.15 C
-ANISOU 1024 C GLY H 145 13239 9091 8503 -1254 -1473 -707 C
-ATOM 1025 O GLY H 145 -22.457 -7.674 -48.350 1.00 75.01 O
-ANISOU 1025 O GLY H 145 12356 8439 7704 -1361 -1342 -673 O
-ATOM 1026 N CYS H 146 -22.320 -7.771 -50.605 1.00 92.05 N
-ANISOU 1026 N CYS H 146 14649 10454 9871 -1001 -1510 -777 N
-ATOM 1027 CA CYS H 146 -22.201 -6.343 -50.853 1.00 87.85 C
-ANISOU 1027 CA CYS H 146 13989 10048 9342 -853 -1413 -807 C
-ATOM 1028 C CYS H 146 -23.261 -5.918 -51.854 1.00 88.12 C
-ANISOU 1028 C CYS H 146 13973 10103 9406 -763 -1527 -950 C
-ATOM 1029 O CYS H 146 -23.491 -6.604 -52.856 1.00111.59 O
-ANISOU 1029 O CYS H 146 17129 12936 12336 -679 -1699 -1004 O
-ATOM 1030 CB CYS H 146 -20.814 -5.977 -51.391 1.00101.44 C
-ANISOU 1030 CB CYS H 146 15803 11717 11024 -616 -1335 -683 C
-ATOM 1031 SG CYS H 146 -19.591 -5.671 -50.110 1.00135.87 S
-ANISOU 1031 SG CYS H 146 20077 16107 15439 -727 -1268 -490 S
-ATOM 1032 N LEU H 147 -23.901 -4.787 -51.579 1.00 75.41 N
-ANISOU 1032 N LEU H 147 12161 8637 7854 -758 -1465 -1015 N
-ATOM 1033 CA LEU H 147 -24.905 -4.204 -52.462 1.00 75.85 C
-ANISOU 1033 CA LEU H 147 12127 8721 7973 -642 -1601 -1134 C
-ATOM 1034 C LEU H 147 -24.323 -2.938 -53.083 1.00 79.76 C
-ANISOU 1034 C LEU H 147 12715 9205 8384 -396 -1551 -1129 C
-ATOM 1035 O LEU H 147 -24.196 -1.908 -52.411 1.00 75.16 O
-ANISOU 1035 O LEU H 147 12044 8699 7815 -385 -1426 -1122 O
-ATOM 1036 CB LEU H 147 -26.198 -3.912 -51.704 1.00 71.60 C
-ANISOU 1036 CB LEU H 147 11253 8349 7603 -780 -1554 -1190 C
-ATOM 1037 CG LEU H 147 -27.323 -3.267 -52.515 1.00 77.63 C
-ANISOU 1037 CG LEU H 147 11830 9158 8506 -648 -1727 -1290 C
-ATOM 1038 CD1 LEU H 147 -27.592 -4.054 -53.784 1.00 88.04 C
-ANISOU 1038 CD1 LEU H 147 13316 10308 9829 -634 -2079 -1325 C
-ATOM 1039 CD2 LEU H 147 -28.589 -3.154 -51.684 1.00 78.67 C
-ANISOU 1039 CD2 LEU H 147 11539 9484 8868 -769 -1615 -1294 C
-ATOM 1040 N VAL H 148 -23.967 -3.024 -54.361 1.00 75.38 N
-ANISOU 1040 N VAL H 148 12400 8525 7715 -197 -1652 -1123 N
-ATOM 1041 CA VAL H 148 -23.412 -1.903 -55.110 1.00 78.14 C
-ANISOU 1041 CA VAL H 148 12878 8840 7970 26 -1593 -1073 C
-ATOM 1042 C VAL H 148 -24.574 -1.206 -55.811 1.00 83.88 C
-ANISOU 1042 C VAL H 148 13578 9567 8725 141 -1800 -1205 C
-ATOM 1043 O VAL H 148 -25.115 -1.720 -56.795 1.00 95.01 O
-ANISOU 1043 O VAL H 148 15158 10875 10069 224 -2036 -1277 O
-ATOM 1044 CB VAL H 148 -22.355 -2.377 -56.115 1.00 78.45 C
-ANISOU 1044 CB VAL H 148 13226 8751 7832 223 -1513 -956 C
-ATOM 1045 CG1 VAL H 148 -21.778 -1.204 -56.877 1.00 79.82 C
-ANISOU 1045 CG1 VAL H 148 13518 8896 7914 422 -1402 -846 C
-ATOM 1046 CG2 VAL H 148 -21.260 -3.159 -55.409 1.00 67.38 C
-ANISOU 1046 CG2 VAL H 148 11787 7352 6465 143 -1338 -811 C
-ATOM 1047 N LYS H 149 -24.961 -0.036 -55.309 1.00 78.06 N
-ANISOU 1047 N LYS H 149 12669 8911 8077 165 -1755 -1240 N
-ATOM 1048 CA LYS H 149 -26.199 0.610 -55.723 1.00 79.45 C
-ANISOU 1048 CA LYS H 149 12722 9112 8352 283 -1953 -1363 C
-ATOM 1049 C LYS H 149 -25.925 1.965 -56.363 1.00 78.43 C
-ANISOU 1049 C LYS H 149 12781 8893 8126 508 -1971 -1336 C
-ATOM 1050 O LYS H 149 -25.036 2.704 -55.925 1.00 60.58 O
-ANISOU 1050 O LYS H 149 10599 6602 5814 497 -1790 -1239 O
-ATOM 1051 CB LYS H 149 -27.150 0.782 -54.530 1.00 66.60 C
-ANISOU 1051 CB LYS H 149 10715 7655 6935 177 -1863 -1437 C
-ATOM 1052 CG LYS H 149 -28.599 0.984 -54.924 1.00 76.80 C
-ANISOU 1052 CG LYS H 149 11732 9010 8436 271 -2085 -1532 C
-ATOM 1053 CD LYS H 149 -29.501 1.049 -53.706 1.00 94.77 C
-ANISOU 1053 CD LYS H 149 13587 11489 10930 196 -1882 -1558 C
-ATOM 1054 CE LYS H 149 -30.965 1.094 -54.112 1.00100.30 C
-ANISOU 1054 CE LYS H 149 13884 12284 11941 274 -2104 -1595 C
-ATOM 1055 NZ LYS H 149 -31.232 2.208 -55.063 1.00 96.47 N1+
-ANISOU 1055 NZ LYS H 149 13514 11696 11444 592 -2341 -1659 N1+
-ATOM 1056 N ASP H 150 -26.697 2.271 -57.411 1.00 91.34 N
-ANISOU 1056 N ASP H 150 14509 10453 9743 689 -2242 -1403 N
-ATOM 1057 CA ASP H 150 -26.742 3.585 -58.048 1.00 89.07 C
-ANISOU 1057 CA ASP H 150 14404 10058 9379 916 -2325 -1389 C
-ATOM 1058 C ASP H 150 -25.396 4.005 -58.629 1.00 91.87 C
-ANISOU 1058 C ASP H 150 15123 10282 9501 971 -2150 -1206 C
-ATOM 1059 O ASP H 150 -24.713 4.872 -58.075 1.00102.38 O
-ANISOU 1059 O ASP H 150 16457 11590 10854 926 -1977 -1108 O
-ATOM 1060 CB ASP H 150 -27.248 4.642 -57.062 1.00 93.77 C
-ANISOU 1060 CB ASP H 150 14760 10725 10143 962 -2242 -1459 C
-ATOM 1061 CG ASP H 150 -28.625 4.313 -56.505 1.00110.11 C
-ANISOU 1061 CG ASP H 150 16399 12961 12479 958 -2327 -1591 C
-ATOM 1062 OD1 ASP H 150 -29.374 3.556 -57.162 1.00116.50 O
-ANISOU 1062 OD1 ASP H 150 17093 13786 13386 939 -2594 -1624 O
-ATOM 1063 OD2 ASP H 150 -28.966 4.820 -55.416 1.00119.97 O1-
-ANISOU 1063 OD2 ASP H 150 17434 14310 13839 980 -2130 -1645 O1-
-ATOM 1064 N TYR H 151 -25.020 3.405 -59.756 1.00 82.81 N
-ANISOU 1064 N TYR H 151 14302 9032 8130 1072 -2196 -1142 N
-ATOM 1065 CA TYR H 151 -23.811 3.781 -60.472 1.00 80.14 C
-ANISOU 1065 CA TYR H 151 14293 8587 7568 1172 -1967 -921 C
-ATOM 1066 C TYR H 151 -24.093 3.811 -61.969 1.00 85.36 C
-ANISOU 1066 C TYR H 151 15423 9081 7929 1428 -2152 -919 C
-ATOM 1067 O TYR H 151 -25.050 3.205 -62.459 1.00 79.73 O
-ANISOU 1067 O TYR H 151 14807 8316 7169 1492 -2494 -1092 O
-ATOM 1068 CB TYR H 151 -22.648 2.828 -60.160 1.00 79.01 C
-ANISOU 1068 CB TYR H 151 14117 8504 7400 1070 -1657 -777 C
-ATOM 1069 CG TYR H 151 -22.814 1.431 -60.720 1.00 85.47 C
-ANISOU 1069 CG TYR H 151 15136 9280 8060 1144 -1735 -866 C
-ATOM 1070 CD1 TYR H 151 -22.216 1.063 -61.922 1.00 81.99 C
-ANISOU 1070 CD1 TYR H 151 15157 8706 7289 1392 -1615 -764 C
-ATOM 1071 CD2 TYR H 151 -23.555 0.477 -60.039 1.00 83.27 C
-ANISOU 1071 CD2 TYR H 151 14635 9066 7940 972 -1916 -1040 C
-ATOM 1072 CE1 TYR H 151 -22.365 -0.211 -62.430 1.00 81.97 C
-ANISOU 1072 CE1 TYR H 151 15449 8601 7096 1490 -1721 -872 C
-ATOM 1073 CE2 TYR H 151 -23.706 -0.800 -60.540 1.00 81.44 C
-ANISOU 1073 CE2 TYR H 151 14644 8731 7567 1010 -2049 -1119 C
-ATOM 1074 CZ TYR H 151 -23.110 -1.138 -61.734 1.00 80.70 C
-ANISOU 1074 CZ TYR H 151 15070 8471 7123 1280 -1974 -1055 C
-ATOM 1075 OH TYR H 151 -23.263 -2.412 -62.229 1.00 85.91 O
-ANISOU 1075 OH TYR H 151 16076 8968 7598 1348 -2142 -1161 O
-ATOM 1076 N PHE H 152 -23.239 4.529 -62.692 1.00 82.43 N
-ANISOU 1076 N PHE H 152 15364 8605 7351 1557 -1943 -698 N
-ATOM 1077 CA PHE H 152 -23.403 4.704 -64.127 1.00 84.42 C
-ANISOU 1077 CA PHE H 152 16168 8671 7236 1826 -2072 -658 C
-ATOM 1078 C PHE H 152 -22.118 5.243 -64.743 1.00 93.89 C
-ANISOU 1078 C PHE H 152 17647 9808 8221 1920 -1642 -321 C
-ATOM 1079 O PHE H 152 -21.510 6.165 -64.203 1.00 97.57 O
-ANISOU 1079 O PHE H 152 17890 10302 8880 1772 -1452 -131 O
-ATOM 1080 CB PHE H 152 -24.572 5.648 -64.419 1.00 86.67 C
-ANISOU 1080 CB PHE H 152 16508 8855 7568 1925 -2504 -793 C
-ATOM 1081 CG PHE H 152 -24.905 5.777 -65.880 1.00 97.97 C
-ANISOU 1081 CG PHE H 152 18560 10064 8601 2200 -2756 -779 C
-ATOM 1082 CD1 PHE H 152 -25.787 4.895 -66.483 1.00 95.89 C
-ANISOU 1082 CD1 PHE H 152 18513 9712 8209 2290 -3188 -981 C
-ATOM 1083 CD2 PHE H 152 -24.348 6.788 -66.644 1.00 99.54 C
-ANISOU 1083 CD2 PHE H 152 19166 10112 8545 2347 -2603 -549 C
-ATOM 1084 CE1 PHE H 152 -26.099 5.013 -67.822 1.00100.51 C
-ANISOU 1084 CE1 PHE H 152 19759 10051 8379 2547 -3490 -978 C
-ATOM 1085 CE2 PHE H 152 -24.657 6.911 -67.984 1.00106.86 C
-ANISOU 1085 CE2 PHE H 152 20747 10813 9043 2615 -2838 -528 C
-ATOM 1086 CZ PHE H 152 -25.534 6.022 -68.573 1.00105.51 C
-ANISOU 1086 CZ PHE H 152 20838 10545 8708 2729 -3298 -756 C
-ATOM 1087 N PRO H 153 -21.693 4.664 -65.876 1.00 89.26 N
-ANISOU 1087 N PRO H 153 17569 9118 7228 2166 -1481 -227 N
-ATOM 1088 CA PRO H 153 -22.327 3.518 -66.529 1.00 76.92 C
-ANISOU 1088 CA PRO H 153 16381 7453 5392 2335 -1754 -456 C
-ATOM 1089 C PRO H 153 -21.719 2.195 -66.085 1.00 84.79 C
-ANISOU 1089 C PRO H 153 17248 8542 6428 2298 -1505 -477 C
-ATOM 1090 O PRO H 153 -20.854 2.179 -65.211 1.00 94.89 O
-ANISOU 1090 O PRO H 153 18083 9991 7981 2135 -1147 -316 O
-ATOM 1091 CB PRO H 153 -22.037 3.771 -68.001 1.00 81.27 C
-ANISOU 1091 CB PRO H 153 17686 7794 5399 2672 -1653 -310 C
-ATOM 1092 CG PRO H 153 -20.683 4.401 -67.973 1.00 88.30 C
-ANISOU 1092 CG PRO H 153 18468 8774 6307 2670 -1020 84 C
-ATOM 1093 CD PRO H 153 -20.618 5.231 -66.710 1.00 90.01 C
-ANISOU 1093 CD PRO H 153 17999 9143 7059 2322 -1039 133 C
-ATOM 1094 N GLU H 154 -22.171 1.101 -66.686 1.00 86.08 N
-ANISOU 1094 N GLU H 154 17833 8557 6318 2446 -1750 -670 N
-ATOM 1095 CA GLU H 154 -21.583 -0.207 -66.433 1.00 83.18 C
-ANISOU 1095 CA GLU H 154 17491 8202 5911 2481 -1534 -693 C
-ATOM 1096 C GLU H 154 -20.172 -0.249 -67.020 1.00 87.69 C
-ANISOU 1096 C GLU H 154 18334 8781 6203 2780 -879 -389 C
-ATOM 1097 O GLU H 154 -19.878 0.476 -67.971 1.00 95.60 O
-ANISOU 1097 O GLU H 154 19744 9698 6882 3010 -685 -214 O
-ATOM 1098 CB GLU H 154 -22.461 -1.312 -67.026 1.00 93.56 C
-ANISOU 1098 CB GLU H 154 19302 9276 6969 2568 -2032 -977 C
-ATOM 1099 CG GLU H 154 -23.516 -1.842 -66.072 1.00104.66 C
-ANISOU 1099 CG GLU H 154 20224 10744 8799 2203 -2506 -1203 C
-ATOM 1100 CD GLU H 154 -23.999 -3.229 -66.452 1.00131.52 C
-ANISOU 1100 CD GLU H 154 23954 13906 12112 2203 -2854 -1367 C
-ATOM 1101 OE1 GLU H 154 -24.016 -3.550 -67.660 1.00139.78 O
-ANISOU 1101 OE1 GLU H 154 25556 14679 12877 2462 -2932 -1336 O
-ATOM 1102 OE2 GLU H 154 -24.354 -4.004 -65.540 1.00141.30 O1-
-ANISOU 1102 OE2 GLU H 154 24852 15204 13631 1920 -3026 -1478 O1-
-ATOM 1103 N PRO H 155 -19.294 -1.103 -66.465 1.00 78.95 N
-ANISOU 1103 N PRO H 155 16994 7774 5228 2794 -521 -297 N
-ATOM 1104 CA PRO H 155 -19.545 -2.062 -65.388 1.00 93.08 C
-ANISOU 1104 CA PRO H 155 18399 9629 7338 2546 -720 -472 C
-ATOM 1105 C PRO H 155 -18.912 -1.696 -64.052 1.00 90.63 C
-ANISOU 1105 C PRO H 155 17328 9575 7533 2239 -496 -299 C
-ATOM 1106 O PRO H 155 -18.415 -0.585 -63.861 1.00 93.82 O
-ANISOU 1106 O PRO H 155 17443 10099 8107 2146 -284 -70 O
-ATOM 1107 CB PRO H 155 -18.895 -3.331 -65.928 1.00102.27 C
-ANISOU 1107 CB PRO H 155 20036 10645 8178 2893 -475 -473 C
-ATOM 1108 CG PRO H 155 -17.720 -2.800 -66.781 1.00 97.15 C
-ANISOU 1108 CG PRO H 155 19616 10033 7263 3270 170 -128 C
-ATOM 1109 CD PRO H 155 -17.954 -1.316 -67.032 1.00 82.01 C
-ANISOU 1109 CD PRO H 155 17583 8184 5392 3139 140 11 C
-ATOM 1110 N VAL H 156 -18.943 -2.657 -63.133 1.00 82.19 N
-ANISOU 1110 N VAL H 156 15998 8548 6683 2067 -593 -406 N
-ATOM 1111 CA VAL H 156 -18.184 -2.605 -61.890 1.00 85.43 C
-ANISOU 1111 CA VAL H 156 15811 9153 7495 1830 -391 -237 C
-ATOM 1112 C VAL H 156 -17.571 -3.978 -61.667 1.00 86.64 C
-ANISOU 1112 C VAL H 156 16034 9255 7630 1963 -248 -225 C
-ATOM 1113 O VAL H 156 -18.220 -5.004 -61.904 1.00 91.71 O
-ANISOU 1113 O VAL H 156 17035 9722 8089 2018 -514 -463 O
-ATOM 1114 CB VAL H 156 -19.056 -2.193 -60.683 1.00 74.48 C
-ANISOU 1114 CB VAL H 156 13988 7874 6436 1416 -731 -396 C
-ATOM 1115 CG1 VAL H 156 -19.325 -0.704 -60.696 1.00 77.76 C
-ANISOU 1115 CG1 VAL H 156 14262 8345 6937 1320 -778 -339 C
-ATOM 1116 CG2 VAL H 156 -20.361 -2.951 -60.688 1.00 71.27 C
-ANISOU 1116 CG2 VAL H 156 13743 7365 5971 1319 -1161 -705 C
-ATOM 1117 N THR H 157 -16.317 -4.003 -61.231 1.00 80.87 N
-ANISOU 1117 N THR H 157 14968 8650 7108 2015 134 67 N
-ATOM 1118 CA THR H 157 -15.649 -5.246 -60.873 1.00 81.40 C
-ANISOU 1118 CA THR H 157 15024 8677 7226 2156 268 110 C
-ATOM 1119 C THR H 157 -15.653 -5.391 -59.356 1.00 83.45 C
-ANISOU 1119 C THR H 157 14774 9051 7882 1749 58 107 C
-ATOM 1120 O THR H 157 -15.271 -4.462 -58.636 1.00 72.70 O
-ANISOU 1120 O THR H 157 12961 7848 6814 1498 87 281 O
-ATOM 1121 CB THR H 157 -14.220 -5.285 -61.419 1.00 76.68 C
-ANISOU 1121 CB THR H 157 14366 8144 6626 2545 840 473 C
-ATOM 1122 OG1 THR H 157 -13.500 -4.130 -60.970 1.00 83.11 O
-ANISOU 1122 OG1 THR H 157 14615 9164 7798 2331 1023 801 O
-ATOM 1123 CG2 THR H 157 -14.233 -5.311 -62.937 1.00 88.15 C
-ANISOU 1123 CG2 THR H 157 16462 9451 7578 3012 1101 464 C
-ATOM 1124 N VAL H 158 -16.098 -6.547 -58.873 1.00 85.06 N
-ANISOU 1124 N VAL H 158 15115 9139 8065 1674 -179 -85 N
-ATOM 1125 CA VAL H 158 -16.283 -6.785 -57.446 1.00 83.22 C
-ANISOU 1125 CA VAL H 158 14519 8980 8121 1285 -402 -115 C
-ATOM 1126 C VAL H 158 -15.529 -8.054 -57.072 1.00 78.80 C
-ANISOU 1126 C VAL H 158 14008 8323 7610 1434 -328 -31 C
-ATOM 1127 O VAL H 158 -15.896 -9.151 -57.510 1.00 75.51 O
-ANISOU 1127 O VAL H 158 14029 7688 6973 1595 -442 -199 O
-ATOM 1128 CB VAL H 158 -17.766 -6.902 -57.068 1.00 73.61 C
-ANISOU 1128 CB VAL H 158 13378 7718 6871 967 -799 -409 C
-ATOM 1129 CG1 VAL H 158 -17.904 -7.312 -55.614 1.00 75.89 C
-ANISOU 1129 CG1 VAL H 158 13382 8066 7386 614 -946 -411 C
-ATOM 1130 CG2 VAL H 158 -18.478 -5.582 -57.323 1.00 68.03 C
-ANISOU 1130 CG2 VAL H 158 12563 7115 6169 856 -877 -475 C
-ATOM 1131 N SER H 159 -14.482 -7.909 -56.267 1.00 82.12 N
-ANISOU 1131 N SER H 159 14007 8868 8326 1379 -191 234 N
-ATOM 1132 CA SER H 159 -13.731 -9.039 -55.739 1.00 88.15 C
-ANISOU 1132 CA SER H 159 14744 9547 9201 1506 -167 344 C
-ATOM 1133 C SER H 159 -13.976 -9.151 -54.239 1.00 84.89 C
-ANISOU 1133 C SER H 159 14081 9174 8999 1061 -478 325 C
-ATOM 1134 O SER H 159 -14.698 -8.349 -53.643 1.00 90.69 O
-ANISOU 1134 O SER H 159 14675 10008 9775 698 -653 226 O
-ATOM 1135 CB SER H 159 -12.240 -8.897 -56.054 1.00104.25 C
-ANISOU 1135 CB SER H 159 16485 11685 11439 1855 227 715 C
-ATOM 1136 OG SER H 159 -11.714 -7.694 -55.526 1.00106.70 O
-ANISOU 1136 OG SER H 159 16273 12199 12067 1593 247 961 O
-ATOM 1137 N TRP H 160 -13.372 -10.167 -53.627 1.00 86.83 N
-ANISOU 1137 N TRP H 160 14321 9322 9349 1128 -533 425 N
-ATOM 1138 CA TRP H 160 -13.526 -10.405 -52.197 1.00 90.05 C
-ANISOU 1138 CA TRP H 160 14589 9730 9897 740 -823 432 C
-ATOM 1139 C TRP H 160 -12.170 -10.693 -51.576 1.00 91.57 C
-ANISOU 1139 C TRP H 160 14480 9938 10374 861 -802 747 C
-ATOM 1140 O TRP H 160 -11.421 -11.535 -52.081 1.00101.31 O
-ANISOU 1140 O TRP H 160 15790 11068 11635 1271 -637 863 O
-ATOM 1141 CB TRP H 160 -14.486 -11.570 -51.925 1.00 91.45 C
-ANISOU 1141 CB TRP H 160 15165 9700 9883 601 -1054 204 C
-ATOM 1142 CG TRP H 160 -15.922 -11.193 -52.070 1.00 93.77 C
-ANISOU 1142 CG TRP H 160 15586 10019 10026 318 -1187 -53 C
-ATOM 1143 CD1 TRP H 160 -16.699 -11.340 -53.180 1.00 98.87 C
-ANISOU 1143 CD1 TRP H 160 16532 10562 10472 446 -1208 -250 C
-ATOM 1144 CD2 TRP H 160 -16.756 -10.596 -51.072 1.00 91.29 C
-ANISOU 1144 CD2 TRP H 160 15093 9835 9757 -112 -1324 -124 C
-ATOM 1145 NE1 TRP H 160 -17.968 -10.875 -52.935 1.00 99.27 N
-ANISOU 1145 NE1 TRP H 160 16518 10691 10511 105 -1374 -417 N
-ATOM 1146 CE2 TRP H 160 -18.029 -10.412 -51.647 1.00 86.69 C
-ANISOU 1146 CE2 TRP H 160 14625 9253 9062 -216 -1399 -343 C
-ATOM 1147 CE3 TRP H 160 -16.551 -10.200 -49.747 1.00 90.44 C
-ANISOU 1147 CE3 TRP H 160 14778 9829 9757 -392 -1395 -20 C
-ATOM 1148 CZ2 TRP H 160 -19.091 -9.849 -50.945 1.00 84.83 C
-ANISOU 1148 CZ2 TRP H 160 14224 9150 8859 -555 -1472 -440 C
-ATOM 1149 CZ3 TRP H 160 -17.607 -9.642 -49.051 1.00 88.36 C
-ANISOU 1149 CZ3 TRP H 160 14456 9672 9445 -715 -1451 -144 C
-ATOM 1150 CH2 TRP H 160 -18.861 -9.472 -49.651 1.00 84.29 C
-ANISOU 1150 CH2 TRP H 160 13979 9189 8857 -778 -1455 -343 C
-ATOM 1151 N ASN H 161 -11.866 -9.995 -50.481 1.00 78.32 N
-ANISOU 1151 N ASN H 161 12486 8368 8904 526 -994 884 N
-ATOM 1152 CA ASN H 161 -10.602 -10.162 -49.763 1.00 80.71 C
-ANISOU 1152 CA ASN H 161 12456 8679 9532 564 -1098 1208 C
-ATOM 1153 C ASN H 161 -9.412 -9.970 -50.699 1.00 92.98 C
-ANISOU 1153 C ASN H 161 13661 10326 11341 982 -760 1514 C
-ATOM 1154 O ASN H 161 -8.437 -10.724 -50.663 1.00 99.45 O
-ANISOU 1154 O ASN H 161 14312 11100 12377 1286 -700 1748 O
-ATOM 1155 CB ASN H 161 -10.541 -11.522 -49.064 1.00 77.64 C
-ANISOU 1155 CB ASN H 161 12309 8093 9097 596 -1305 1192 C
-ATOM 1156 CG ASN H 161 -11.481 -11.610 -47.873 1.00 79.93 C
-ANISOU 1156 CG ASN H 161 12846 8321 9203 128 -1621 1014 C
-ATOM 1157 OD1 ASN H 161 -12.306 -10.723 -47.648 1.00 74.56 O
-ANISOU 1157 OD1 ASN H 161 12184 7745 8399 -168 -1645 857 O
-ATOM 1158 ND2 ASN H 161 -11.361 -12.687 -47.105 1.00 82.97 N
-ANISOU 1158 ND2 ASN H 161 13442 8526 9558 90 -1836 1054 N
-ATOM 1159 N SER H 162 -9.503 -8.943 -51.547 1.00 90.44 N
-ANISOU 1159 N SER H 162 13223 10138 11001 1017 -513 1536 N
-ATOM 1160 CA SER H 162 -8.462 -8.626 -52.525 1.00 93.09 C
-ANISOU 1160 CA SER H 162 13230 10590 11550 1396 -99 1860 C
-ATOM 1161 C SER H 162 -8.202 -9.810 -53.454 1.00 94.89 C
-ANISOU 1161 C SER H 162 13739 10711 11603 1984 250 1837 C
-ATOM 1162 O SER H 162 -7.063 -10.093 -53.830 1.00 93.23 O
-ANISOU 1162 O SER H 162 13209 10563 11652 2385 564 2170 O
-ATOM 1163 CB SER H 162 -7.171 -8.178 -51.836 1.00 91.20 C
-ANISOU 1163 CB SER H 162 12346 10457 11848 1277 -213 2307 C
-ATOM 1164 OG SER H 162 -7.393 -7.031 -51.035 1.00 87.78 O
-ANISOU 1164 OG SER H 162 11765 10062 11527 750 -569 2313 O
-ATOM 1165 N GLY H 163 -9.272 -10.512 -53.823 1.00 93.75 N
-ANISOU 1165 N GLY H 163 14205 10389 11028 2046 184 1451 N
-ATOM 1166 CA GLY H 163 -9.167 -11.657 -54.702 1.00 87.46 C
-ANISOU 1166 CA GLY H 163 13851 9405 9976 2590 431 1360 C
-ATOM 1167 C GLY H 163 -8.768 -12.952 -54.034 1.00 83.49 C
-ANISOU 1167 C GLY H 163 13453 8711 9560 2744 253 1385 C
-ATOM 1168 O GLY H 163 -8.527 -13.941 -54.735 1.00 84.37 O
-ANISOU 1168 O GLY H 163 13952 8627 9478 3265 465 1335 O
-ATOM 1169 N ALA H 164 -8.692 -12.985 -52.702 1.00 84.56 N
-ANISOU 1169 N ALA H 164 13329 8860 9941 2333 -143 1457 N
-ATOM 1170 CA ALA H 164 -8.283 -14.196 -52.001 1.00 85.51 C
-ANISOU 1170 CA ALA H 164 13565 8777 10148 2464 -355 1512 C
-ATOM 1171 C ALA H 164 -9.429 -15.177 -51.792 1.00 88.23 C
-ANISOU 1171 C ALA H 164 14572 8829 10122 2290 -647 1153 C
-ATOM 1172 O ALA H 164 -9.174 -16.366 -51.572 1.00 98.38 O
-ANISOU 1172 O ALA H 164 16146 9859 11377 2520 -762 1155 O
-ATOM 1173 CB ALA H 164 -7.662 -13.841 -50.649 1.00 86.44 C
-ANISOU 1173 CB ALA H 164 13187 8998 10659 2103 -700 1772 C
-ATOM 1174 N LEU H 165 -10.676 -14.715 -51.856 1.00 81.29 N
-ANISOU 1174 N LEU H 165 13919 7969 8997 1889 -781 874 N
-ATOM 1175 CA LEU H 165 -11.850 -15.560 -51.657 1.00 83.80 C
-ANISOU 1175 CA LEU H 165 14773 8034 9034 1637 -1072 582 C
-ATOM 1176 C LEU H 165 -12.600 -15.671 -52.980 1.00 93.69 C
-ANISOU 1176 C LEU H 165 16480 9161 9958 1843 -952 323 C
-ATOM 1177 O LEU H 165 -13.234 -14.707 -53.422 1.00 93.40 O
-ANISOU 1177 O LEU H 165 16348 9295 9846 1670 -894 216 O
-ATOM 1178 CB LEU H 165 -12.748 -14.993 -50.560 1.00 75.57 C
-ANISOU 1178 CB LEU H 165 13586 7114 8012 995 -1347 503 C
-ATOM 1179 CG LEU H 165 -14.010 -15.785 -50.211 1.00 71.23 C
-ANISOU 1179 CG LEU H 165 13459 6352 7252 642 -1621 278 C
-ATOM 1180 CD1 LEU H 165 -13.665 -17.178 -49.713 1.00 74.06 C
-ANISOU 1180 CD1 LEU H 165 14150 6393 7594 731 -1817 346 C
-ATOM 1181 CD2 LEU H 165 -14.821 -15.038 -49.173 1.00 68.85 C
-ANISOU 1181 CD2 LEU H 165 12939 6242 6977 90 -1750 245 C
-ATOM 1182 N THR H 166 -12.528 -16.846 -53.607 1.00100.13 N
-ANISOU 1182 N THR H 166 17845 9639 10560 2226 -960 220 N
-ATOM 1183 CA THR H 166 -13.218 -17.098 -54.865 1.00 99.97 C
-ANISOU 1183 CA THR H 166 18403 9408 10171 2442 -941 -40 C
-ATOM 1184 C THR H 166 -14.314 -18.144 -54.760 1.00107.20 C
-ANISOU 1184 C THR H 166 19900 9946 10886 2156 -1392 -291 C
-ATOM 1185 O THR H 166 -15.311 -18.047 -55.477 1.00113.89 O
-ANISOU 1185 O THR H 166 21079 10682 11512 2019 -1568 -520 O
-ATOM 1186 CB THR H 166 -12.223 -17.543 -55.948 1.00103.21 C
-ANISOU 1186 CB THR H 166 19121 9681 10415 3218 -545 29 C
-ATOM 1187 OG1 THR H 166 -11.678 -18.826 -55.610 1.00101.10 O
-ANISOU 1187 OG1 THR H 166 19158 9099 10156 3511 -636 71 O
-ATOM 1188 CG2 THR H 166 -11.092 -16.534 -56.087 1.00102.40 C
-ANISOU 1188 CG2 THR H 166 18369 9960 10577 3484 -62 352 C
-ATOM 1189 N SER H 167 -14.156 -19.135 -53.889 1.00112.88 N
-ANISOU 1189 N SER H 167 20746 10447 11697 2042 -1620 -228 N
-ATOM 1190 CA SER H 167 -15.135 -20.208 -53.792 1.00111.49 C
-ANISOU 1190 CA SER H 167 21138 9865 11359 1746 -2059 -415 C
-ATOM 1191 C SER H 167 -16.424 -19.701 -53.157 1.00 98.54 C
-ANISOU 1191 C SER H 167 19225 8393 9822 1015 -2316 -482 C
-ATOM 1192 O SER H 167 -16.401 -18.909 -52.212 1.00 94.04 O
-ANISOU 1192 O SER H 167 18089 8174 9470 695 -2222 -342 O
-ATOM 1193 CB SER H 167 -14.565 -21.370 -52.980 1.00113.02 C
-ANISOU 1193 CB SER H 167 21542 9770 11630 1819 -2219 -288 C
-ATOM 1194 OG SER H 167 -15.459 -22.467 -52.959 1.00120.22 O
-ANISOU 1194 OG SER H 167 23065 10227 12385 1536 -2655 -441 O
-ATOM 1195 N GLY H 168 -17.556 -20.158 -53.691 1.00 95.63 N
-ANISOU 1195 N GLY H 168 19275 7759 9303 769 -2651 -685 N
-ATOM 1196 CA GLY H 168 -18.851 -19.798 -53.150 1.00 87.98 C
-ANISOU 1196 CA GLY H 168 18020 6933 8477 104 -2883 -719 C
-ATOM 1197 C GLY H 168 -19.290 -18.375 -53.402 1.00 92.10 C
-ANISOU 1197 C GLY H 168 18041 7877 9074 0 -2699 -759 C
-ATOM 1198 O GLY H 168 -20.310 -17.951 -52.850 1.00 98.38 O
-ANISOU 1198 O GLY H 168 18498 8855 10028 -497 -2812 -758 O
-ATOM 1199 N VAL H 169 -18.560 -17.624 -54.216 1.00 86.79 N
-ANISOU 1199 N VAL H 169 17316 7360 8299 468 -2398 -773 N
-ATOM 1200 CA VAL H 169 -18.908 -16.244 -54.531 1.00 78.62 C
-ANISOU 1200 CA VAL H 169 15874 6682 7317 408 -2236 -803 C
-ATOM 1201 C VAL H 169 -19.854 -16.225 -55.723 1.00 82.92 C
-ANISOU 1201 C VAL H 169 16791 7049 7667 430 -2494 -1022 C
-ATOM 1202 O VAL H 169 -19.681 -16.981 -56.686 1.00 84.11 O
-ANISOU 1202 O VAL H 169 17577 6840 7541 772 -2617 -1141 O
-ATOM 1203 CB VAL H 169 -17.643 -15.413 -54.815 1.00 76.77 C
-ANISOU 1203 CB VAL H 169 15391 6688 7091 852 -1795 -656 C
-ATOM 1204 CG1 VAL H 169 -18.008 -13.958 -55.070 1.00 70.82 C
-ANISOU 1204 CG1 VAL H 169 14252 6262 6395 751 -1660 -670 C
-ATOM 1205 CG2 VAL H 169 -16.652 -15.538 -53.669 1.00 82.96 C
-ANISOU 1205 CG2 VAL H 169 15836 7591 8096 834 -1650 -421 C
-ATOM 1206 N HIS H 170 -20.865 -15.360 -55.654 1.00 81.56 N
-ANISOU 1206 N HIS H 170 16260 7102 7628 89 -2604 -1076 N
-ATOM 1207 CA HIS H 170 -21.804 -15.132 -56.748 1.00 75.13 C
-ANISOU 1207 CA HIS H 170 15697 6165 6683 86 -2901 -1258 C
-ATOM 1208 C HIS H 170 -21.976 -13.629 -56.918 1.00 87.93 C
-ANISOU 1208 C HIS H 170 16870 8160 8381 113 -2691 -1244 C
-ATOM 1209 O HIS H 170 -22.618 -12.980 -56.086 1.00 77.77 O
-ANISOU 1209 O HIS H 170 15043 7146 7358 -246 -2677 -1196 O
-ATOM 1210 CB HIS H 170 -23.156 -15.795 -56.477 1.00 77.20 C
-ANISOU 1210 CB HIS H 170 15963 6250 7118 -440 -3400 -1322 C
-ATOM 1211 CG HIS H 170 -23.097 -17.287 -56.391 1.00 84.29 C
-ANISOU 1211 CG HIS H 170 17388 6703 7936 -517 -3695 -1337 C
-ATOM 1212 ND1 HIS H 170 -22.047 -18.023 -56.895 1.00 98.05 N
-ANISOU 1212 ND1 HIS H 170 19732 8144 9380 -28 -3593 -1375 N
-ATOM 1213 CD2 HIS H 170 -23.963 -18.182 -55.860 1.00 93.16 C
-ANISOU 1213 CD2 HIS H 170 18538 7611 9247 -1020 -4083 -1300 C
-ATOM 1214 CE1 HIS H 170 -22.268 -19.307 -56.678 1.00115.35 C
-ANISOU 1214 CE1 HIS H 170 22341 9928 11559 -209 -3938 -1384 C
-ATOM 1215 NE2 HIS H 170 -23.425 -19.431 -56.051 1.00114.80 N
-ANISOU 1215 NE2 HIS H 170 21887 9929 11803 -831 -4225 -1302 N
-ATOM 1216 N THR H 171 -21.403 -13.076 -57.983 1.00 96.92 N
-ANISOU 1216 N THR H 171 18267 9292 9268 560 -2503 -1275 N
-ATOM 1217 CA THR H 171 -21.642 -11.685 -58.348 1.00 89.25 C
-ANISOU 1217 CA THR H 171 17001 8588 8323 601 -2378 -1271 C
-ATOM 1218 C THR H 171 -22.771 -11.652 -59.372 1.00 84.34 C
-ANISOU 1218 C THR H 171 16710 7774 7560 564 -2826 -1459 C
-ATOM 1219 O THR H 171 -22.666 -12.270 -60.437 1.00 87.09 O
-ANISOU 1219 O THR H 171 17737 7790 7564 857 -2999 -1573 O
-ATOM 1220 CB THR H 171 -20.381 -11.027 -58.909 1.00 76.05 C
-ANISOU 1220 CB THR H 171 15392 7025 6478 1066 -1906 -1137 C
-ATOM 1221 OG1 THR H 171 -19.281 -11.243 -58.014 1.00 75.93 O
-ANISOU 1221 OG1 THR H 171 15089 7132 6630 1108 -1583 -941 O
-ATOM 1222 CG2 THR H 171 -20.596 -9.532 -59.067 1.00 68.59 C
-ANISOU 1222 CG2 THR H 171 14099 6351 5611 1031 -1784 -1094 C
-ATOM 1223 N PHE H 172 -23.861 -10.942 -59.041 1.00 76.86 N
-ANISOU 1223 N PHE H 172 15309 7017 6876 227 -3034 -1490 N
-ATOM 1224 CA PHE H 172 -25.019 -10.977 -59.921 1.00 78.03 C
-ANISOU 1224 CA PHE H 172 15689 6977 6982 139 -3561 -1640 C
-ATOM 1225 C PHE H 172 -24.924 -9.896 -60.995 1.00 83.05 C
-ANISOU 1225 C PHE H 172 16528 7653 7374 485 -3508 -1682 C
-ATOM 1226 O PHE H 172 -24.311 -8.846 -60.778 1.00 93.93 O
-ANISOU 1226 O PHE H 172 17609 9302 8776 633 -3082 -1572 O
-ATOM 1227 CB PHE H 172 -26.305 -10.789 -59.118 1.00 78.56 C
-ANISOU 1227 CB PHE H 172 15130 7225 7494 -354 -3820 -1621 C
-ATOM 1228 CG PHE H 172 -26.658 -11.970 -58.256 1.00 85.24 C
-ANISOU 1228 CG PHE H 172 15872 7957 8557 -753 -3981 -1566 C
-ATOM 1229 CD1 PHE H 172 -26.069 -12.141 -57.013 1.00 82.73 C
-ANISOU 1229 CD1 PHE H 172 15245 7823 8364 -882 -3585 -1430 C
-ATOM 1230 CD2 PHE H 172 -27.580 -12.909 -58.689 1.00 84.79 C
-ANISOU 1230 CD2 PHE H 172 16064 7576 8575 -1022 -4572 -1630 C
-ATOM 1231 CE1 PHE H 172 -26.389 -13.227 -56.220 1.00 80.44 C
-ANISOU 1231 CE1 PHE H 172 14911 7409 8243 -1253 -3723 -1352 C
-ATOM 1232 CE2 PHE H 172 -27.906 -13.997 -57.898 1.00 84.45 C
-ANISOU 1232 CE2 PHE H 172 15940 7401 8747 -1430 -4724 -1540 C
-ATOM 1233 CZ PHE H 172 -27.308 -14.156 -56.663 1.00 85.20 C
-ANISOU 1233 CZ PHE H 172 15742 7695 8937 -1535 -4272 -1398 C
-ATOM 1234 N PRO H 173 -25.509 -10.137 -62.167 1.00 80.74 N
-ANISOU 1234 N PRO H 173 16668 7098 6913 609 -3892 -1754 N
-ATOM 1235 CA PRO H 173 -25.559 -9.085 -63.186 1.00 84.48 C
-ANISOU 1235 CA PRO H 173 17307 7602 7191 904 -3865 -1748 C
-ATOM 1236 C PRO H 173 -26.392 -7.909 -62.705 1.00 87.68 C
-ANISOU 1236 C PRO H 173 17149 8284 7881 676 -4009 -1784 C
-ATOM 1237 O PRO H 173 -27.396 -8.078 -62.011 1.00 99.49 O
-ANISOU 1237 O PRO H 173 18192 9860 9751 286 -4333 -1824 O
-ATOM 1238 CB PRO H 173 -26.207 -9.785 -64.385 1.00 97.72 C
-ANISOU 1238 CB PRO H 173 19477 8911 8740 995 -4319 -1767 C
-ATOM 1239 CG PRO H 173 -26.972 -10.921 -63.787 1.00 87.32 C
-ANISOU 1239 CG PRO H 173 17994 7457 7724 580 -4722 -1791 C
-ATOM 1240 CD PRO H 173 -26.144 -11.382 -62.630 1.00 84.56 C
-ANISOU 1240 CD PRO H 173 17462 7237 7430 483 -4341 -1768 C
-ATOM 1241 N ALA H 174 -25.961 -6.708 -63.078 1.00 81.24 N
-ANISOU 1241 N ALA H 174 16364 7609 6897 937 -3748 -1745 N
-ATOM 1242 CA ALA H 174 -26.641 -5.509 -62.623 1.00 79.78 C
-ANISOU 1242 CA ALA H 174 15581 7693 7038 799 -3765 -1712 C
-ATOM 1243 C ALA H 174 -28.042 -5.424 -63.220 1.00 84.56 C
-ANISOU 1243 C ALA H 174 16185 8171 7773 687 -4432 -1829 C
-ATOM 1244 O ALA H 174 -28.354 -6.044 -64.241 1.00 90.67 O
-ANISOU 1244 O ALA H 174 17398 8654 8399 779 -4759 -1839 O
-ATOM 1245 CB ALA H 174 -25.834 -4.263 -62.986 1.00 73.65 C
-ANISOU 1245 CB ALA H 174 14882 7034 6069 1099 -3356 -1598 C
-ATOM 1246 N VAL H 175 -28.896 -4.648 -62.558 1.00 82.39 N
-ANISOU 1246 N VAL H 175 15236 8146 7922 506 -4492 -1804 N
-ATOM 1247 CA VAL H 175 -30.259 -4.398 -63.007 1.00 83.30 C
-ANISOU 1247 CA VAL H 175 15158 8208 8285 411 -5099 -1865 C
-ATOM 1248 C VAL H 175 -30.445 -2.893 -63.136 1.00 80.77 C
-ANISOU 1248 C VAL H 175 14617 8053 8018 637 -4986 -1834 C
-ATOM 1249 O VAL H 175 -30.053 -2.134 -62.242 1.00 93.22 O
-ANISOU 1249 O VAL H 175 15793 9890 9736 651 -4491 -1764 O
-ATOM 1250 CB VAL H 175 -31.300 -5.013 -62.050 1.00 98.68 C
-ANISOU 1250 CB VAL H 175 16414 10296 10784 -17 -5300 -1830 C
-ATOM 1251 CG1 VAL H 175 -30.999 -4.645 -60.605 1.00108.43 C
-ANISOU 1251 CG1 VAL H 175 17038 11889 12273 -138 -4679 -1734 C
-ATOM 1252 CG2 VAL H 175 -32.706 -4.576 -62.434 1.00116.50 C
-ANISOU 1252 CG2 VAL H 175 18289 12565 13412 -92 -5877 -1835 C
-ATOM 1253 N LEU H 176 -31.021 -2.463 -64.255 1.00 84.27 N
-ANISOU 1253 N LEU H 176 15395 8301 8321 822 -5485 -1888 N
-ATOM 1254 CA LEU H 176 -31.245 -1.046 -64.507 1.00 94.67 C
-ANISOU 1254 CA LEU H 176 16597 9709 9663 1065 -5460 -1858 C
-ATOM 1255 C LEU H 176 -32.462 -0.579 -63.717 1.00100.55 C
-ANISOU 1255 C LEU H 176 16492 10696 11015 913 -5623 -1845 C
-ATOM 1256 O LEU H 176 -33.578 -1.061 -63.943 1.00 98.31 O
-ANISOU 1256 O LEU H 176 15953 10351 11047 747 -6199 -1865 O
-ATOM 1257 CB LEU H 176 -31.435 -0.796 -66.002 1.00 88.20 C
-ANISOU 1257 CB LEU H 176 16469 8571 8475 1331 -5922 -1885 C
-ATOM 1258 CG LEU H 176 -31.550 0.662 -66.453 1.00 95.18 C
-ANISOU 1258 CG LEU H 176 17443 9464 9258 1625 -5965 -1853 C
-ATOM 1259 CD1 LEU H 176 -30.344 1.474 -66.003 1.00 95.47 C
-ANISOU 1259 CD1 LEU H 176 17515 9649 9110 1757 -5226 -1741 C
-ATOM 1260 CD2 LEU H 176 -31.708 0.731 -67.958 1.00101.35 C
-ANISOU 1260 CD2 LEU H 176 18859 9889 9760 1852 -6240 -1791 C
-ATOM 1261 N GLN H 177 -32.246 0.354 -62.792 1.00 99.72 N
-ANISOU 1261 N GLN H 177 15957 10851 11081 979 -5122 -1796 N
-ATOM 1262 CA GLN H 177 -33.313 0.847 -61.937 1.00 90.94 C
-ANISOU 1262 CA GLN H 177 14059 9991 10503 921 -5125 -1778 C
-ATOM 1263 C GLN H 177 -34.170 1.868 -62.681 1.00 93.50 C
-ANISOU 1263 C GLN H 177 14333 10244 10948 1201 -5560 -1793 C
-ATOM 1264 O GLN H 177 -33.806 2.374 -63.745 1.00 96.80 O
-ANISOU 1264 O GLN H 177 15365 10427 10987 1442 -5777 -1811 O
-ATOM 1265 CB GLN H 177 -32.743 1.474 -60.666 1.00 88.57 C
-ANISOU 1265 CB GLN H 177 13456 9936 10260 935 -4448 -1745 C
-ATOM 1266 CG GLN H 177 -32.043 0.500 -59.735 1.00 87.07 C
-ANISOU 1266 CG GLN H 177 13205 9844 10033 649 -4051 -1710 C
-ATOM 1267 CD GLN H 177 -31.624 1.149 -58.427 1.00 91.45 C
-ANISOU 1267 CD GLN H 177 13481 10614 10650 655 -3483 -1683 C
-ATOM 1268 OE1 GLN H 177 -31.057 0.498 -57.549 1.00 90.61 O
-ANISOU 1268 OE1 GLN H 177 13319 10593 10513 443 -3159 -1644 O
-ATOM 1269 NE2 GLN H 177 -31.912 2.439 -58.288 1.00 92.30 N
-ANISOU 1269 NE2 GLN H 177 13471 10774 10825 913 -3401 -1709 N
-ATOM 1270 N SER H 178 -35.323 2.185 -62.089 1.00 96.96 N
-ANISOU 1270 N SER H 178 14022 10891 11926 1192 -5659 -1764 N
-ATOM 1271 CA SER H 178 -36.245 3.146 -62.681 1.00101.33 C
-ANISOU 1271 CA SER H 178 14408 11398 12695 1487 -6090 -1762 C
-ATOM 1272 C SER H 178 -35.676 4.558 -62.738 1.00104.22 C
-ANISOU 1272 C SER H 178 15092 11716 12791 1860 -5791 -1787 C
-ATOM 1273 O SER H 178 -36.319 5.442 -63.313 1.00114.73 O
-ANISOU 1273 O SER H 178 16412 12954 14226 2156 -6155 -1787 O
-ATOM 1274 CB SER H 178 -37.562 3.152 -61.902 1.00108.73 C
-ANISOU 1274 CB SER H 178 14368 12617 14329 1430 -6141 -1687 C
-ATOM 1275 OG SER H 178 -38.133 1.856 -61.859 1.00113.72 O
-ANISOU 1275 OG SER H 178 14669 13272 15269 1024 -6460 -1616 O
-ATOM 1276 N SER H 179 -34.499 4.792 -62.160 1.00 95.16 N
-ANISOU 1276 N SER H 179 14227 10603 11327 1838 -5190 -1790 N
-ATOM 1277 CA SER H 179 -33.855 6.097 -62.196 1.00100.25 C
-ANISOU 1277 CA SER H 179 15218 11155 11720 2115 -4932 -1783 C
-ATOM 1278 C SER H 179 -32.778 6.204 -63.267 1.00107.77 C
-ANISOU 1278 C SER H 179 16989 11838 12121 2174 -4969 -1730 C
-ATOM 1279 O SER H 179 -32.305 7.312 -63.538 1.00112.06 O
-ANISOU 1279 O SER H 179 17876 12247 12455 2385 -4859 -1680 O
-ATOM 1280 CB SER H 179 -33.241 6.418 -60.828 1.00 97.06 C
-ANISOU 1280 CB SER H 179 14595 10932 11350 2042 -4287 -1785 C
-ATOM 1281 OG SER H 179 -32.307 5.423 -60.441 1.00 88.56 O
-ANISOU 1281 OG SER H 179 13648 9907 10092 1735 -3984 -1753 O
-ATOM 1282 N GLY H 180 -32.388 5.092 -63.881 1.00108.86 N
-ANISOU 1282 N GLY H 180 17470 11877 12013 2008 -5100 -1725 N
-ATOM 1283 CA GLY H 180 -31.309 5.097 -64.843 1.00114.12 C
-ANISOU 1283 CA GLY H 180 18911 12319 12132 2101 -5007 -1651 C
-ATOM 1284 C GLY H 180 -29.952 4.757 -64.275 1.00112.51 C
-ANISOU 1284 C GLY H 180 18817 12197 11733 1953 -4388 -1565 C
-ATOM 1285 O GLY H 180 -28.946 4.931 -64.973 1.00117.97 O
-ANISOU 1285 O GLY H 180 20065 12745 12014 2060 -4176 -1447 O
-ATOM 1286 N LEU H 181 -29.890 4.278 -63.035 1.00104.70 N
-ANISOU 1286 N LEU H 181 17312 11437 11033 1720 -4088 -1594 N
-ATOM 1287 CA LEU H 181 -28.641 3.934 -62.373 1.00 90.43 C
-ANISOU 1287 CA LEU H 181 15539 9712 9107 1567 -3563 -1503 C
-ATOM 1288 C LEU H 181 -28.627 2.442 -62.083 1.00 94.66 C
-ANISOU 1288 C LEU H 181 15973 10304 9690 1342 -3571 -1552 C
-ATOM 1289 O LEU H 181 -29.576 1.912 -61.495 1.00 98.53 O
-ANISOU 1289 O LEU H 181 16016 10913 10508 1174 -3754 -1636 O
-ATOM 1290 CB LEU H 181 -28.474 4.726 -61.076 1.00 84.08 C
-ANISOU 1290 CB LEU H 181 14329 9075 8544 1493 -3224 -1488 C
-ATOM 1291 CG LEU H 181 -28.559 6.248 -61.191 1.00 84.81 C
-ANISOU 1291 CG LEU H 181 14524 9071 8628 1707 -3244 -1458 C
-ATOM 1292 CD1 LEU H 181 -28.418 6.890 -59.822 1.00 79.68 C
-ANISOU 1292 CD1 LEU H 181 13562 8539 8176 1632 -2945 -1479 C
-ATOM 1293 CD2 LEU H 181 -27.505 6.779 -62.150 1.00 87.93 C
-ANISOU 1293 CD2 LEU H 181 15480 9265 8663 1809 -3140 -1281 C
-ATOM 1294 N TYR H 182 -27.554 1.770 -62.491 1.00 97.90 N
-ANISOU 1294 N TYR H 182 16789 10621 9787 1350 -3352 -1474 N
-ATOM 1295 CA TYR H 182 -27.442 0.336 -62.282 1.00 95.65 C
-ANISOU 1295 CA TYR H 182 16517 10325 9499 1177 -3371 -1519 C
-ATOM 1296 C TYR H 182 -27.244 0.026 -60.798 1.00 95.00 C
-ANISOU 1296 C TYR H 182 15913 10467 9715 913 -3055 -1496 C
-ATOM 1297 O TYR H 182 -26.962 0.906 -59.977 1.00 89.75 O
-ANISOU 1297 O TYR H 182 14976 9944 9181 889 -2778 -1441 O
-ATOM 1298 CB TYR H 182 -26.292 -0.238 -63.112 1.00 94.85 C
-ANISOU 1298 CB TYR H 182 17015 10056 8966 1348 -3160 -1434 C
-ATOM 1299 CG TYR H 182 -26.473 -0.092 -64.612 1.00 91.71 C
-ANISOU 1299 CG TYR H 182 17279 9399 8167 1630 -3457 -1460 C
-ATOM 1300 CD1 TYR H 182 -25.913 0.979 -65.298 1.00 88.49 C
-ANISOU 1300 CD1 TYR H 182 17187 8935 7499 1872 -3255 -1320 C
-ATOM 1301 CD2 TYR H 182 -27.192 -1.028 -65.341 1.00 82.58 C
-ANISOU 1301 CD2 TYR H 182 16489 8021 6868 1639 -3967 -1608 C
-ATOM 1302 CE1 TYR H 182 -26.070 1.119 -66.662 1.00 81.54 C
-ANISOU 1302 CE1 TYR H 182 16990 7803 6189 2145 -3509 -1328 C
-ATOM 1303 CE2 TYR H 182 -27.354 -0.896 -66.709 1.00101.61 C
-ANISOU 1303 CE2 TYR H 182 19494 10163 8951 1897 -4203 -1587 C
-ATOM 1304 CZ TYR H 182 -26.790 0.181 -67.365 1.00 99.53 C
-ANISOU 1304 CZ TYR H 182 19558 9862 8396 2162 -3957 -1454 C
-ATOM 1305 OH TYR H 182 -26.946 0.319 -68.729 1.00103.67 O
-ANISOU 1305 OH TYR H 182 20655 10097 8637 2412 -4124 -1397 O
-ATOM 1306 N SER H 183 -27.400 -1.256 -60.461 1.00 98.27 N
-ANISOU 1306 N SER H 183 16263 10871 10203 711 -3136 -1538 N
-ATOM 1307 CA SER H 183 -27.285 -1.732 -59.086 1.00 93.33 C
-ANISOU 1307 CA SER H 183 15219 10426 9817 447 -2880 -1507 C
-ATOM 1308 C SER H 183 -27.202 -3.252 -59.042 1.00 92.73 C
-ANISOU 1308 C SER H 183 15287 10237 9709 272 -2992 -1523 C
-ATOM 1309 O SER H 183 -28.165 -3.936 -59.401 1.00 92.91 O
-ANISOU 1309 O SER H 183 15301 10156 9843 142 -3406 -1599 O
-ATOM 1310 CB SER H 183 -28.473 -1.253 -58.250 1.00 94.14 C
-ANISOU 1310 CB SER H 183 14759 10721 10287 313 -2950 -1555 C
-ATOM 1311 OG SER H 183 -28.604 -2.018 -57.065 1.00 97.65 O
-ANISOU 1311 OG SER H 183 14878 11301 10923 33 -2775 -1524 O
-ATOM 1312 N LEU H 184 -26.070 -3.794 -58.602 1.00 88.24 N
-ANISOU 1312 N LEU H 184 14847 9663 9019 257 -2672 -1437 N
-ATOM 1313 CA LEU H 184 -25.905 -5.236 -58.493 1.00 90.01 C
-ANISOU 1313 CA LEU H 184 15255 9744 9200 122 -2763 -1447 C
-ATOM 1314 C LEU H 184 -25.589 -5.625 -57.056 1.00 85.59 C
-ANISOU 1314 C LEU H 184 14349 9341 8831 -131 -2497 -1362 C
-ATOM 1315 O LEU H 184 -25.381 -4.780 -56.184 1.00 88.46 O
-ANISOU 1315 O LEU H 184 14399 9905 9307 -175 -2234 -1303 O
-ATOM 1316 CB LEU H 184 -24.811 -5.755 -59.440 1.00 89.72 C
-ANISOU 1316 CB LEU H 184 15807 9492 8792 421 -2657 -1417 C
-ATOM 1317 CG LEU H 184 -23.359 -5.264 -59.402 1.00 78.74 C
-ANISOU 1317 CG LEU H 184 14478 8178 7260 652 -2175 -1249 C
-ATOM 1318 CD1 LEU H 184 -22.558 -5.828 -58.237 1.00 67.31 C
-ANISOU 1318 CD1 LEU H 184 12785 6826 5964 501 -1913 -1133 C
-ATOM 1319 CD2 LEU H 184 -22.691 -5.635 -60.712 1.00 90.34 C
-ANISOU 1319 CD2 LEU H 184 16564 9425 8336 1031 -2110 -1234 C
-ATOM 1320 N SER H 185 -25.547 -6.933 -56.826 1.00 88.06 N
-ANISOU 1320 N SER H 185 14802 9514 9142 -291 -2602 -1358 N
-ATOM 1321 CA SER H 185 -25.257 -7.494 -55.516 1.00 81.15 C
-ANISOU 1321 CA SER H 185 13701 8732 8401 -537 -2402 -1264 C
-ATOM 1322 C SER H 185 -24.295 -8.655 -55.701 1.00 83.90 C
-ANISOU 1322 C SER H 185 14456 8857 8567 -444 -2380 -1221 C
-ATOM 1323 O SER H 185 -24.483 -9.476 -56.604 1.00 87.02 O
-ANISOU 1323 O SER H 185 15261 8985 8817 -362 -2657 -1304 O
-ATOM 1324 CB SER H 185 -26.538 -7.968 -54.821 1.00 87.74 C
-ANISOU 1324 CB SER H 185 14191 9632 9514 -910 -2582 -1270 C
-ATOM 1325 OG SER H 185 -27.615 -7.082 -55.082 1.00 94.47 O
-ANISOU 1325 OG SER H 185 14724 10624 10547 -910 -2710 -1328 O
-ATOM 1326 N SER H 186 -23.266 -8.718 -54.860 1.00 78.77 N
-ANISOU 1326 N SER H 186 13726 8285 7918 -431 -2085 -1093 N
-ATOM 1327 CA SER H 186 -22.276 -9.788 -54.909 1.00 77.30 C
-ANISOU 1327 CA SER H 186 13862 7905 7605 -295 -2030 -1023 C
-ATOM 1328 C SER H 186 -22.207 -10.445 -53.541 1.00 73.74 C
-ANISOU 1328 C SER H 186 13236 7488 7295 -597 -1993 -926 C
-ATOM 1329 O SER H 186 -21.837 -9.796 -52.560 1.00 72.96 O
-ANISOU 1329 O SER H 186 12846 7588 7287 -694 -1794 -827 O
-ATOM 1330 CB SER H 186 -20.901 -9.257 -55.317 1.00 72.70 C
-ANISOU 1330 CB SER H 186 13347 7368 6908 71 -1716 -900 C
-ATOM 1331 OG SER H 186 -19.951 -10.306 -55.380 1.00 75.90 O
-ANISOU 1331 OG SER H 186 14020 7596 7224 269 -1634 -818 O
-ATOM 1332 N VAL H 187 -22.543 -11.729 -53.477 1.00 78.35 N
-ANISOU 1332 N VAL H 187 14065 7836 7867 -749 -2216 -946 N
-ATOM 1333 CA VAL H 187 -22.664 -12.432 -52.210 1.00 78.24 C
-ANISOU 1333 CA VAL H 187 13940 7820 7966 -1080 -2216 -839 C
-ATOM 1334 C VAL H 187 -21.675 -13.592 -52.173 1.00 85.00 C
-ANISOU 1334 C VAL H 187 15177 8409 8711 -921 -2245 -766 C
-ATOM 1335 O VAL H 187 -21.029 -13.926 -53.164 1.00 93.98 O
-ANISOU 1335 O VAL H 187 16666 9356 9686 -545 -2257 -815 O
-ATOM 1336 CB VAL H 187 -24.095 -12.932 -51.966 1.00 67.34 C
-ANISOU 1336 CB VAL H 187 12440 6399 6746 -1496 -2461 -867 C
-ATOM 1337 CG1 VAL H 187 -25.051 -11.748 -51.891 1.00 66.62 C
-ANISOU 1337 CG1 VAL H 187 11898 6604 6810 -1596 -2384 -912 C
-ATOM 1338 CG2 VAL H 187 -24.495 -13.900 -53.067 1.00 70.44 C
-ANISOU 1338 CG2 VAL H 187 13261 6435 7067 -1470 -2857 -974 C
-ATOM 1339 N VAL H 188 -21.571 -14.204 -50.997 1.00 87.63 N
-ANISOU 1339 N VAL H 188 15466 8719 9112 -1178 -2239 -639 N
-ATOM 1340 CA VAL H 188 -20.656 -15.315 -50.766 1.00 87.35 C
-ANISOU 1340 CA VAL H 188 15765 8421 9002 -1040 -2291 -545 C
-ATOM 1341 C VAL H 188 -21.134 -16.057 -49.526 1.00 78.95 C
-ANISOU 1341 C VAL H 188 14695 7292 8008 -1476 -2389 -425 C
-ATOM 1342 O VAL H 188 -21.644 -15.449 -48.579 1.00 84.96 O
-ANISOU 1342 O VAL H 188 15131 8304 8845 -1772 -2256 -359 O
-ATOM 1343 CB VAL H 188 -19.196 -14.819 -50.620 1.00 82.09 C
-ANISOU 1343 CB VAL H 188 14983 7874 8332 -677 -2042 -420 C
-ATOM 1344 CG1 VAL H 188 -19.084 -13.788 -49.505 1.00 76.42 C
-ANISOU 1344 CG1 VAL H 188 13851 7464 7720 -891 -1891 -315 C
-ATOM 1345 CG2 VAL H 188 -18.245 -15.985 -50.377 1.00 75.59 C
-ANISOU 1345 CG2 VAL H 188 14462 6782 7476 -478 -2104 -304 C
-ATOM 1346 N THR H 189 -20.988 -17.378 -49.548 1.00 72.02 N
-ANISOU 1346 N THR H 189 14236 6054 7076 -1496 -2608 -391 N
-ATOM 1347 CA THR H 189 -21.289 -18.218 -48.398 1.00 89.55 C
-ANISOU 1347 CA THR H 189 16544 8150 9332 -1890 -2704 -234 C
-ATOM 1348 C THR H 189 -19.984 -18.637 -47.737 1.00100.35 C
-ANISOU 1348 C THR H 189 18074 9418 10636 -1655 -2654 -87 C
-ATOM 1349 O THR H 189 -19.048 -19.070 -48.419 1.00 99.62 O
-ANISOU 1349 O THR H 189 18241 9126 10484 -1211 -2689 -115 O
-ATOM 1350 CB THR H 189 -22.094 -19.453 -48.805 1.00 95.99 C
-ANISOU 1350 CB THR H 189 17743 8569 10159 -2143 -3061 -263 C
-ATOM 1351 OG1 THR H 189 -21.296 -20.291 -49.647 1.00 95.42 O
-ANISOU 1351 OG1 THR H 189 18207 8111 9937 -1726 -3237 -348 O
-ATOM 1352 CG2 THR H 189 -23.354 -19.042 -49.554 1.00 97.59 C
-ANISOU 1352 CG2 THR H 189 17747 8852 10481 -2365 -3200 -388 C
-ATOM 1353 N VAL H 190 -19.929 -18.508 -46.414 1.00 96.52 N
-ANISOU 1353 N VAL H 190 17451 9064 10156 -1926 -2571 79 N
-ATOM 1354 CA VAL H 190 -18.728 -18.824 -45.641 1.00 86.14 C
-ANISOU 1354 CA VAL H 190 16257 7667 8806 -1750 -2594 247 C
-ATOM 1355 C VAL H 190 -19.144 -19.672 -44.442 1.00 99.37 C
-ANISOU 1355 C VAL H 190 18174 9175 10409 -2167 -2713 420 C
-ATOM 1356 O VAL H 190 -20.305 -19.604 -44.010 1.00110.05 O
-ANISOU 1356 O VAL H 190 19433 10624 11755 -2603 -2642 441 O
-ATOM 1357 CB VAL H 190 -17.992 -17.547 -45.192 1.00 79.95 C
-ANISOU 1357 CB VAL H 190 15097 7219 8061 -1612 -2409 298 C
-ATOM 1358 CG1 VAL H 190 -17.471 -16.792 -46.404 1.00 77.60 C
-ANISOU 1358 CG1 VAL H 190 14590 7052 7844 -1200 -2276 186 C
-ATOM 1359 CG2 VAL H 190 -18.922 -16.655 -44.371 1.00 70.02 C
-ANISOU 1359 CG2 VAL H 190 13606 6244 6754 -1995 -2251 287 C
-ATOM 1360 N PRO H 191 -18.256 -20.500 -43.887 1.00106.36 N
-ANISOU 1360 N PRO H 191 19362 9804 11246 -2043 -2881 574 N
-ATOM 1361 CA PRO H 191 -18.620 -21.250 -42.676 1.00106.40 C
-ANISOU 1361 CA PRO H 191 19646 9642 11138 -2449 -2986 771 C
-ATOM 1362 C PRO H 191 -18.880 -20.308 -41.511 1.00110.97 C
-ANISOU 1362 C PRO H 191 20002 10551 11610 -2722 -2778 864 C
-ATOM 1363 O PRO H 191 -18.070 -19.431 -41.207 1.00113.53 O
-ANISOU 1363 O PRO H 191 20135 11073 11928 -2510 -2731 871 O
-ATOM 1364 CB PRO H 191 -17.396 -22.145 -42.424 1.00 98.36 C
-ANISOU 1364 CB PRO H 191 18972 8297 10104 -2132 -3233 907 C
-ATOM 1365 CG PRO H 191 -16.277 -21.469 -43.135 1.00 95.30 C
-ANISOU 1365 CG PRO H 191 18294 8065 9850 -1589 -3158 837 C
-ATOM 1366 CD PRO H 191 -16.905 -20.853 -44.353 1.00102.63 C
-ANISOU 1366 CD PRO H 191 19001 9164 10830 -1506 -2976 604 C
-ATOM 1367 N SER H 192 -20.024 -20.502 -40.850 1.00109.68 N
-ANISOU 1367 N SER H 192 19886 10426 11361 -3195 -2652 952 N
-ATOM 1368 CA SER H 192 -20.427 -19.594 -39.781 1.00104.01 C
-ANISOU 1368 CA SER H 192 19023 10017 10480 -3413 -2376 1019 C
-ATOM 1369 C SER H 192 -19.481 -19.640 -38.589 1.00 99.03 C
-ANISOU 1369 C SER H 192 18704 9297 9623 -3369 -2500 1191 C
-ATOM 1370 O SER H 192 -19.523 -18.735 -37.750 1.00 99.16 O
-ANISOU 1370 O SER H 192 18688 9537 9451 -3434 -2330 1208 O
-ATOM 1371 CB SER H 192 -21.854 -19.909 -39.329 1.00107.37 C
-ANISOU 1371 CB SER H 192 19418 10499 10878 -3901 -2148 1133 C
-ATOM 1372 OG SER H 192 -21.999 -21.279 -39.004 1.00117.88 O
-ANISOU 1372 OG SER H 192 21151 11461 12176 -4169 -2344 1336 O
-ATOM 1373 N SER H 193 -18.628 -20.659 -38.498 1.00100.46 N
-ANISOU 1373 N SER H 193 19230 9132 9810 -3236 -2826 1314 N
-ATOM 1374 CA SER H 193 -17.653 -20.756 -37.419 1.00111.10 C
-ANISOU 1374 CA SER H 193 20877 10357 10979 -3169 -3047 1495 C
-ATOM 1375 C SER H 193 -16.411 -19.907 -37.663 1.00114.22 C
-ANISOU 1375 C SER H 193 20999 10880 11520 -2764 -3201 1437 C
-ATOM 1376 O SER H 193 -15.473 -19.972 -36.862 1.00121.10 O
-ANISOU 1376 O SER H 193 22064 11631 12318 -2678 -3486 1599 O
-ATOM 1377 CB SER H 193 -17.245 -22.217 -37.211 1.00117.55 C
-ANISOU 1377 CB SER H 193 22164 10724 11774 -3169 -3368 1676 C
-ATOM 1378 OG SER H 193 -16.608 -22.736 -38.363 1.00119.10 O
-ANISOU 1378 OG SER H 193 22285 10735 12232 -2768 -3548 1575 O
-ATOM 1379 N SER H 194 -16.378 -19.122 -38.741 1.00109.89 N
-ANISOU 1379 N SER H 194 20005 10557 11192 -2534 -3048 1243 N
-ATOM 1380 CA SER H 194 -15.245 -18.258 -39.040 1.00106.62 C
-ANISOU 1380 CA SER H 194 19264 10281 10966 -2195 -3151 1233 C
-ATOM 1381 C SER H 194 -15.601 -16.779 -39.032 1.00101.14 C
-ANISOU 1381 C SER H 194 18263 9924 10240 -2271 -2934 1096 C
-ATOM 1382 O SER H 194 -14.726 -15.945 -39.293 1.00 94.96 O
-ANISOU 1382 O SER H 194 17189 9257 9634 -2053 -3022 1105 O
-ATOM 1383 CB SER H 194 -14.643 -18.619 -40.404 1.00108.67 C
-ANISOU 1383 CB SER H 194 19303 10470 11516 -1768 -3156 1167 C
-ATOM 1384 OG SER H 194 -15.545 -18.302 -41.449 1.00109.10 O
-ANISOU 1384 OG SER H 194 19183 10665 11604 -1778 -2889 949 O
-ATOM 1385 N LEU H 195 -16.856 -16.429 -38.741 1.00100.56 N
-ANISOU 1385 N LEU H 195 18234 10001 9972 -2564 -2652 994 N
-ATOM 1386 CA LEU H 195 -17.281 -15.035 -38.751 1.00 97.24 C
-ANISOU 1386 CA LEU H 195 17568 9873 9507 -2589 -2430 846 C
-ATOM 1387 C LEU H 195 -16.595 -14.197 -37.681 1.00107.51 C
-ANISOU 1387 C LEU H 195 19031 11189 10630 -2615 -2606 919 C
-ATOM 1388 O LEU H 195 -16.687 -12.965 -37.733 1.00117.96 O
-ANISOU 1388 O LEU H 195 20190 12694 11938 -2577 -2509 798 O
-ATOM 1389 CB LEU H 195 -18.798 -14.957 -38.571 1.00 96.61 C
-ANISOU 1389 CB LEU H 195 17492 9940 9277 -2862 -2070 761 C
-ATOM 1390 CG LEU H 195 -19.658 -15.453 -39.732 1.00103.56 C
-ANISOU 1390 CG LEU H 195 18135 10839 10373 -2881 -1942 655 C
-ATOM 1391 CD1 LEU H 195 -21.118 -15.504 -39.317 1.00105.08 C
-ANISOU 1391 CD1 LEU H 195 18287 11164 10474 -3209 -1627 668 C
-ATOM 1392 CD2 LEU H 195 -19.474 -14.556 -40.948 1.00105.66 C
-ANISOU 1392 CD2 LEU H 195 18024 11268 10855 -2596 -1903 467 C
-ATOM 1393 N GLY H 196 -15.919 -14.822 -36.721 1.00107.75 N
-ANISOU 1393 N GLY H 196 19429 10997 10515 -2681 -2914 1114 N
-ATOM 1394 CA GLY H 196 -15.248 -14.085 -35.669 1.00105.99 C
-ANISOU 1394 CA GLY H 196 19448 10726 10095 -2728 -3190 1191 C
-ATOM 1395 C GLY H 196 -13.738 -14.124 -35.777 1.00109.12 C
-ANISOU 1395 C GLY H 196 19679 10987 10796 -2525 -3674 1358 C
-ATOM 1396 O GLY H 196 -13.039 -13.393 -35.070 1.00116.00 O
-ANISOU 1396 O GLY H 196 20665 11804 11608 -2566 -4014 1432 O
-ATOM 1397 N THR H 197 -13.221 -14.977 -36.659 1.00107.76 N
-ANISOU 1397 N THR H 197 19241 10740 10962 -2292 -3723 1431 N
-ATOM 1398 CA THR H 197 -11.787 -15.107 -36.864 1.00101.34 C
-ANISOU 1398 CA THR H 197 18160 9827 10518 -2033 -4107 1633 C
-ATOM 1399 C THR H 197 -11.349 -14.771 -38.283 1.00 90.97 C
-ANISOU 1399 C THR H 197 16259 8679 9627 -1713 -3908 1590 C
-ATOM 1400 O THR H 197 -10.147 -14.817 -38.569 1.00 89.33 O
-ANISOU 1400 O THR H 197 15713 8437 9789 -1458 -4135 1791 O
-ATOM 1401 CB THR H 197 -11.322 -16.529 -36.513 1.00 98.37 C
-ANISOU 1401 CB THR H 197 18063 9159 10154 -1939 -4368 1825 C
-ATOM 1402 OG1 THR H 197 -11.987 -17.474 -37.360 1.00 97.65 O
-ANISOU 1402 OG1 THR H 197 18009 9014 10081 -1841 -4065 1718 O
-ATOM 1403 CG2 THR H 197 -11.629 -16.850 -35.058 1.00 92.23 C
-ANISOU 1403 CG2 THR H 197 17922 8191 8929 -2253 -4596 1919 C
-ATOM 1404 N GLN H 198 -12.278 -14.438 -39.176 1.00 84.17 N
-ANISOU 1404 N GLN H 198 15262 7995 8725 -1705 -3489 1361 N
-ATOM 1405 CA GLN H 198 -11.948 -14.094 -40.555 1.00 82.85 C
-ANISOU 1405 CA GLN H 198 14637 7971 8871 -1395 -3267 1313 C
-ATOM 1406 C GLN H 198 -12.770 -12.884 -40.967 1.00 85.77 C
-ANISOU 1406 C GLN H 198 14861 8576 9153 -1519 -2992 1101 C
-ATOM 1407 O GLN H 198 -14.001 -12.957 -41.010 1.00 93.67 O
-ANISOU 1407 O GLN H 198 16043 9629 9918 -1684 -2760 906 O
-ATOM 1408 CB GLN H 198 -12.220 -15.269 -41.499 1.00 82.66 C
-ANISOU 1408 CB GLN H 198 14699 7827 8881 -1153 -3083 1246 C
-ATOM 1409 CG GLN H 198 -12.033 -14.935 -42.971 1.00 84.93 C
-ANISOU 1409 CG GLN H 198 14649 8246 9375 -810 -2796 1167 C
-ATOM 1410 CD GLN H 198 -10.601 -14.577 -43.314 1.00 88.34 C
-ANISOU 1410 CD GLN H 198 14645 8740 10180 -483 -2856 1411 C
-ATOM 1411 OE1 GLN H 198 -9.661 -15.033 -42.662 1.00 81.77 O
-ANISOU 1411 OE1 GLN H 198 13767 7784 9518 -402 -3146 1650 O
-ATOM 1412 NE2 GLN H 198 -10.428 -13.739 -44.334 1.00 93.17 N
-ANISOU 1412 NE2 GLN H 198 14911 9546 10945 -301 -2586 1387 N
-ATOM 1413 N THR H 199 -12.097 -11.776 -41.265 1.00 82.41 N
-ANISOU 1413 N THR H 199 14088 8279 8946 -1446 -3035 1165 N
-ATOM 1414 CA THR H 199 -12.781 -10.593 -41.769 1.00 88.52 C
-ANISOU 1414 CA THR H 199 14728 9241 9663 -1509 -2797 977 C
-ATOM 1415 C THR H 199 -13.018 -10.731 -43.266 1.00 93.55 C
-ANISOU 1415 C THR H 199 15137 9975 10434 -1233 -2471 880 C
-ATOM 1416 O THR H 199 -12.151 -11.202 -44.007 1.00 94.07 O
-ANISOU 1416 O THR H 199 14993 10009 10741 -931 -2436 1027 O
-ATOM 1417 CB THR H 199 -11.970 -9.328 -41.476 1.00 90.44 C
-ANISOU 1417 CB THR H 199 14759 9527 10077 -1583 -3021 1103 C
-ATOM 1418 OG1 THR H 199 -11.686 -9.251 -40.072 1.00102.61 O
-ANISOU 1418 OG1 THR H 199 16615 10921 11452 -1826 -3409 1192 O
-ATOM 1419 CG2 THR H 199 -12.739 -8.087 -41.895 1.00 79.36 C
-ANISOU 1419 CG2 THR H 199 13310 8270 8574 -1649 -2804 898 C
-ATOM 1420 N TYR H 200 -14.208 -10.329 -43.707 1.00 95.48 N
-ANISOU 1420 N TYR H 200 15443 10327 10506 -1309 -2231 639 N
-ATOM 1421 CA TYR H 200 -14.607 -10.431 -45.105 1.00 85.50 C
-ANISOU 1421 CA TYR H 200 14071 9122 9292 -1078 -1981 514 C
-ATOM 1422 C TYR H 200 -14.806 -9.033 -45.671 1.00 86.99 C
-ANISOU 1422 C TYR H 200 14048 9479 9524 -1058 -1849 434 C
-ATOM 1423 O TYR H 200 -15.674 -8.286 -45.206 1.00 86.16 O
-ANISOU 1423 O TYR H 200 14013 9454 9271 -1258 -1822 285 O
-ATOM 1424 CB TYR H 200 -15.878 -11.270 -45.250 1.00 69.14 C
-ANISOU 1424 CB TYR H 200 12249 6992 7030 -1191 -1897 325 C
-ATOM 1425 CG TYR H 200 -15.665 -12.722 -44.893 1.00 68.27 C
-ANISOU 1425 CG TYR H 200 12398 6658 6885 -1191 -2035 414 C
-ATOM 1426 CD1 TYR H 200 -14.970 -13.568 -45.743 1.00 83.14 C
-ANISOU 1426 CD1 TYR H 200 14327 8389 8872 -851 -2037 475 C
-ATOM 1427 CD2 TYR H 200 -16.147 -13.244 -43.702 1.00 74.63 C
-ANISOU 1427 CD2 TYR H 200 13449 7381 7527 -1501 -2144 450 C
-ATOM 1428 CE1 TYR H 200 -14.765 -14.897 -45.421 1.00 88.29 C
-ANISOU 1428 CE1 TYR H 200 15271 8788 9487 -819 -2191 550 C
-ATOM 1429 CE2 TYR H 200 -15.948 -14.572 -43.369 1.00 82.49 C
-ANISOU 1429 CE2 TYR H 200 14726 8133 8485 -1514 -2297 551 C
-ATOM 1430 CZ TYR H 200 -15.257 -15.394 -44.233 1.00 85.76 C
-ANISOU 1430 CZ TYR H 200 15187 8374 9025 -1171 -2344 593 C
-ATOM 1431 OH TYR H 200 -15.054 -16.717 -43.913 1.00 88.07 O
-ANISOU 1431 OH TYR H 200 15811 8377 9275 -1153 -2522 686 O
-ATOM 1432 N ILE H 201 -14.000 -8.687 -46.671 1.00 88.87 N
-ANISOU 1432 N ILE H 201 14046 9761 9960 -792 -1741 551 N
-ATOM 1433 CA ILE H 201 -14.025 -7.380 -47.316 1.00 84.89 C
-ANISOU 1433 CA ILE H 201 13356 9381 9518 -756 -1623 532 C
-ATOM 1434 C ILE H 201 -14.319 -7.578 -48.797 1.00 87.92 C
-ANISOU 1434 C ILE H 201 13759 9789 9858 -458 -1367 442 C
-ATOM 1435 O ILE H 201 -13.774 -8.493 -49.426 1.00 94.77 O
-ANISOU 1435 O ILE H 201 14662 10581 10764 -179 -1265 528 O
-ATOM 1436 CB ILE H 201 -12.687 -6.635 -47.116 1.00 78.41 C
-ANISOU 1436 CB ILE H 201 12227 8577 8988 -758 -1739 831 C
-ATOM 1437 CG1 ILE H 201 -12.290 -6.632 -45.639 1.00 79.04 C
-ANISOU 1437 CG1 ILE H 201 12380 8567 9086 -1036 -2097 930 C
-ATOM 1438 CG2 ILE H 201 -12.762 -5.225 -47.658 1.00 86.39 C
-ANISOU 1438 CG2 ILE H 201 13102 9672 10051 -791 -1658 827 C
-ATOM 1439 N CYS H 202 -15.186 -6.734 -49.353 1.00 84.82 N
-ANISOU 1439 N CYS H 202 13397 9474 9356 -483 -1279 266 N
-ATOM 1440 CA CYS H 202 -15.453 -6.745 -50.785 1.00 92.50 C
-ANISOU 1440 CA CYS H 202 14451 10449 10247 -204 -1090 188 C
-ATOM 1441 C CYS H 202 -14.834 -5.508 -51.424 1.00 83.11 C
-ANISOU 1441 C CYS H 202 13064 9343 9169 -101 -953 342 C
-ATOM 1442 O CYS H 202 -14.890 -4.407 -50.861 1.00 73.02 O
-ANISOU 1442 O CYS H 202 11670 8115 7960 -314 -1055 360 O
-ATOM 1443 CB CYS H 202 -16.958 -6.821 -51.095 1.00103.41 C
-ANISOU 1443 CB CYS H 202 16026 11825 11438 -291 -1141 -104 C
-ATOM 1444 SG CYS H 202 -17.874 -5.261 -51.114 1.00116.64 S
-ANISOU 1444 SG CYS H 202 17604 13627 13087 -417 -1152 -246 S
-ATOM 1445 N ASN H 203 -14.220 -5.709 -52.588 1.00 81.76 N
-ANISOU 1445 N ASN H 203 12905 9162 8998 236 -712 468 N
-ATOM 1446 CA ASN H 203 -13.518 -4.663 -53.321 1.00 76.72 C
-ANISOU 1446 CA ASN H 203 12081 8598 8472 356 -511 689 C
-ATOM 1447 C ASN H 203 -14.354 -4.295 -54.541 1.00 72.74 C
-ANISOU 1447 C ASN H 203 11862 8075 7701 537 -391 506 C
-ATOM 1448 O ASN H 203 -14.462 -5.080 -55.490 1.00 84.73 O
-ANISOU 1448 O ASN H 203 13665 9516 9012 849 -244 435 O
-ATOM 1449 CB ASN H 203 -12.120 -5.123 -53.727 1.00 81.33 C
-ANISOU 1449 CB ASN H 203 12438 9204 9259 641 -252 1036 C
-ATOM 1450 CG ASN H 203 -11.405 -5.871 -52.616 1.00 78.69 C
-ANISOU 1450 CG ASN H 203 11893 8845 9159 539 -432 1180 C
-ATOM 1451 OD1 ASN H 203 -11.458 -7.101 -52.542 1.00 68.54 O
-ANISOU 1451 OD1 ASN H 203 10798 7467 7779 706 -441 1094 O
-ATOM 1452 ND2 ASN H 203 -10.733 -5.130 -51.744 1.00 86.20 N
-ANISOU 1452 ND2 ASN H 203 12499 9841 10412 256 -631 1406 N
-ATOM 1453 N VAL H 204 -14.946 -3.106 -54.504 1.00 63.24 N
-ANISOU 1453 N VAL H 204 10641 6907 6482 361 -492 425 N
-ATOM 1454 CA VAL H 204 -15.767 -2.583 -55.587 1.00 75.14 C
-ANISOU 1454 CA VAL H 204 12406 8384 7760 509 -454 269 C
-ATOM 1455 C VAL H 204 -14.944 -1.553 -56.345 1.00 77.38 C
-ANISOU 1455 C VAL H 204 12601 8693 8107 624 -221 553 C
-ATOM 1456 O VAL H 204 -14.560 -0.518 -55.788 1.00 71.58 O
-ANISOU 1456 O VAL H 204 11634 7983 7582 392 -297 707 O
-ATOM 1457 CB VAL H 204 -17.071 -1.967 -55.054 1.00 76.37 C
-ANISOU 1457 CB VAL H 204 12600 8549 7869 282 -719 -6 C
-ATOM 1458 CG1 VAL H 204 -17.915 -1.423 -56.197 1.00 77.80 C
-ANISOU 1458 CG1 VAL H 204 13026 8685 7849 454 -745 -148 C
-ATOM 1459 CG2 VAL H 204 -17.850 -2.996 -54.256 1.00 78.79 C
-ANISOU 1459 CG2 VAL H 204 12936 8851 8151 132 -891 -215 C
-ATOM 1460 N ASN H 205 -14.664 -1.838 -57.613 1.00 81.00 N
-ANISOU 1460 N ASN H 205 13293 9119 8366 976 59 637 N
-ATOM 1461 CA ASN H 205 -13.934 -0.931 -58.487 1.00 76.21 C
-ANISOU 1461 CA ASN H 205 12653 8535 7769 1115 359 943 C
-ATOM 1462 C ASN H 205 -14.848 -0.525 -59.633 1.00 75.01 C
-ANISOU 1462 C ASN H 205 12967 8289 7246 1304 338 757 C
-ATOM 1463 O ASN H 205 -15.340 -1.383 -60.375 1.00 82.89 O
-ANISOU 1463 O ASN H 205 14374 9196 7924 1574 345 561 O
-ATOM 1464 CB ASN H 205 -12.653 -1.585 -59.012 1.00 76.91 C
-ANISOU 1464 CB ASN H 205 12620 8677 7925 1430 804 1281 C
-ATOM 1465 CG ASN H 205 -11.800 -0.630 -59.832 1.00 85.68 C
-ANISOU 1465 CG ASN H 205 13607 9841 9105 1535 1188 1689 C
-ATOM 1466 OD1 ASN H 205 -12.041 0.576 -59.856 1.00 88.06 O
-ANISOU 1466 OD1 ASN H 205 13880 10119 9461 1302 1062 1745 O
-ATOM 1467 ND2 ASN H 205 -10.785 -1.169 -60.496 1.00 92.41 N
-ANISOU 1467 ND2 ASN H 205 14387 10757 9967 1900 1682 1998 N
-ATOM 1468 N HIS H 206 -15.086 0.779 -59.759 1.00 68.18 N
-ANISOU 1468 N HIS H 206 12086 7406 6416 1157 254 816 N
-ATOM 1469 CA HIS H 206 -15.863 1.364 -60.850 1.00 76.67 C
-ANISOU 1469 CA HIS H 206 13591 8375 7165 1332 203 698 C
-ATOM 1470 C HIS H 206 -14.917 2.266 -61.639 1.00 85.22 C
-ANISOU 1470 C HIS H 206 14682 9454 8245 1427 567 1107 C
-ATOM 1471 O HIS H 206 -14.721 3.435 -61.296 1.00 90.75 O
-ANISOU 1471 O HIS H 206 15187 10135 9159 1175 486 1273 O
-ATOM 1472 CB HIS H 206 -17.066 2.128 -60.325 1.00 70.18 C
-ANISOU 1472 CB HIS H 206 12771 7510 6386 1112 -223 416 C
-ATOM 1473 CG HIS H 206 -17.936 2.698 -61.402 1.00 79.94 C
-ANISOU 1473 CG HIS H 206 14428 8623 7323 1301 -362 287 C
-ATOM 1474 ND1 HIS H 206 -18.152 4.052 -61.545 1.00 86.02 N
-ANISOU 1474 ND1 HIS H 206 15242 9319 8124 1227 -466 358 N
-ATOM 1475 CD2 HIS H 206 -18.645 2.098 -62.388 1.00 72.72 C
-ANISOU 1475 CD2 HIS H 206 13956 7610 6066 1561 -474 96 C
-ATOM 1476 CE1 HIS H 206 -18.958 4.261 -62.571 1.00 80.21 C
-ANISOU 1476 CE1 HIS H 206 14929 8463 7086 1449 -622 225 C
-ATOM 1477 NE2 HIS H 206 -19.272 3.092 -63.099 1.00 76.98 N
-ANISOU 1477 NE2 HIS H 206 14769 8035 6443 1644 -650 64 N
-ATOM 1478 N LYS H 207 -14.328 1.707 -62.695 1.00 81.77 N
-ANISOU 1478 N LYS H 207 14507 9011 7550 1799 983 1283 N
-ATOM 1479 CA LYS H 207 -13.347 2.451 -63.480 1.00 85.26 C
-ANISOU 1479 CA LYS H 207 14929 9477 7990 1913 1446 1743 C
-ATOM 1480 C LYS H 207 -13.901 3.710 -64.142 1.00102.53 C
-ANISOU 1480 C LYS H 207 17438 11532 9985 1860 1318 1766 C
-ATOM 1481 O LYS H 207 -13.165 4.712 -64.190 1.00105.52 O
-ANISOU 1481 O LYS H 207 17588 11921 10584 1684 1511 2163 O
-ATOM 1482 CB LYS H 207 -12.722 1.521 -64.529 1.00 85.46 C
-ANISOU 1482 CB LYS H 207 15273 9514 7683 2417 1978 1892 C
-ATOM 1483 CG LYS H 207 -12.015 0.306 -63.948 1.00 82.72 C
-ANISOU 1483 CG LYS H 207 14609 9275 7545 2537 2158 1932 C
-ATOM 1484 N PRO H 208 -15.132 3.741 -64.680 1.00107.40 N
-ANISOU 1484 N PRO H 208 18571 12006 10231 1991 976 1399 N
-ATOM 1485 CA PRO H 208 -15.603 4.980 -65.326 1.00 95.16 C
-ANISOU 1485 CA PRO H 208 17338 10308 8510 1972 839 1455 C
-ATOM 1486 C PRO H 208 -15.546 6.200 -64.427 1.00 97.23 C
-ANISOU 1486 C PRO H 208 17211 10553 9181 1563 607 1562 C
-ATOM 1487 O PRO H 208 -15.311 7.310 -64.922 1.00100.45 O
-ANISOU 1487 O PRO H 208 17763 10845 9559 1505 681 1828 O
-ATOM 1488 CB PRO H 208 -17.047 4.640 -65.719 1.00 85.29 C
-ANISOU 1488 CB PRO H 208 16551 8926 6930 2128 358 986 C
-ATOM 1489 CG PRO H 208 -17.032 3.179 -65.926 1.00 94.91 C
-ANISOU 1489 CG PRO H 208 17946 10169 7947 2364 448 815 C
-ATOM 1490 CD PRO H 208 -16.089 2.635 -64.889 1.00104.33 C
-ANISOU 1490 CD PRO H 208 18545 11549 9548 2191 699 971 C
-ATOM 1491 N SER H 209 -15.748 6.034 -63.122 1.00 98.01 N
-ANISOU 1491 N SER H 209 16888 10726 9627 1282 322 1369 N
-ATOM 1492 CA SER H 209 -15.657 7.138 -62.179 1.00105.19 C
-ANISOU 1492 CA SER H 209 17515 11572 10882 915 75 1441 C
-ATOM 1493 C SER H 209 -14.375 7.100 -61.358 1.00100.97 C
-ANISOU 1493 C SER H 209 16461 11134 10770 633 248 1788 C
-ATOM 1494 O SER H 209 -14.219 7.909 -60.437 1.00 92.67 O
-ANISOU 1494 O SER H 209 15203 9997 10011 294 -22 1838 O
-ATOM 1495 CB SER H 209 -16.877 7.144 -61.254 1.00102.18 C
-ANISOU 1495 CB SER H 209 17106 11170 10549 819 -393 979 C
-ATOM 1496 OG SER H 209 -17.003 5.916 -60.559 1.00 99.60 O
-ANISOU 1496 OG SER H 209 16559 10995 10292 807 -411 775 O
-ATOM 1497 N ASN H 210 -13.452 6.192 -61.684 1.00125.54 N
-ANISOU 1497 N ASN H 210 17867 17882 11948 2488 -1235 4950 N
-ATOM 1498 CA ASN H 210 -12.227 5.986 -60.910 1.00128.74 C
-ANISOU 1498 CA ASN H 210 18137 18757 12021 1747 -1330 5218 C
-ATOM 1499 C ASN H 210 -12.545 5.846 -59.424 1.00120.25 C
-ANISOU 1499 C ASN H 210 17603 16830 11256 959 -1290 4533 C
-ATOM 1500 O ASN H 210 -11.981 6.532 -58.570 1.00120.05 O
-ANISOU 1500 O ASN H 210 17790 16475 11347 -14 -1226 4708 O
-ATOM 1501 CB ASN H 210 -11.222 7.111 -61.158 1.00138.82 C
-ANISOU 1501 CB ASN H 210 19182 20250 13312 1076 -1225 6070 C
-ATOM 1502 CG ASN H 210 -10.626 7.062 -62.551 1.00153.58 C
-ANISOU 1502 CG ASN H 210 20385 22888 15079 1654 -1193 6244 C
-ATOM 1503 OD1 ASN H 210 -10.802 7.982 -63.349 1.00166.11 O
-ANISOU 1503 OD1 ASN H 210 21857 24418 16840 1752 -1058 6750 O
-ATOM 1504 ND2 ASN H 210 -9.914 5.982 -62.851 1.00154.79 N
-ANISOU 1504 ND2 ASN H 210 20083 23729 15001 1997 -1300 5840 N
-ATOM 1505 N THR H 211 -13.474 4.943 -59.120 1.00108.85 N
-ANISOU 1505 N THR H 211 16358 15044 9958 1412 -1348 3757 N
-ATOM 1506 CA THR H 211 -13.998 4.762 -57.768 1.00 96.66 C
-ANISOU 1506 CA THR H 211 15305 12717 8705 806 -1267 3094 C
-ATOM 1507 C THR H 211 -13.592 3.378 -57.271 1.00 98.21 C
-ANISOU 1507 C THR H 211 15313 13446 8555 956 -1533 2809 C
-ATOM 1508 O THR H 211 -14.293 2.391 -57.502 1.00 99.61 O
-ANISOU 1508 O THR H 211 15406 13622 8820 1663 -1696 2361 O
-ATOM 1509 CB THR H 211 -15.524 4.948 -57.744 1.00 89.28 C
-ANISOU 1509 CB THR H 211 14750 10848 8324 1129 -1087 2484 C
-ATOM 1510 OG1 THR H 211 -15.852 6.271 -58.187 1.00 88.47 O
-ANISOU 1510 OG1 THR H 211 14831 10223 8561 967 -880 2759 O
-ATOM 1511 CG2 THR H 211 -16.080 4.729 -56.337 1.00 79.52 C
-ANISOU 1511 CG2 THR H 211 13959 8935 7322 554 -972 1839 C
-ATOM 1512 N LYS H 212 -12.452 3.308 -56.591 1.00 93.89 N
-ANISOU 1512 N LYS H 212 14686 13325 7663 285 -1621 3079 N
-ATOM 1513 CA LYS H 212 -12.006 2.092 -55.927 1.00 86.35 C
-ANISOU 1513 CA LYS H 212 13613 12786 6410 264 -1878 2823 C
-ATOM 1514 C LYS H 212 -12.371 2.181 -54.450 1.00 90.57 C
-ANISOU 1514 C LYS H 212 14650 12601 7160 -541 -1727 2362 C
-ATOM 1515 O LYS H 212 -12.012 3.152 -53.776 1.00104.60 O
-ANISOU 1515 O LYS H 212 16707 14043 8992 -1366 -1555 2488 O
-ATOM 1516 CB LYS H 212 -10.500 1.889 -56.103 1.00 81.43 C
-ANISOU 1516 CB LYS H 212 12544 13096 5300 112 -2052 3330 C
-ATOM 1517 N VAL H 213 -13.087 1.171 -53.957 1.00 90.57 N
-ANISOU 1517 N VAL H 213 14737 12383 7293 -276 -1822 1842 N
-ATOM 1518 CA VAL H 213 -13.653 1.175 -52.610 1.00 85.44 C
-ANISOU 1518 CA VAL H 213 14527 11101 6835 -887 -1639 1391 C
-ATOM 1519 C VAL H 213 -13.497 -0.213 -52.005 1.00 79.65 C
-ANISOU 1519 C VAL H 213 13637 10694 5931 -792 -1922 1200 C
-ATOM 1520 O VAL H 213 -13.836 -1.213 -52.645 1.00 85.87 O
-ANISOU 1520 O VAL H 213 14122 11691 6816 -27 -2206 1093 O
-ATOM 1521 CB VAL H 213 -15.138 1.591 -52.625 1.00 78.26 C
-ANISOU 1521 CB VAL H 213 13934 9338 6465 -650 -1356 949 C
-ATOM 1522 CG1 VAL H 213 -15.821 1.206 -51.329 1.00 71.59 C
-ANISOU 1522 CG1 VAL H 213 13395 8051 5755 -1036 -1213 478 C
-ATOM 1523 CG2 VAL H 213 -15.265 3.088 -52.856 1.00 90.86 C
-ANISOU 1523 CG2 VAL H 213 15798 10458 8267 -976 -1079 1083 C
-ATOM 1524 N ASP H 214 -12.986 -0.278 -50.776 1.00 84.16 N
-ANISOU 1524 N ASP H 214 14409 11293 6273 -1548 -1891 1152 N
-ATOM 1525 CA ASP H 214 -12.899 -1.519 -50.011 1.00 86.60 C
-ANISOU 1525 CA ASP H 214 14627 11821 6456 -1582 -2132 998 C
-ATOM 1526 C ASP H 214 -13.856 -1.429 -48.828 1.00 76.62 C
-ANISOU 1526 C ASP H 214 13761 9933 5417 -2001 -1834 603 C
-ATOM 1527 O ASP H 214 -13.673 -0.585 -47.946 1.00 81.17 O
-ANISOU 1527 O ASP H 214 14691 10299 5852 -2704 -1575 525 O
-ATOM 1528 CB ASP H 214 -11.472 -1.774 -49.522 1.00100.45 C
-ANISOU 1528 CB ASP H 214 16066 14175 7925 -1965 -2247 1239 C
-ATOM 1529 CG ASP H 214 -10.494 -2.015 -50.659 1.00115.03 C
-ANISOU 1529 CG ASP H 214 17272 16658 9774 -1336 -2380 1516 C
-ATOM 1530 OD1 ASP H 214 -10.926 -2.484 -51.732 1.00117.44 O
-ANISOU 1530 OD1 ASP H 214 17302 17124 10194 -500 -2525 1477 O
-ATOM 1531 OD2 ASP H 214 -9.289 -1.740 -50.473 1.00122.81 O1-
-ANISOU 1531 OD2 ASP H 214 18048 17968 10645 -1642 -2338 1732 O1-
-ATOM 1532 N LYS H 215 -14.867 -2.296 -48.804 1.00 79.26 N
-ANISOU 1532 N LYS H 215 14010 9999 6106 -1550 -1896 359 N
-ATOM 1533 CA LYS H 215 -15.908 -2.245 -47.784 1.00 86.08 C
-ANISOU 1533 CA LYS H 215 15168 10337 7202 -1842 -1577 35 C
-ATOM 1534 C LYS H 215 -15.870 -3.498 -46.918 1.00 91.70 C
-ANISOU 1534 C LYS H 215 15728 11273 7840 -1967 -1804 70 C
-ATOM 1535 O LYS H 215 -15.844 -4.620 -47.438 1.00 98.07 O
-ANISOU 1535 O LYS H 215 16163 12275 8823 -1448 -2233 169 O
-ATOM 1536 CB LYS H 215 -17.293 -2.083 -48.418 1.00 84.72 C
-ANISOU 1536 CB LYS H 215 15011 9574 7605 -1268 -1400 -232 C
-ATOM 1537 CG LYS H 215 -18.418 -1.919 -47.408 1.00 91.90 C
-ANISOU 1537 CG LYS H 215 16187 9990 8743 -1537 -1015 -552 C
-ATOM 1538 CD LYS H 215 -18.105 -0.801 -46.427 1.00107.55 C
-ANISOU 1538 CD LYS H 215 18602 11885 10375 -2282 -657 -684 C
-ATOM 1539 CE LYS H 215 -19.270 -0.531 -45.488 1.00116.03 C
-ANISOU 1539 CE LYS H 215 19927 12546 11614 -2444 -244 -1051 C
-ATOM 1540 NZ LYS H 215 -20.444 0.040 -46.202 1.00118.63 N
-ANISOU 1540 NZ LYS H 215 20322 12287 12464 -1965 -18 -1318 N
-ATOM 1541 N ARG H 216 -15.886 -3.298 -45.600 1.00 84.82 N
-ANISOU 1541 N ARG H 216 15135 10371 6722 -2626 -1547 -16 N
-ATOM 1542 CA ARG H 216 -15.856 -4.390 -44.635 1.00 80.97 C
-ANISOU 1542 CA ARG H 216 14526 10114 6125 -2839 -1708 89 C
-ATOM 1543 C ARG H 216 -17.275 -4.859 -44.339 1.00 81.74 C
-ANISOU 1543 C ARG H 216 14568 9773 6716 -2592 -1530 -58 C
-ATOM 1544 O ARG H 216 -18.173 -4.042 -44.110 1.00 85.11 O
-ANISOU 1544 O ARG H 216 15251 9791 7297 -2652 -1078 -330 O
-ATOM 1545 CB ARG H 216 -15.165 -3.944 -43.344 1.00 76.10 C
-ANISOU 1545 CB ARG H 216 14211 9768 4935 -3633 -1520 90 C
-ATOM 1546 CG ARG H 216 -15.103 -5.003 -42.247 1.00 73.50 C
-ANISOU 1546 CG ARG H 216 13776 9735 4418 -3904 -1650 254 C
-ATOM 1547 CD ARG H 216 -14.428 -4.450 -40.991 1.00 84.82 C
-ANISOU 1547 CD ARG H 216 15303 11367 5556 -4478 -1366 214 C
-ATOM 1548 NE ARG H 216 -14.225 -5.470 -39.965 1.00 78.19 N
-ANISOU 1548 NE ARG H 216 14229 10832 4645 -4647 -1466 429 N
-ATOM 1549 N VAL H 217 -17.471 -6.174 -44.342 1.00 76.26 N
-ANISOU 1549 N VAL H 217 13514 9159 6304 -2311 -1916 132 N
-ATOM 1550 CA VAL H 217 -18.760 -6.786 -44.047 1.00 68.53 C
-ANISOU 1550 CA VAL H 217 12376 7794 5868 -2104 -1829 109 C
-ATOM 1551 C VAL H 217 -18.615 -7.546 -42.735 1.00 75.00 C
-ANISOU 1551 C VAL H 217 13133 8910 6453 -2607 -1851 384 C
-ATOM 1552 O VAL H 217 -17.889 -8.545 -42.659 1.00 80.62 O
-ANISOU 1552 O VAL H 217 13593 9937 7103 -2615 -2351 667 O
-ATOM 1553 CB VAL H 217 -19.225 -7.712 -45.177 1.00 67.76 C
-ANISOU 1553 CB VAL H 217 11859 7447 6441 -1324 -2338 132 C
-ATOM 1554 CG1 VAL H 217 -20.580 -8.321 -44.842 1.00 67.00 C
-ANISOU 1554 CG1 VAL H 217 11559 6905 6993 -1165 -2268 155 C
-ATOM 1555 CG2 VAL H 217 -19.282 -6.953 -46.493 1.00 65.16 C
-ANISOU 1555 CG2 VAL H 217 11580 6938 6238 -791 -2321 -106 C
-ATOM 1556 N GLU H 218 -19.303 -7.077 -41.700 1.00 78.23 N
-ANISOU 1556 N GLU H 218 13757 9258 6708 -2994 -1322 304 N
-ATOM 1557 CA GLU H 218 -19.278 -7.705 -40.392 1.00 89.27 C
-ANISOU 1557 CA GLU H 218 15093 11001 7823 -3459 -1254 599 C
-ATOM 1558 C GLU H 218 -20.704 -7.919 -39.907 1.00 87.96 C
-ANISOU 1558 C GLU H 218 14776 10569 8077 -3371 -905 652 C
-ATOM 1559 O GLU H 218 -21.618 -7.202 -40.327 1.00 82.15 O
-ANISOU 1559 O GLU H 218 14145 9428 7641 -3102 -557 331 O
-ATOM 1560 CB GLU H 218 -18.497 -6.845 -39.384 1.00 96.25 C
-ANISOU 1560 CB GLU H 218 16394 12307 7871 -4085 -928 467 C
-ATOM 1561 CG GLU H 218 -19.247 -5.628 -38.864 1.00110.48 C
-ANISOU 1561 CG GLU H 218 18561 13935 9480 -4237 -291 57 C
-ATOM 1562 CD GLU H 218 -18.354 -4.697 -38.064 1.00128.86 C
-ANISOU 1562 CD GLU H 218 21312 16601 11049 -4773 -112 -173 C
-ATOM 1563 OE1 GLU H 218 -17.137 -4.965 -37.982 1.00136.38 O
-ANISOU 1563 OE1 GLU H 218 22265 17914 11641 -5040 -461 11 O
-ATOM 1564 OE2 GLU H 218 -18.868 -3.698 -37.517 1.00135.08 O1-
-ANISOU 1564 OE2 GLU H 218 22419 17286 11620 -4903 339 -567 O1-
-ATOM 1565 N PRO H 219 -20.930 -8.910 -39.042 1.00100.05 N
-ANISOU 1565 N PRO H 219 16023 12330 9662 -3586 -999 1098 N
-ATOM 1566 CA PRO H 219 -22.290 -9.151 -38.545 1.00108.17 C
-ANISOU 1566 CA PRO H 219 16823 13181 11096 -3526 -651 1255 C
-ATOM 1567 C PRO H 219 -22.810 -7.971 -37.738 1.00120.07 C
-ANISOU 1567 C PRO H 219 18696 14850 12077 -3773 101 909 C
-ATOM 1568 O PRO H 219 -22.050 -7.149 -37.221 1.00113.74 O
-ANISOU 1568 O PRO H 219 18306 14378 10533 -4119 310 641 O
-ATOM 1569 CB PRO H 219 -22.136 -10.404 -37.672 1.00100.59 C
-ANISOU 1569 CB PRO H 219 15497 12568 10155 -3818 -935 1907 C
-ATOM 1570 CG PRO H 219 -20.690 -10.445 -37.315 1.00 86.88 C
-ANISOU 1570 CG PRO H 219 13977 11316 7715 -4181 -1196 1957 C
-ATOM 1571 CD PRO H 219 -19.971 -9.892 -38.508 1.00 95.63 C
-ANISOU 1571 CD PRO H 219 15290 12205 8840 -3879 -1455 1535 C
-ATOM 1572 N LYS H 220 -24.139 -7.899 -37.636 1.00139.38 N
-ANISOU 1572 N LYS H 220 20961 17051 14946 -3561 472 893 N
-ATOM 1573 CA LYS H 220 -24.803 -6.784 -36.970 1.00149.59 C
-ANISOU 1573 CA LYS H 220 22554 18464 15818 -3659 1169 490 C
-ATOM 1574 C LYS H 220 -24.461 -6.735 -35.484 1.00159.96 C
-ANISOU 1574 C LYS H 220 23983 20523 16273 -4157 1485 655 C
-ATOM 1575 O LYS H 220 -23.771 -7.620 -34.966 1.00163.33 O
-ANISOU 1575 O LYS H 220 24231 21350 16478 -4449 1179 1151 O
-ATOM 1576 CB LYS H 220 -26.319 -6.870 -37.166 1.00148.29 C
-ANISOU 1576 CB LYS H 220 22078 17945 16320 -3296 1466 506 C
-ATOM 1577 N SER H 221 -24.957 -5.708 -34.793 1.00159.14 N
-ANISOU 1577 N SER H 221 24169 20624 15674 -4211 2071 218 N
-ATOM 1578 CA SER H 221 -24.521 -5.431 -33.427 1.00159.61 C
-ANISOU 1578 CA SER H 221 24432 21431 14781 -4612 2359 199 C
-ATOM 1579 C SER H 221 -24.911 -6.554 -32.471 1.00170.07 C
-ANISOU 1579 C SER H 221 25275 23335 16010 -4784 2446 947 C
-ATOM 1580 O SER H 221 -24.058 -7.124 -31.782 1.00167.29 O
-ANISOU 1580 O SER H 221 24895 23499 15169 -5143 2232 1329 O
-ATOM 1581 CB SER H 221 -25.107 -4.098 -32.961 1.00156.01 C
-ANISOU 1581 CB SER H 221 24350 21036 13889 -4506 2921 -505 C
-ATOM 1582 OG SER H 221 -26.520 -4.166 -32.884 1.00154.07 O
-ANISOU 1582 OG SER H 221 23790 20726 14022 -4185 3341 -448 O
-ATOM 1583 N CYS H 222 -26.200 -6.883 -32.417 1.00177.60 N
-ANISOU 1583 N CYS H 222 25817 24218 17445 -4542 2751 1208 N
-ATOM 1584 CA CYS H 222 -26.736 -7.802 -31.411 1.00188.27 C
-ANISOU 1584 CA CYS H 222 26664 26183 18688 -4712 2945 1971 C
-ATOM 1585 C CYS H 222 -26.193 -9.231 -31.512 1.00192.04 C
-ANISOU 1585 C CYS H 222 26724 26643 19598 -4924 2330 2801 C
-ATOM 1586 O CYS H 222 -26.864 -10.140 -32.000 1.00196.67 O
-ANISOU 1586 O CYS H 222 26789 26834 21101 -4764 2071 3322 O
-ATOM 1587 CB CYS H 222 -28.266 -7.825 -31.500 1.00189.06 C
-ANISOU 1587 CB CYS H 222 26351 26123 19359 -4383 3366 2095 C
-ATOM 1588 SG CYS H 222 -28.931 -8.119 -33.162 1.00177.49 S
-ANISOU 1588 SG CYS H 222 24651 23526 19263 -3920 2955 2004 S
-TER 1589 CYS H 222
-ATOM 1590 N ASP L 1 -38.866 -7.760 -95.403 1.00102.84 N
-ANISOU 1590 N ASP L 1 12698 12893 13485 3628 -1976 -561 N
-ATOM 1591 CA ASP L 1 -38.069 -8.557 -94.476 1.00 95.15 C
-ANISOU 1591 CA ASP L 1 12128 11747 12279 3510 -1947 -835 C
-ATOM 1592 C ASP L 1 -38.493 -10.027 -94.506 1.00 92.51 C
-ANISOU 1592 C ASP L 1 11821 11625 11703 3248 -1974 -896 C
-ATOM 1593 O ASP L 1 -39.650 -10.344 -94.778 1.00 95.68 O
-ANISOU 1593 O ASP L 1 11947 12269 12136 3171 -1933 -774 O
-ATOM 1594 CB ASP L 1 -38.186 -7.998 -93.056 1.00 83.58 C
-ANISOU 1594 CB ASP L 1 10854 10018 10885 3667 -1707 -1014 C
-ATOM 1595 N ILE L 2 -37.548 -10.919 -94.223 1.00 88.11 N
-ANISOU 1595 N ILE L 2 11591 10966 10922 3107 -2049 -1067 N
-ATOM 1596 CA ILE L 2 -37.780 -12.359 -94.237 1.00 89.71 C
-ANISOU 1596 CA ILE L 2 11886 11292 10909 2855 -2089 -1143 C
-ATOM 1597 C ILE L 2 -37.471 -12.917 -92.854 1.00 80.09 C
-ANISOU 1597 C ILE L 2 10978 9883 9570 2812 -1950 -1333 C
-ATOM 1598 O ILE L 2 -36.392 -12.668 -92.304 1.00 67.77 O
-ANISOU 1598 O ILE L 2 9681 8102 7965 2888 -1961 -1440 O
-ATOM 1599 CB ILE L 2 -36.936 -13.053 -95.321 1.00 88.34 C
-ANISOU 1599 CB ILE L 2 11813 11183 10569 2731 -2310 -1148 C
-ATOM 1600 CG1 ILE L 2 -36.950 -14.566 -95.120 1.00 74.06 C
-ANISOU 1600 CG1 ILE L 2 10214 9379 8548 2490 -2335 -1283 C
-ATOM 1601 CG2 ILE L 2 -35.522 -12.488 -95.344 1.00 96.00 C
-ANISOU 1601 CG2 ILE L 2 12974 11959 11544 2874 -2381 -1178 C
-ATOM 1602 CD1 ILE L 2 -36.182 -15.306 -96.173 1.00 78.21 C
-ANISOU 1602 CD1 ILE L 2 10866 9949 8900 2393 -2515 -1322 C
-ATOM 1603 N GLN L 3 -38.409 -13.683 -92.302 1.00 73.75 N
-ANISOU 1603 N GLN L 3 10128 9186 8708 2670 -1834 -1345 N
-ATOM 1604 CA GLN L 3 -38.395 -14.046 -90.892 1.00 68.17 C
-ANISOU 1604 CA GLN L 3 9645 8353 7904 2649 -1657 -1475 C
-ATOM 1605 C GLN L 3 -37.896 -15.467 -90.668 1.00 72.58 C
-ANISOU 1605 C GLN L 3 10463 8857 8257 2416 -1740 -1558 C
-ATOM 1606 O GLN L 3 -38.311 -16.404 -91.355 1.00 65.50 O
-ANISOU 1606 O GLN L 3 9494 8083 7309 2211 -1847 -1510 O
-ATOM 1607 CB GLN L 3 -39.790 -13.893 -90.285 1.00 74.58 C
-ANISOU 1607 CB GLN L 3 10215 9325 8796 2671 -1431 -1397 C
-ATOM 1608 CG GLN L 3 -40.398 -12.520 -90.488 1.00101.40 C
-ANISOU 1608 CG GLN L 3 13335 12763 12431 2935 -1315 -1295 C
-ATOM 1609 CD GLN L 3 -41.688 -12.339 -89.716 1.00127.72 C
-ANISOU 1609 CD GLN L 3 16447 16243 15839 3012 -1034 -1224 C
-ATOM 1610 OE1 GLN L 3 -41.918 -13.007 -88.706 1.00131.56 O
-ANISOU 1610 OE1 GLN L 3 17067 16744 16175 2915 -886 -1299 O
-ATOM 1611 NE2 GLN L 3 -42.536 -11.429 -90.183 1.00138.36 N
-ANISOU 1611 NE2 GLN L 3 17435 17712 17424 3202 -949 -1051 N
-ATOM 1612 N MET L 4 -37.021 -15.618 -89.676 1.00 75.17 N
-ANISOU 1612 N MET L 4 11099 8989 8472 2442 -1695 -1678 N
-ATOM 1613 CA MET L 4 -36.499 -16.906 -89.246 1.00 63.55 C
-ANISOU 1613 CA MET L 4 9887 7428 6830 2258 -1743 -1732 C
-ATOM 1614 C MET L 4 -37.173 -17.329 -87.947 1.00 65.05 C
-ANISOU 1614 C MET L 4 10131 7647 6937 2173 -1547 -1742 C
-ATOM 1615 O MET L 4 -37.456 -16.494 -87.083 1.00 86.48 O
-ANISOU 1615 O MET L 4 12832 10364 9661 2315 -1370 -1780 O
-ATOM 1616 CB MET L 4 -34.984 -16.835 -89.050 1.00 61.38 C
-ANISOU 1616 CB MET L 4 9892 6950 6480 2337 -1848 -1801 C
-ATOM 1617 CG MET L 4 -34.228 -16.457 -90.311 1.00 65.55 C
-ANISOU 1617 CG MET L 4 10363 7473 7072 2426 -2026 -1764 C
-ATOM 1618 SD MET L 4 -34.243 -17.793 -91.519 1.00 74.54 S
-ANISOU 1618 SD MET L 4 11510 8682 8131 2251 -2171 -1753 S
-ATOM 1619 CE MET L 4 -34.362 -16.864 -93.046 1.00 96.57 C
-ANISOU 1619 CE MET L 4 14023 11649 11022 2361 -2292 -1663 C
-ATOM 1620 N THR L 5 -37.430 -18.630 -87.810 1.00 67.79 N
-ANISOU 1620 N THR L 5 10551 8009 7197 1941 -1572 -1708 N
-ATOM 1621 CA THR L 5 -38.106 -19.162 -86.628 1.00 82.80 C
-ANISOU 1621 CA THR L 5 12479 9970 9012 1825 -1394 -1669 C
-ATOM 1622 C THR L 5 -37.354 -20.381 -86.105 1.00 83.01 C
-ANISOU 1622 C THR L 5 12806 9834 8902 1661 -1465 -1676 C
-ATOM 1623 O THR L 5 -37.396 -21.454 -86.718 1.00 78.40 O
-ANISOU 1623 O THR L 5 12259 9199 8329 1470 -1593 -1640 O
-ATOM 1624 CB THR L 5 -39.562 -19.512 -86.939 1.00 85.11 C
-ANISOU 1624 CB THR L 5 12458 10492 9388 1671 -1329 -1534 C
-ATOM 1625 OG1 THR L 5 -40.286 -18.308 -87.221 1.00 80.78 O
-ANISOU 1625 OG1 THR L 5 11611 10101 8980 1867 -1220 -1491 O
-ATOM 1626 CG2 THR L 5 -40.206 -20.226 -85.758 1.00 90.41 C
-ANISOU 1626 CG2 THR L 5 13151 11240 9961 1518 -1154 -1453 C
-ATOM 1627 N GLN L 6 -36.683 -20.216 -84.966 1.00 71.40 N
-ANISOU 1627 N GLN L 6 11554 8275 7300 1730 -1385 -1717 N
-ATOM 1628 CA GLN L 6 -35.980 -21.307 -84.308 1.00 66.78 C
-ANISOU 1628 CA GLN L 6 11232 7551 6590 1593 -1436 -1676 C
-ATOM 1629 C GLN L 6 -36.906 -22.049 -83.353 1.00 77.75 C
-ANISOU 1629 C GLN L 6 12588 9056 7898 1406 -1279 -1563 C
-ATOM 1630 O GLN L 6 -37.859 -21.483 -82.809 1.00 80.06 O
-ANISOU 1630 O GLN L 6 12707 9543 8170 1446 -1081 -1543 O
-ATOM 1631 CB GLN L 6 -34.773 -20.790 -83.530 1.00 65.70 C
-ANISOU 1631 CB GLN L 6 11333 7300 6332 1725 -1459 -1734 C
-ATOM 1632 CG GLN L 6 -33.614 -20.334 -84.373 1.00 67.71 C
-ANISOU 1632 CG GLN L 6 11652 7420 6656 1865 -1641 -1785 C
-ATOM 1633 CD GLN L 6 -32.341 -20.228 -83.561 1.00 78.46 C
-ANISOU 1633 CD GLN L 6 13256 8664 7890 1912 -1710 -1777 C
-ATOM 1634 OE1 GLN L 6 -31.432 -19.479 -83.906 1.00 88.87 O
-ANISOU 1634 OE1 GLN L 6 14608 9914 9246 2042 -1824 -1809 O
-ATOM 1635 NE2 GLN L 6 -32.270 -20.985 -82.472 1.00 69.59 N
-ANISOU 1635 NE2 GLN L 6 12287 7537 6617 1786 -1656 -1700 N
-ATOM 1636 N SER L 7 -36.600 -23.323 -83.137 1.00 69.73 N
-ANISOU 1636 N SER L 7 11737 7914 6843 1217 -1356 -1472 N
-ATOM 1637 CA SER L 7 -37.367 -24.161 -82.229 1.00 76.17 C
-ANISOU 1637 CA SER L 7 12534 8819 7587 1007 -1233 -1319 C
-ATOM 1638 C SER L 7 -36.500 -25.307 -81.715 1.00 88.43 C
-ANISOU 1638 C SER L 7 14365 10162 9073 884 -1327 -1222 C
-ATOM 1639 O SER L 7 -35.856 -26.000 -82.503 1.00 94.01 O
-ANISOU 1639 O SER L 7 15198 10644 9877 852 -1500 -1241 O
-ATOM 1640 CB SER L 7 -38.616 -24.705 -82.921 1.00 81.96 C
-ANISOU 1640 CB SER L 7 13019 9662 8459 802 -1240 -1228 C
-ATOM 1641 OG SER L 7 -39.375 -25.514 -82.043 1.00 93.63 O
-ANISOU 1641 OG SER L 7 14453 11238 9883 579 -1123 -1041 O
-ATOM 1642 N PRO L 8 -36.481 -25.513 -80.387 1.00 80.91 N
-ANISOU 1642 N PRO L 8 13507 9287 7948 829 -1203 -1108 N
-ATOM 1643 CA PRO L 8 -37.231 -24.733 -79.401 1.00 81.01 C
-ANISOU 1643 CA PRO L 8 13401 9574 7804 884 -965 -1104 C
-ATOM 1644 C PRO L 8 -36.486 -23.480 -78.967 1.00 81.74 C
-ANISOU 1644 C PRO L 8 13611 9688 7759 1129 -929 -1277 C
-ATOM 1645 O PRO L 8 -35.322 -23.309 -79.324 1.00 75.77 O
-ANISOU 1645 O PRO L 8 13018 8748 7023 1223 -1106 -1349 O
-ATOM 1646 CB PRO L 8 -37.371 -25.707 -78.237 1.00 90.73 C
-ANISOU 1646 CB PRO L 8 14732 10857 8884 684 -885 -887 C
-ATOM 1647 CG PRO L 8 -36.100 -26.488 -78.290 1.00 86.21 C
-ANISOU 1647 CG PRO L 8 14424 10006 8326 652 -1091 -832 C
-ATOM 1648 CD PRO L 8 -35.732 -26.612 -79.752 1.00 77.57 C
-ANISOU 1648 CD PRO L 8 13319 8690 7462 707 -1279 -953 C
-ATOM 1649 N SER L 9 -37.155 -22.613 -78.204 1.00 87.21 N
-ANISOU 1649 N SER L 9 14222 10598 8315 1229 -699 -1339 N
-ATOM 1650 CA SER L 9 -36.495 -21.410 -77.711 1.00 89.87 C
-ANISOU 1650 CA SER L 9 14713 10924 8508 1435 -665 -1530 C
-ATOM 1651 C SER L 9 -35.476 -21.738 -76.627 1.00 87.47 C
-ANISOU 1651 C SER L 9 14707 10581 7946 1362 -733 -1483 C
-ATOM 1652 O SER L 9 -34.445 -21.064 -76.521 1.00 88.69 O
-ANISOU 1652 O SER L 9 15043 10626 8031 1463 -859 -1603 O
-ATOM 1653 CB SER L 9 -37.538 -20.417 -77.196 1.00106.73 C
-ANISOU 1653 CB SER L 9 16706 13277 10570 1583 -371 -1632 C
-ATOM 1654 OG SER L 9 -38.536 -21.077 -76.436 1.00119.73 O
-ANISOU 1654 OG SER L 9 18235 15158 12100 1448 -156 -1464 O
-ATOM 1655 N SER L 10 -35.740 -22.765 -75.825 1.00 78.08 N
-ANISOU 1655 N SER L 10 13558 9490 6619 1171 -669 -1280 N
-ATOM 1656 CA SER L 10 -34.799 -23.222 -74.813 1.00 85.54 C
-ANISOU 1656 CA SER L 10 14757 10421 7322 1075 -754 -1170 C
-ATOM 1657 C SER L 10 -35.061 -24.695 -74.544 1.00 96.99 C
-ANISOU 1657 C SER L 10 16187 11868 8797 841 -769 -876 C
-ATOM 1658 O SER L 10 -36.216 -25.127 -74.496 1.00101.72 O
-ANISOU 1658 O SER L 10 16597 12608 9443 733 -607 -768 O
-ATOM 1659 CB SER L 10 -34.927 -22.421 -73.513 1.00 84.02 C
-ANISOU 1659 CB SER L 10 14698 10454 6771 1125 -565 -1275 C
-ATOM 1660 OG SER L 10 -36.135 -22.737 -72.845 1.00 84.43 O
-ANISOU 1660 OG SER L 10 14613 10768 6698 1049 -290 -1169 O
-ATOM 1661 N VAL L 11 -33.984 -25.458 -74.367 1.00 95.99 N
-ANISOU 1661 N VAL L 11 16239 11574 8657 763 -966 -720 N
-ATOM 1662 CA VAL L 11 -34.090 -26.889 -74.119 1.00 97.19 C
-ANISOU 1662 CA VAL L 11 16406 11654 8868 551 -1005 -422 C
-ATOM 1663 C VAL L 11 -32.891 -27.322 -73.284 1.00 86.98 C
-ANISOU 1663 C VAL L 11 15334 10310 7403 509 -1146 -239 C
-ATOM 1664 O VAL L 11 -31.813 -26.725 -73.355 1.00 80.92 O
-ANISOU 1664 O VAL L 11 14689 9470 6587 637 -1293 -336 O
-ATOM 1665 CB VAL L 11 -34.197 -27.677 -75.448 1.00 96.61 C
-ANISOU 1665 CB VAL L 11 16251 11301 9156 509 -1138 -405 C
-ATOM 1666 CG1 VAL L 11 -32.827 -27.894 -76.073 1.00 79.86 C
-ANISOU 1666 CG1 VAL L 11 14287 8894 7163 623 -1368 -421 C
-ATOM 1667 CG2 VAL L 11 -34.929 -28.994 -75.236 1.00108.68 C
-ANISOU 1667 CG2 VAL L 11 17727 12791 10776 253 -1100 -140 C
-ATOM 1668 N SER L 12 -33.092 -28.356 -72.470 1.00 88.23 N
-ANISOU 1668 N SER L 12 15524 10525 7474 314 -1108 63 N
-ATOM 1669 CA SER L 12 -32.071 -28.839 -71.551 1.00 95.23 C
-ANISOU 1669 CA SER L 12 16591 11414 8179 250 -1231 308 C
-ATOM 1670 C SER L 12 -31.772 -30.306 -71.825 1.00 99.18 C
-ANISOU 1670 C SER L 12 17118 11629 8936 131 -1355 616 C
-ATOM 1671 O SER L 12 -32.686 -31.114 -72.019 1.00101.27 O
-ANISOU 1671 O SER L 12 17284 11834 9360 -24 -1274 739 O
-ATOM 1672 CB SER L 12 -32.504 -28.657 -70.093 1.00100.72 C
-ANISOU 1672 CB SER L 12 17326 12481 8461 130 -1063 425 C
-ATOM 1673 OG SER L 12 -33.644 -29.444 -69.800 1.00106.41 O
-ANISOU 1673 OG SER L 12 17908 13314 9209 -49 -890 630 O
-ATOM 1674 N ALA L 13 -30.485 -30.642 -71.832 1.00 86.01 N
-ANISOU 1674 N ALA L 13 15581 9777 7322 202 -1553 753 N
-ATOM 1675 CA ALA L 13 -30.040 -31.992 -72.135 1.00 86.91 C
-ANISOU 1675 CA ALA L 13 15749 9562 7711 150 -1668 1033 C
-ATOM 1676 C ALA L 13 -28.847 -32.338 -71.262 1.00 88.35 C
-ANISOU 1676 C ALA L 13 16051 9763 7757 155 -1809 1346 C
-ATOM 1677 O ALA L 13 -28.151 -31.461 -70.746 1.00 97.40 O
-ANISOU 1677 O ALA L 13 17244 11119 8645 225 -1878 1288 O
-ATOM 1678 CB ALA L 13 -29.662 -32.148 -73.613 1.00 89.69 C
-ANISOU 1678 CB ALA L 13 16103 9557 8420 315 -1768 844 C
-ATOM 1679 N SER L 14 -28.617 -33.635 -71.108 1.00 90.50 N
-ANISOU 1679 N SER L 14 16369 9802 8216 69 -1865 1695 N
-ATOM 1680 CA SER L 14 -27.464 -34.134 -70.380 1.00 92.24 C
-ANISOU 1680 CA SER L 14 16671 9999 8376 87 -2013 2063 C
-ATOM 1681 C SER L 14 -26.286 -34.332 -71.331 1.00 90.43 C
-ANISOU 1681 C SER L 14 16480 9432 8448 334 -2166 2050 C
-ATOM 1682 O SER L 14 -26.420 -34.266 -72.555 1.00102.46 O
-ANISOU 1682 O SER L 14 17990 10710 10230 469 -2148 1773 O
-ATOM 1683 CB SER L 14 -27.809 -35.441 -69.667 1.00103.84 C
-ANISOU 1683 CB SER L 14 18159 11384 9912 -117 -1985 2498 C
-ATOM 1684 OG SER L 14 -28.928 -35.269 -68.814 1.00111.90 O
-ANISOU 1684 OG SER L 14 19118 12752 10648 -340 -1820 2533 O
-ATOM 1685 N VAL L 15 -25.112 -34.569 -70.750 1.00100.58 N
-ANISOU 1685 N VAL L 15 17798 10736 9681 395 -2314 2375 N
-ATOM 1686 CA VAL L 15 -23.918 -34.805 -71.552 1.00106.54 C
-ANISOU 1686 CA VAL L 15 18559 11206 10718 652 -2439 2434 C
-ATOM 1687 C VAL L 15 -24.010 -36.182 -72.192 1.00115.13 C
-ANISOU 1687 C VAL L 15 19709 11820 12217 708 -2398 2585 C
-ATOM 1688 O VAL L 15 -24.212 -37.193 -71.506 1.00123.35 O
-ANISOU 1688 O VAL L 15 20790 12762 13314 564 -2386 2941 O
-ATOM 1689 CB VAL L 15 -22.653 -34.668 -70.692 1.00105.20 C
-ANISOU 1689 CB VAL L 15 18369 11226 10377 688 -2619 2791 C
-ATOM 1690 CG1 VAL L 15 -21.410 -34.929 -71.528 1.00105.17 C
-ANISOU 1690 CG1 VAL L 15 18327 10950 10683 980 -2725 2897 C
-ATOM 1691 CG2 VAL L 15 -22.591 -33.287 -70.053 1.00 99.21 C
-ANISOU 1691 CG2 VAL L 15 17597 10906 9193 596 -2677 2599 C
-ATOM 1692 N GLY L 16 -23.868 -36.229 -73.514 1.00120.12 N
-ANISOU 1692 N GLY L 16 20362 12147 13130 912 -2375 2311 N
-ATOM 1693 CA GLY L 16 -23.976 -37.465 -74.256 1.00115.65 C
-ANISOU 1693 CA GLY L 16 19905 11092 12945 976 -2329 2360 C
-ATOM 1694 C GLY L 16 -25.282 -37.655 -74.992 1.00110.93 C
-ANISOU 1694 C GLY L 16 19350 10348 12452 821 -2223 2035 C
-ATOM 1695 O GLY L 16 -25.490 -38.724 -75.579 1.00126.52 O
-ANISOU 1695 O GLY L 16 21450 11892 14729 818 -2197 2050 O
-ATOM 1696 N ASP L 17 -26.166 -36.664 -74.976 1.00 98.91 N
-ANISOU 1696 N ASP L 17 17727 9157 10698 691 -2167 1752 N
-ATOM 1697 CA ASP L 17 -27.435 -36.731 -75.681 1.00 94.28 C
-ANISOU 1697 CA ASP L 17 17127 8498 10195 534 -2082 1467 C
-ATOM 1698 C ASP L 17 -27.331 -36.069 -77.048 1.00 85.63 C
-ANISOU 1698 C ASP L 17 16015 7333 9189 729 -2089 1058 C
-ATOM 1699 O ASP L 17 -26.388 -35.326 -77.340 1.00 83.50 O
-ANISOU 1699 O ASP L 17 15709 7154 8862 967 -2142 975 O
-ATOM 1700 CB ASP L 17 -28.550 -36.060 -74.874 1.00 88.76 C
-ANISOU 1700 CB ASP L 17 16296 8220 9209 297 -1988 1433 C
-ATOM 1701 CG ASP L 17 -28.818 -36.753 -73.562 1.00113.27 C
-ANISOU 1701 CG ASP L 17 19407 11432 12199 72 -1959 1841 C
-ATOM 1702 OD1 ASP L 17 -28.392 -37.918 -73.402 1.00116.65 O
-ANISOU 1702 OD1 ASP L 17 19943 11537 12842 49 -2015 2149 O
-ATOM 1703 OD2 ASP L 17 -29.471 -36.135 -72.696 1.00116.67 O
-ANISOU 1703 OD2 ASP L 17 19736 12268 12324 -72 -1868 1860 O
-ATOM 1704 N ARG L 18 -28.324 -36.349 -77.885 1.00 85.72 N
-ANISOU 1704 N ARG L 18 16037 7200 9332 602 -2049 826 N
-ATOM 1705 CA ARG L 18 -28.479 -35.681 -79.167 1.00 83.11 C
-ANISOU 1705 CA ARG L 18 15666 6871 9042 728 -2053 440 C
-ATOM 1706 C ARG L 18 -29.462 -34.534 -79.000 1.00 81.34 C
-ANISOU 1706 C ARG L 18 15244 7057 8605 611 -1991 259 C
-ATOM 1707 O ARG L 18 -30.540 -34.717 -78.426 1.00 89.83 O
-ANISOU 1707 O ARG L 18 16243 8269 9619 356 -1922 341 O
-ATOM 1708 CB ARG L 18 -28.976 -36.654 -80.237 1.00 84.93 C
-ANISOU 1708 CB ARG L 18 16035 6713 9523 645 -2068 285 C
-ATOM 1709 CG ARG L 18 -29.508 -35.978 -81.496 1.00102.32 C
-ANISOU 1709 CG ARG L 18 18165 8997 11715 674 -2075 -101 C
-ATOM 1710 CD ARG L 18 -29.825 -36.990 -82.585 1.00110.41 C
-ANISOU 1710 CD ARG L 18 19378 9617 12954 595 -2116 -271 C
-ATOM 1711 NE ARG L 18 -28.710 -37.904 -82.805 1.00122.56 N
-ANISOU 1711 NE ARG L 18 21154 10740 14671 814 -2125 -184 N
-ATOM 1712 CZ ARG L 18 -28.555 -38.650 -83.893 1.00135.55 C
-ANISOU 1712 CZ ARG L 18 23020 12001 16481 883 -2141 -391 C
-ATOM 1713 NH1 ARG L 18 -29.441 -38.583 -84.877 1.00143.84 N
-ANISOU 1713 NH1 ARG L 18 24085 13051 17517 713 -2183 -697 N
-ATOM 1714 NH2 ARG L 18 -27.508 -39.457 -83.998 1.00138.21 N
-ANISOU 1714 NH2 ARG L 18 23566 11961 16989 1128 -2113 -290 N
-ATOM 1715 N VAL L 19 -29.090 -33.356 -79.491 1.00 78.39 N
-ANISOU 1715 N VAL L 19 14777 6875 8133 805 -2004 39 N
-ATOM 1716 CA VAL L 19 -29.962 -32.188 -79.460 1.00 79.75 C
-ANISOU 1716 CA VAL L 19 14767 7393 8143 752 -1935 -153 C
-ATOM 1717 C VAL L 19 -30.077 -31.628 -80.873 1.00 80.57 C
-ANISOU 1717 C VAL L 19 14804 7464 8344 879 -1968 -457 C
-ATOM 1718 O VAL L 19 -29.081 -31.536 -81.600 1.00 73.33 O
-ANISOU 1718 O VAL L 19 13952 6409 7501 1100 -2040 -527 O
-ATOM 1719 CB VAL L 19 -29.449 -31.117 -78.471 1.00 87.27 C
-ANISOU 1719 CB VAL L 19 15669 8648 8841 840 -1920 -103 C
-ATOM 1720 CG1 VAL L 19 -28.010 -30.742 -78.777 1.00 96.31 C
-ANISOU 1720 CG1 VAL L 19 16871 9716 10006 1088 -2037 -96 C
-ATOM 1721 CG2 VAL L 19 -30.341 -29.887 -78.501 1.00 82.56 C
-ANISOU 1721 CG2 VAL L 19 14907 8353 8109 829 -1825 -327 C
-ATOM 1722 N THR L 20 -31.300 -31.276 -81.269 1.00 87.28 N
-ANISOU 1722 N THR L 20 15505 8464 9191 740 -1913 -606 N
-ATOM 1723 CA THR L 20 -31.580 -30.771 -82.607 1.00 80.14 C
-ANISOU 1723 CA THR L 20 14513 7572 8366 818 -1954 -863 C
-ATOM 1724 C THR L 20 -32.370 -29.473 -82.512 1.00 71.74 C
-ANISOU 1724 C THR L 20 13215 6853 7190 830 -1875 -976 C
-ATOM 1725 O THR L 20 -33.379 -29.403 -81.802 1.00 73.16 O
-ANISOU 1725 O THR L 20 13276 7221 7303 663 -1769 -900 O
-ATOM 1726 CB THR L 20 -32.354 -31.800 -83.439 1.00 78.44 C
-ANISOU 1726 CB THR L 20 14350 7148 8307 612 -1999 -925 C
-ATOM 1727 OG1 THR L 20 -33.597 -32.103 -82.794 1.00 89.51 O
-ANISOU 1727 OG1 THR L 20 15634 8680 9694 325 -1932 -803 O
-ATOM 1728 CG2 THR L 20 -31.545 -33.079 -83.589 1.00 79.18 C
-ANISOU 1728 CG2 THR L 20 14712 6835 8536 636 -2060 -843 C
-ATOM 1729 N ILE L 21 -31.906 -28.454 -83.229 1.00 69.39 N
-ANISOU 1729 N ILE L 21 12844 6636 6884 1041 -1915 -1139 N
-ATOM 1730 CA ILE L 21 -32.559 -27.153 -83.300 1.00 73.03 C
-ANISOU 1730 CA ILE L 21 13092 7371 7286 1100 -1846 -1256 C
-ATOM 1731 C ILE L 21 -33.055 -26.956 -84.724 1.00 74.43 C
-ANISOU 1731 C ILE L 21 13140 7562 7578 1111 -1909 -1411 C
-ATOM 1732 O ILE L 21 -32.273 -27.053 -85.678 1.00 78.84 O
-ANISOU 1732 O ILE L 21 13777 7986 8193 1239 -2012 -1492 O
-ATOM 1733 CB ILE L 21 -31.602 -26.022 -82.888 1.00 72.07 C
-ANISOU 1733 CB ILE L 21 12989 7332 7063 1317 -1859 -1287 C
-ATOM 1734 CG1 ILE L 21 -31.028 -26.296 -81.497 1.00 67.55 C
-ANISOU 1734 CG1 ILE L 21 12565 6759 6340 1278 -1834 -1122 C
-ATOM 1735 CG2 ILE L 21 -32.316 -24.676 -82.923 1.00 74.79 C
-ANISOU 1735 CG2 ILE L 21 13138 7905 7373 1391 -1773 -1414 C
-ATOM 1736 CD1 ILE L 21 -29.979 -25.297 -81.064 1.00 66.29 C
-ANISOU 1736 CD1 ILE L 21 12458 6659 6071 1440 -1893 -1139 C
-ATOM 1737 N THR L 22 -34.348 -26.689 -84.871 1.00 81.57 N
-ANISOU 1737 N THR L 22 13833 8655 8506 978 -1844 -1431 N
-ATOM 1738 CA THR L 22 -34.961 -26.514 -86.180 1.00 85.29 C
-ANISOU 1738 CA THR L 22 14150 9189 9067 943 -1920 -1541 C
-ATOM 1739 C THR L 22 -35.108 -25.033 -86.495 1.00 87.09 C
-ANISOU 1739 C THR L 22 14162 9636 9293 1140 -1881 -1616 C
-ATOM 1740 O THR L 22 -35.432 -24.228 -85.619 1.00 94.85 O
-ANISOU 1740 O THR L 22 15044 10770 10223 1210 -1746 -1584 O
-ATOM 1741 CB THR L 22 -36.331 -27.192 -86.251 1.00 76.59 C
-ANISOU 1741 CB THR L 22 12911 8168 8020 646 -1904 -1470 C
-ATOM 1742 OG1 THR L 22 -37.216 -26.592 -85.297 1.00 89.65 O
-ANISOU 1742 OG1 THR L 22 14357 10076 9630 619 -1734 -1365 O
-ATOM 1743 CG2 THR L 22 -36.206 -28.675 -85.952 1.00 72.99 C
-ANISOU 1743 CG2 THR L 22 12685 7448 7598 430 -1955 -1386 C
-ATOM 1744 N CYS L 23 -34.866 -24.681 -87.753 1.00 82.58 N
-ANISOU 1744 N CYS L 23 13531 9072 8774 1233 -1993 -1714 N
-ATOM 1745 CA CYS L 23 -35.025 -23.317 -88.232 1.00 85.77 C
-ANISOU 1745 CA CYS L 23 13714 9660 9213 1410 -1980 -1755 C
-ATOM 1746 C CYS L 23 -35.965 -23.322 -89.426 1.00 89.10 C
-ANISOU 1746 C CYS L 23 13921 10231 9701 1298 -2059 -1773 C
-ATOM 1747 O CYS L 23 -35.814 -24.143 -90.338 1.00 99.99 O
-ANISOU 1747 O CYS L 23 15404 11520 11069 1189 -2189 -1832 O
-ATOM 1748 CB CYS L 23 -33.677 -22.699 -88.613 1.00108.73 C
-ANISOU 1748 CB CYS L 23 16726 12478 12110 1649 -2058 -1805 C
-ATOM 1749 SG CYS L 23 -33.700 -20.896 -88.718 1.00133.45 S
-ANISOU 1749 SG CYS L 23 19639 15767 15299 1876 -2021 -1818 S
-ATOM 1750 N ARG L 24 -36.932 -22.410 -89.411 1.00 81.94 N
-ANISOU 1750 N ARG L 24 12722 9554 8857 1329 -1979 -1718 N
-ATOM 1751 CA ARG L 24 -37.946 -22.290 -90.450 1.00 80.70 C
-ANISOU 1751 CA ARG L 24 12295 9600 8768 1215 -2057 -1679 C
-ATOM 1752 C ARG L 24 -37.804 -20.930 -91.116 1.00 87.71 C
-ANISOU 1752 C ARG L 24 12982 10620 9725 1454 -2072 -1674 C
-ATOM 1753 O ARG L 24 -37.831 -19.896 -90.435 1.00101.92 O
-ANISOU 1753 O ARG L 24 14692 12455 11579 1648 -1935 -1648 O
-ATOM 1754 CB ARG L 24 -39.349 -22.450 -89.861 1.00 97.47 C
-ANISOU 1754 CB ARG L 24 14181 11911 10943 1036 -1940 -1545 C
-ATOM 1755 CG ARG L 24 -40.478 -22.072 -90.803 1.00118.61 C
-ANISOU 1755 CG ARG L 24 16496 14860 13711 944 -2007 -1444 C
-ATOM 1756 CD ARG L 24 -40.873 -23.235 -91.692 1.00142.08 C
-ANISOU 1756 CD ARG L 24 19510 17827 16647 611 -2212 -1453 C
-ATOM 1757 NE ARG L 24 -41.448 -24.331 -90.919 1.00157.23 N
-ANISOU 1757 NE ARG L 24 21497 19684 18561 330 -2172 -1378 N
-ATOM 1758 CZ ARG L 24 -41.919 -25.455 -91.451 1.00168.61 C
-ANISOU 1758 CZ ARG L 24 22997 21078 19989 -19 -2340 -1373 C
-ATOM 1759 NH1 ARG L 24 -41.883 -25.634 -92.765 1.00169.17 N
-ANISOU 1759 NH1 ARG L 24 23087 21173 20016 -125 -2556 -1468 N
-ATOM 1760 NH2 ARG L 24 -42.425 -26.400 -90.671 1.00175.02 N
-ANISOU 1760 NH2 ARG L 24 23862 21818 20821 -276 -2299 -1270 N
-ATOM 1761 N ALA L 25 -37.652 -20.933 -92.439 1.00 79.09 N
-ANISOU 1761 N ALA L 25 11835 9592 8624 1438 -2239 -1698 N
-ATOM 1762 CA ALA L 25 -37.464 -19.715 -93.214 1.00 70.74 C
-ANISOU 1762 CA ALA L 25 10582 8663 7635 1646 -2282 -1656 C
-ATOM 1763 C ALA L 25 -38.794 -19.239 -93.780 1.00 76.42 C
-ANISOU 1763 C ALA L 25 10918 9667 8452 1569 -2297 -1514 C
-ATOM 1764 O ALA L 25 -39.617 -20.046 -94.223 1.00 83.71 O
-ANISOU 1764 O ALA L 25 11757 10710 9339 1303 -2385 -1479 O
-ATOM 1765 CB ALA L 25 -36.464 -19.935 -94.350 1.00 63.89 C
-ANISOU 1765 CB ALA L 25 9857 7745 6673 1694 -2445 -1731 C
-ATOM 1766 N SER L 26 -38.999 -17.920 -93.756 1.00 76.12 N
-ANISOU 1766 N SER L 26 10645 9725 8553 1796 -2217 -1418 N
-ATOM 1767 CA SER L 26 -40.223 -17.344 -94.302 1.00 75.35 C
-ANISOU 1767 CA SER L 26 10139 9908 8583 1775 -2220 -1235 C
-ATOM 1768 C SER L 26 -40.345 -17.643 -95.792 1.00 89.67 C
-ANISOU 1768 C SER L 26 11842 11907 10322 1621 -2459 -1186 C
-ATOM 1769 O SER L 26 -41.406 -18.059 -96.272 1.00 83.71 O
-ANISOU 1769 O SER L 26 10859 11381 9566 1391 -2544 -1072 O
-ATOM 1770 CB SER L 26 -40.243 -15.836 -94.044 1.00 70.81 C
-ANISOU 1770 CB SER L 26 9378 9333 8192 2092 -2089 -1149 C
-ATOM 1771 OG SER L 26 -41.315 -15.204 -94.719 1.00 91.02 O
-ANISOU 1771 OG SER L 26 11519 12161 10903 2115 -2105 -934 O
-ATOM 1772 N GLN L 27 -39.262 -17.443 -96.533 1.00 87.26 N
-ANISOU 1772 N GLN L 27 11692 11529 9935 1731 -2574 -1259 N
-ATOM 1773 CA GLN L 27 -39.192 -17.713 -97.958 1.00 82.23 C
-ANISOU 1773 CA GLN L 27 11005 11071 9166 1612 -2789 -1243 C
-ATOM 1774 C GLN L 27 -38.092 -18.734 -98.215 1.00 81.50 C
-ANISOU 1774 C GLN L 27 11317 10781 8868 1550 -2862 -1459 C
-ATOM 1775 O GLN L 27 -37.248 -19.000 -97.355 1.00 84.27 O
-ANISOU 1775 O GLN L 27 11939 10866 9215 1653 -2758 -1573 O
-ATOM 1776 CB GLN L 27 -38.924 -16.426 -98.749 1.00 86.28 C
-ANISOU 1776 CB GLN L 27 11282 11728 9771 1839 -2840 -1083 C
-ATOM 1777 CG GLN L 27 -39.743 -15.235 -98.283 1.00106.33 C
-ANISOU 1777 CG GLN L 27 13475 14352 12573 2011 -2711 -880 C
-ATOM 1778 CD GLN L 27 -39.295 -13.932 -98.915 1.00129.46 C
-ANISOU 1778 CD GLN L 27 16228 17329 15633 2263 -2749 -721 C
-ATOM 1779 OE1 GLN L 27 -38.710 -13.921 -99.999 1.00128.12 O
-ANISOU 1779 OE1 GLN L 27 16071 17272 15338 2249 -2912 -689 O
-ATOM 1780 NE2 GLN L 27 -39.561 -12.822 -98.232 1.00141.28 N
-ANISOU 1780 NE2 GLN L 27 17570 18731 17381 2498 -2590 -620 N
-ATOM 1781 N GLY L 28 -38.107 -19.310 -99.414 1.00 77.48 N
-ANISOU 1781 N GLY L 28 10848 10412 8178 1387 -3039 -1511 N
-ATOM 1782 CA GLY L 28 -37.069 -20.243 -99.802 1.00 79.14 C
-ANISOU 1782 CA GLY L 28 11438 10441 8190 1372 -3087 -1723 C
-ATOM 1783 C GLY L 28 -35.727 -19.543 -99.881 1.00 82.37 C
-ANISOU 1783 C GLY L 28 11933 10759 8605 1690 -3031 -1715 C
-ATOM 1784 O GLY L 28 -35.552 -18.612-100.685 1.00 94.54 O
-ANISOU 1784 O GLY L 28 13265 12504 10151 1823 -3092 -1580 O
-ATOM 1785 N ILE L 29 -34.775 -19.960 -99.048 1.00 68.39 N
-ANISOU 1785 N ILE L 29 10445 8698 6843 1803 -2926 -1820 N
-ATOM 1786 CA ILE L 29 -33.436 -19.387 -99.043 1.00 65.85 C
-ANISOU 1786 CA ILE L 29 10204 8286 6532 2077 -2885 -1788 C
-ATOM 1787 C ILE L 29 -32.416 -20.337 -99.651 1.00 79.40 C
-ANISOU 1787 C ILE L 29 12214 9899 8056 2118 -2905 -1933 C
-ATOM 1788 O ILE L 29 -31.212 -20.057 -99.609 1.00 81.22 O
-ANISOU 1788 O ILE L 29 12525 10050 8287 2340 -2862 -1893 O
-ATOM 1789 CB ILE L 29 -33.014 -18.965 -97.627 1.00 75.04 C
-ANISOU 1789 CB ILE L 29 11428 9231 7852 2203 -2758 -1754 C
-ATOM 1790 CG1 ILE L 29 -33.248 -20.100 -96.626 1.00 76.88 C
-ANISOU 1790 CG1 ILE L 29 11895 9251 8063 2048 -2684 -1871 C
-ATOM 1791 CG2 ILE L 29 -33.790 -17.740 -97.200 1.00 75.92 C
-ANISOU 1791 CG2 ILE L 29 11250 9446 8151 2260 -2713 -1613 C
-ATOM 1792 N SER L 30 -32.872 -21.454-100.227 1.00 79.44 N
-ANISOU 1792 N SER L 30 12384 9900 7901 1910 -2968 -2095 N
-ATOM 1793 CA SER L 30 -32.007 -22.493-100.794 1.00 72.75 C
-ANISOU 1793 CA SER L 30 11865 8911 6868 1955 -2958 -2278 C
-ATOM 1794 C SER L 30 -31.131 -23.037 -99.673 1.00 74.59 C
-ANISOU 1794 C SER L 30 12338 8807 7197 2079 -2832 -2307 C
-ATOM 1795 O SER L 30 -31.681 -23.556 -98.685 1.00 81.71 O
-ANISOU 1795 O SER L 30 13316 9531 8197 1924 -2798 -2329 O
-ATOM 1796 CB SER L 30 -31.259 -21.925-101.999 1.00 77.76 C
-ANISOU 1796 CB SER L 30 12418 9774 7351 2146 -2993 -2230 C
-ATOM 1797 OG SER L 30 -30.204 -22.788-102.391 1.00 86.45 O
-ANISOU 1797 OG SER L 30 13826 10724 8296 2286 -2922 -2381 O
-ATOM 1798 N ASN L 31 -29.805 -22.956 -99.767 1.00 63.43 N
-ANISOU 1798 N ASN L 31 11025 7318 5756 2345 -2764 -2275 N
-ATOM 1799 CA ASN L 31 -28.910 -23.404 -98.710 1.00 62.43 C
-ANISOU 1799 CA ASN L 31 11087 6909 5727 2472 -2662 -2248 C
-ATOM 1800 C ASN L 31 -28.085 -22.246 -98.161 1.00 74.58 C
-ANISOU 1800 C ASN L 31 12446 8505 7388 2681 -2639 -2038 C
-ATOM 1801 O ASN L 31 -26.982 -22.443 -97.647 1.00 82.63 O
-ANISOU 1801 O ASN L 31 13577 9374 8444 2847 -2580 -1967 O
-ATOM 1802 CB ASN L 31 -28.002 -24.529 -99.205 1.00 71.58 C
-ANISOU 1802 CB ASN L 31 12549 7884 6765 2597 -2597 -2382 C
-ATOM 1803 CG ASN L 31 -26.951 -24.045-100.183 1.00 82.27 C
-ANISOU 1803 CG ASN L 31 13833 9418 8008 2867 -2569 -2317 C
-ATOM 1804 OD1 ASN L 31 -27.133 -23.038-100.868 1.00 91.02 O
-ANISOU 1804 OD1 ASN L 31 14688 10821 9075 2891 -2636 -2218 O
-ATOM 1805 ND2 ASN L 31 -25.832 -24.754-100.237 1.00 76.63 N
-ANISOU 1805 ND2 ASN L 31 13324 8534 7259 3085 -2459 -2339 N
-ATOM 1806 N TRP L 32 -28.611 -21.026 -98.268 1.00 62.29 N
-ANISOU 1806 N TRP L 32 10606 7154 5906 2667 -2694 -1922 N
-ATOM 1807 CA TRP L 32 -27.938 -19.843 -97.736 1.00 62.71 C
-ANISOU 1807 CA TRP L 32 10503 7229 6094 2825 -2695 -1736 C
-ATOM 1808 C TRP L 32 -28.350 -19.665 -96.280 1.00 67.51 C
-ANISOU 1808 C TRP L 32 11142 7679 6829 2737 -2650 -1728 C
-ATOM 1809 O TRP L 32 -29.172 -18.816 -95.926 1.00 74.06 O
-ANISOU 1809 O TRP L 32 11798 8582 7761 2681 -2652 -1690 O
-ATOM 1810 CB TRP L 32 -28.268 -18.618 -98.574 1.00 63.42 C
-ANISOU 1810 CB TRP L 32 10298 7577 6222 2868 -2770 -1610 C
-ATOM 1811 CG TRP L 32 -27.599 -18.668 -99.884 1.00 65.05 C
-ANISOU 1811 CG TRP L 32 10472 7964 6281 2989 -2803 -1571 C
-ATOM 1812 CD1 TRP L 32 -28.130 -19.109-101.058 1.00 62.64 C
-ANISOU 1812 CD1 TRP L 32 10157 7849 5792 2909 -2845 -1665 C
-ATOM 1813 CD2 TRP L 32 -26.246 -18.306-100.161 1.00 57.53 C
-ANISOU 1813 CD2 TRP L 32 9493 7044 5322 3205 -2791 -1420 C
-ATOM 1814 NE1 TRP L 32 -27.193 -19.024-102.058 1.00 67.85 N
-ANISOU 1814 NE1 TRP L 32 10800 8667 6312 3081 -2840 -1597 N
-ATOM 1815 CE2 TRP L 32 -26.026 -18.535-101.531 1.00 65.87 C
-ANISOU 1815 CE2 TRP L 32 10521 8327 6181 3272 -2800 -1430 C
-ATOM 1816 CE3 TRP L 32 -25.200 -17.801 -99.385 1.00 69.57 C
-ANISOU 1816 CE3 TRP L 32 11006 8449 6978 3331 -2783 -1262 C
-ATOM 1817 CZ2 TRP L 32 -24.805 -18.278-102.142 1.00 69.24 C
-ANISOU 1817 CZ2 TRP L 32 10888 8875 6545 3488 -2772 -1274 C
-ATOM 1818 CZ3 TRP L 32 -23.990 -17.545 -99.991 1.00 82.32 C
-ANISOU 1818 CZ3 TRP L 32 12547 10176 8554 3520 -2783 -1090 C
-ATOM 1819 CH2 TRP L 32 -23.802 -17.781-101.358 1.00 84.55 C
-ANISOU 1819 CH2 TRP L 32 12782 10696 8647 3610 -2763 -1089 C
-ATOM 1820 N LEU L 33 -27.759 -20.494 -95.423 1.00 61.30 N
-ANISOU 1820 N LEU L 33 10581 6679 6030 2741 -2597 -1755 N
-ATOM 1821 CA LEU L 33 -28.079 -20.483 -94.004 1.00 62.49 C
-ANISOU 1821 CA LEU L 33 10798 6698 6248 2647 -2547 -1748 C
-ATOM 1822 C LEU L 33 -26.836 -20.849 -93.206 1.00 73.27 C
-ANISOU 1822 C LEU L 33 12333 7895 7611 2746 -2535 -1663 C
-ATOM 1823 O LEU L 33 -26.079 -21.743 -93.595 1.00 75.78 O
-ANISOU 1823 O LEU L 33 12791 8123 7878 2830 -2521 -1661 O
-ATOM 1824 CB LEU L 33 -29.223 -21.452 -93.687 1.00 57.50 C
-ANISOU 1824 CB LEU L 33 10255 6005 5587 2428 -2501 -1865 C
-ATOM 1825 CG LEU L 33 -29.637 -21.538 -92.221 1.00 66.36 C
-ANISOU 1825 CG LEU L 33 11440 7029 6744 2322 -2426 -1844 C
-ATOM 1826 CD1 LEU L 33 -31.139 -21.520 -92.100 1.00 66.00 C
-ANISOU 1826 CD1 LEU L 33 11260 7094 6724 2137 -2384 -1888 C
-ATOM 1827 CD2 LEU L 33 -29.075 -22.791 -91.577 1.00 88.56 C
-ANISOU 1827 CD2 LEU L 33 14513 9622 9515 2280 -2396 -1841 C
-ATOM 1828 N ALA L 34 -26.638 -20.155 -92.088 1.00 72.73 N
-ANISOU 1828 N ALA L 34 12254 7789 7592 2739 -2537 -1589 N
-ATOM 1829 CA ALA L 34 -25.521 -20.409 -91.193 1.00 66.22 C
-ANISOU 1829 CA ALA L 34 11565 6841 6755 2792 -2555 -1474 C
-ATOM 1830 C ALA L 34 -26.037 -20.599 -89.775 1.00 63.42 C
-ANISOU 1830 C ALA L 34 11324 6405 6368 2643 -2504 -1499 C
-ATOM 1831 O ALA L 34 -27.090 -20.070 -89.403 1.00 68.91 O
-ANISOU 1831 O ALA L 34 11950 7162 7071 2547 -2453 -1584 O
-ATOM 1832 CB ALA L 34 -24.499 -19.261 -91.227 1.00 59.13 C
-ANISOU 1832 CB ALA L 34 10550 6006 5911 2916 -2651 -1325 C
-ATOM 1833 N TRP L 35 -25.286 -21.365 -88.988 1.00 65.55 N
-ANISOU 1833 N TRP L 35 11756 6553 6596 2637 -2508 -1402 N
-ATOM 1834 CA TRP L 35 -25.554 -21.560 -87.571 1.00 60.36 C
-ANISOU 1834 CA TRP L 35 11217 5846 5870 2500 -2472 -1380 C
-ATOM 1835 C TRP L 35 -24.424 -20.952 -86.754 1.00 56.47 C
-ANISOU 1835 C TRP L 35 10757 5357 5342 2540 -2570 -1233 C
-ATOM 1836 O TRP L 35 -23.252 -21.045 -87.135 1.00 72.47 O
-ANISOU 1836 O TRP L 35 12763 7366 7407 2665 -2652 -1084 O
-ATOM 1837 CB TRP L 35 -25.704 -23.047 -87.235 1.00 70.67 C
-ANISOU 1837 CB TRP L 35 12688 7010 7153 2416 -2413 -1352 C
-ATOM 1838 CG TRP L 35 -26.981 -23.644 -87.732 1.00 71.52 C
-ANISOU 1838 CG TRP L 35 12785 7108 7279 2288 -2337 -1494 C
-ATOM 1839 CD1 TRP L 35 -27.157 -24.368 -88.872 1.00 64.76 C
-ANISOU 1839 CD1 TRP L 35 11954 6188 6464 2305 -2337 -1578 C
-ATOM 1840 CD2 TRP L 35 -28.264 -23.577 -87.098 1.00 59.31 C
-ANISOU 1840 CD2 TRP L 35 11200 5635 5701 2108 -2255 -1558 C
-ATOM 1841 NE1 TRP L 35 -28.469 -24.751 -88.992 1.00 71.31 N
-ANISOU 1841 NE1 TRP L 35 12758 7041 7296 2114 -2293 -1683 N
-ATOM 1842 CE2 TRP L 35 -29.170 -24.277 -87.915 1.00 60.17 C
-ANISOU 1842 CE2 TRP L 35 11284 5725 5853 1999 -2234 -1652 C
-ATOM 1843 CE3 TRP L 35 -28.733 -22.989 -85.920 1.00 59.66 C
-ANISOU 1843 CE3 TRP L 35 11227 5771 5670 2029 -2190 -1544 C
-ATOM 1844 CZ2 TRP L 35 -30.519 -24.408 -87.594 1.00 61.29 C
-ANISOU 1844 CZ2 TRP L 35 11344 5952 5992 1807 -2161 -1690 C
-ATOM 1845 CZ3 TRP L 35 -30.072 -23.120 -85.601 1.00 66.79 C
-ANISOU 1845 CZ3 TRP L 35 12057 6762 6559 1876 -2081 -1597 C
-ATOM 1846 CH2 TRP L 35 -30.949 -23.824 -86.435 1.00 68.54 C
-ANISOU 1846 CH2 TRP L 35 12214 6976 6851 1763 -2072 -1648 C
-ATOM 1847 N PHE L 36 -24.777 -20.327 -85.635 1.00 61.79 N
-ANISOU 1847 N PHE L 36 11481 6067 5931 2430 -2561 -1270 N
-ATOM 1848 CA PHE L 36 -23.812 -19.666 -84.769 1.00 61.61 C
-ANISOU 1848 CA PHE L 36 11515 6056 5840 2411 -2681 -1159 C
-ATOM 1849 C PHE L 36 -23.906 -20.212 -83.352 1.00 65.28 C
-ANISOU 1849 C PHE L 36 12152 6515 6138 2262 -2652 -1113 C
-ATOM 1850 O PHE L 36 -24.999 -20.508 -82.860 1.00 59.41 O
-ANISOU 1850 O PHE L 36 11456 5793 5323 2162 -2515 -1224 O
-ATOM 1851 CB PHE L 36 -24.033 -18.152 -84.745 1.00 62.18 C
-ANISOU 1851 CB PHE L 36 11517 6172 5935 2416 -2720 -1270 C
-ATOM 1852 CG PHE L 36 -23.470 -17.443 -85.936 1.00 68.88 C
-ANISOU 1852 CG PHE L 36 12196 7041 6936 2550 -2815 -1212 C
-ATOM 1853 CD1 PHE L 36 -22.131 -17.099 -85.980 1.00 78.77 C
-ANISOU 1853 CD1 PHE L 36 13417 8296 8218 2588 -2982 -1019 C
-ATOM 1854 CD2 PHE L 36 -24.281 -17.112 -87.009 1.00 58.08 C
-ANISOU 1854 CD2 PHE L 36 10675 5716 5677 2626 -2746 -1315 C
-ATOM 1855 CE1 PHE L 36 -21.606 -16.444 -87.075 1.00 75.98 C
-ANISOU 1855 CE1 PHE L 36 12884 7986 8001 2706 -3062 -929 C
-ATOM 1856 CE2 PHE L 36 -23.763 -16.457 -88.105 1.00 66.14 C
-ANISOU 1856 CE2 PHE L 36 11529 6783 6820 2744 -2832 -1232 C
-ATOM 1857 CZ PHE L 36 -22.423 -16.121 -88.140 1.00 75.51 C
-ANISOU 1857 CZ PHE L 36 12687 7970 8035 2787 -2983 -1038 C
-ATOM 1858 N GLN L 37 -22.753 -20.343 -82.704 1.00 83.39 N
-ANISOU 1858 N GLN L 37 14514 8806 8364 2239 -2785 -916 N
-ATOM 1859 CA GLN L 37 -22.662 -20.646 -81.281 1.00 79.36 C
-ANISOU 1859 CA GLN L 37 14162 8335 7657 2082 -2803 -836 C
-ATOM 1860 C GLN L 37 -22.246 -19.369 -80.571 1.00 64.52 C
-ANISOU 1860 C GLN L 37 12337 6524 5654 1999 -2930 -884 C
-ATOM 1861 O GLN L 37 -21.224 -18.770 -80.920 1.00 75.30 O
-ANISOU 1861 O GLN L 37 13632 7888 7092 2043 -3103 -771 O
-ATOM 1862 CB GLN L 37 -21.655 -21.768 -81.015 1.00 82.48 C
-ANISOU 1862 CB GLN L 37 14593 8687 8059 2099 -2881 -545 C
-ATOM 1863 CG GLN L 37 -21.369 -22.056 -79.541 1.00 64.12 C
-ANISOU 1863 CG GLN L 37 12410 6437 5515 1927 -2944 -392 C
-ATOM 1864 CD GLN L 37 -20.184 -22.993 -79.342 1.00 74.86 C
-ANISOU 1864 CD GLN L 37 13758 7764 6920 1974 -3056 -40 C
-ATOM 1865 OE1 GLN L 37 -19.827 -23.327 -78.218 1.00 98.74 O
-ANISOU 1865 OE1 GLN L 37 16872 10865 9778 1839 -3132 149 O
-ATOM 1866 NE2 GLN L 37 -19.566 -23.412 -80.436 1.00 74.46 N
-ANISOU 1866 NE2 GLN L 37 13590 7614 7087 2177 -3058 61 N
-ATOM 1867 N HIS L 38 -23.035 -18.947 -79.591 1.00 64.01 N
-ANISOU 1867 N HIS L 38 12403 6517 5401 1876 -2842 -1052 N
-ATOM 1868 CA HIS L 38 -22.777 -17.707 -78.872 1.00 70.68 C
-ANISOU 1868 CA HIS L 38 13360 7391 6103 1787 -2943 -1168 C
-ATOM 1869 C HIS L 38 -22.671 -18.003 -77.385 1.00 76.79 C
-ANISOU 1869 C HIS L 38 14340 8271 6565 1600 -2964 -1120 C
-ATOM 1870 O HIS L 38 -23.610 -18.538 -76.782 1.00 76.17 O
-ANISOU 1870 O HIS L 38 14332 8260 6348 1548 -2775 -1191 O
-ATOM 1871 CB HIS L 38 -23.870 -16.673 -79.139 1.00 64.06 C
-ANISOU 1871 CB HIS L 38 12505 6518 5317 1851 -2790 -1466 C
-ATOM 1872 CG HIS L 38 -23.489 -15.285 -78.737 1.00 65.24 C
-ANISOU 1872 CG HIS L 38 12766 6615 5409 1803 -2912 -1602 C
-ATOM 1873 ND1 HIS L 38 -24.412 -14.274 -78.578 1.00 78.14 N
-ANISOU 1873 ND1 HIS L 38 14459 8196 7036 1850 -2766 -1881 N
-ATOM 1874 CD2 HIS L 38 -22.280 -14.739 -78.469 1.00 66.02 C
-ANISOU 1874 CD2 HIS L 38 12930 6688 5468 1704 -3172 -1489 C
-ATOM 1875 CE1 HIS L 38 -23.786 -13.164 -78.229 1.00 80.75 C
-ANISOU 1875 CE1 HIS L 38 14922 8433 7326 1782 -2930 -1963 C
-ATOM 1876 NE2 HIS L 38 -22.493 -13.420 -78.157 1.00 78.83 N
-ANISOU 1876 NE2 HIS L 38 14680 8214 7057 1671 -3192 -1724 N
-ATOM 1877 N LYS L 39 -21.526 -17.660 -76.805 1.00 85.57 N
-ANISOU 1877 N LYS L 39 15533 9422 7559 1484 -3203 -974 N
-ATOM 1878 CA LYS L 39 -21.228 -17.771 -75.389 1.00 85.69 C
-ANISOU 1878 CA LYS L 39 15751 9570 7238 1275 -3288 -910 C
-ATOM 1879 C LYS L 39 -21.039 -16.383 -74.790 1.00 91.33 C
-ANISOU 1879 C LYS L 39 16646 10279 7776 1150 -3410 -1131 C
-ATOM 1880 O LYS L 39 -20.633 -15.448 -75.488 1.00 95.66 O
-ANISOU 1880 O LYS L 39 17128 10709 8512 1202 -3531 -1196 O
-ATOM 1881 CB LYS L 39 -19.963 -18.605 -75.150 1.00 71.37 C
-ANISOU 1881 CB LYS L 39 13880 7822 5414 1210 -3507 -509 C
-ATOM 1882 CG LYS L 39 -20.167 -20.092 -75.367 1.00 74.08 C
-ANISOU 1882 CG LYS L 39 14134 8150 5865 1298 -3377 -293 C
-ATOM 1883 CD LYS L 39 -18.851 -20.848 -75.316 1.00 73.32 C
-ANISOU 1883 CD LYS L 39 13942 8081 5834 1303 -3577 125 C
-ATOM 1884 CE LYS L 39 -19.081 -22.352 -75.313 1.00 71.79 C
-ANISOU 1884 CE LYS L 39 13718 7834 5726 1372 -3443 338 C
-ATOM 1885 NZ LYS L 39 -17.814 -23.133 -75.412 1.00 86.13 N1+
-ANISOU 1885 NZ LYS L 39 15414 9640 7673 1448 -3599 760 N1+
-ATOM 1886 N PRO L 40 -21.330 -16.214 -73.503 1.00 95.66 N
-ANISOU 1886 N PRO L 40 17439 10947 7960 978 -3380 -1253 N
-ATOM 1887 CA PRO L 40 -21.262 -14.874 -72.910 1.00 99.90 C
-ANISOU 1887 CA PRO L 40 18138 11445 8376 854 -3423 -1508 C
-ATOM 1888 C PRO L 40 -19.846 -14.320 -72.919 1.00 99.15 C
-ANISOU 1888 C PRO L 40 17994 11322 8356 695 -3757 -1314 C
-ATOM 1889 O PRO L 40 -18.871 -15.036 -72.675 1.00 78.83 O
-ANISOU 1889 O PRO L 40 15337 8870 5743 586 -3954 -967 O
-ATOM 1890 CB PRO L 40 -21.772 -15.095 -71.483 1.00 80.88 C
-ANISOU 1890 CB PRO L 40 15925 9229 5577 690 -3272 -1598 C
-ATOM 1891 CG PRO L 40 -21.539 -16.544 -71.220 1.00 80.59 C
-ANISOU 1891 CG PRO L 40 15855 9348 5418 652 -3324 -1264 C
-ATOM 1892 CD PRO L 40 -21.757 -17.229 -72.528 1.00 89.19 C
-ANISOU 1892 CD PRO L 40 16711 10306 6871 881 -3255 -1145 C
-ATOM 1893 N GLY L 41 -19.744 -13.024 -73.213 1.00 95.98 N
-ANISOU 1893 N GLY L 41 17628 10754 8088 683 -3816 -1517 N
-ATOM 1894 CA GLY L 41 -18.488 -12.312 -73.146 1.00102.95 C
-ANISOU 1894 CA GLY L 41 18492 11598 9027 492 -4136 -1368 C
-ATOM 1895 C GLY L 41 -17.658 -12.345 -74.406 1.00100.34 C
-ANISOU 1895 C GLY L 41 17910 11190 9026 605 -4341 -1102 C
-ATOM 1896 O GLY L 41 -16.621 -11.674 -74.462 1.00106.29 O
-ANISOU 1896 O GLY L 41 18607 11908 9868 446 -4609 -954 O
-ATOM 1897 N LYS L 42 -18.075 -13.095 -75.417 1.00102.59 N
-ANISOU 1897 N LYS L 42 18029 11461 9491 867 -4219 -1029 N
-ATOM 1898 CA LYS L 42 -17.321 -13.215 -76.650 1.00100.61 C
-ANISOU 1898 CA LYS L 42 17505 11177 9543 1009 -4360 -762 C
-ATOM 1899 C LYS L 42 -18.263 -13.074 -77.837 1.00 89.72 C
-ANISOU 1899 C LYS L 42 15989 9676 8425 1276 -4122 -939 C
-ATOM 1900 O LYS L 42 -19.489 -13.136 -77.703 1.00 86.00 O
-ANISOU 1900 O LYS L 42 15609 9169 7897 1361 -3858 -1214 O
-ATOM 1901 CB LYS L 42 -16.555 -14.546 -76.699 1.00 92.93 C
-ANISOU 1901 CB LYS L 42 16333 10363 8614 1043 -4384 -358 C
-ATOM 1902 CG LYS L 42 -17.388 -15.756 -76.315 1.00 87.84 C
-ANISOU 1902 CG LYS L 42 15784 9783 7808 1128 -4175 -391 C
-ATOM 1903 CD LYS L 42 -16.563 -17.035 -76.382 1.00 97.04 C
-ANISOU 1903 CD LYS L 42 16762 11048 9059 1177 -4206 22 C
-ATOM 1904 CE LYS L 42 -15.391 -17.000 -75.408 1.00 92.14 C
-ANISOU 1904 CE LYS L 42 16080 10587 8341 918 -4400 305 C
-ATOM 1905 N ALA L 43 -17.668 -12.864 -79.007 1.00 81.92 N
-ANISOU 1905 N ALA L 43 14749 8652 7726 1399 -4211 -752 N
-ATOM 1906 CA ALA L 43 -18.434 -12.716 -80.226 1.00 77.35 C
-ANISOU 1906 CA ALA L 43 14000 7994 7398 1632 -4014 -867 C
-ATOM 1907 C ALA L 43 -19.034 -14.056 -80.643 1.00 78.56 C
-ANISOU 1907 C ALA L 43 14058 8222 7569 1797 -3780 -830 C
-ATOM 1908 O ALA L 43 -18.568 -15.117 -80.217 1.00 82.78 O
-ANISOU 1908 O ALA L 43 14602 8850 8002 1767 -3802 -631 O
-ATOM 1909 CB ALA L 43 -17.549 -12.164 -81.340 1.00 73.78 C
-ANISOU 1909 CB ALA L 43 13300 7523 7209 1704 -4181 -639 C
-ATOM 1910 N PRO L 44 -20.084 -14.031 -81.463 1.00 73.62 N
-ANISOU 1910 N PRO L 44 13344 7549 7080 1960 -3567 -1009 N
-ATOM 1911 CA PRO L 44 -20.626 -15.286 -81.998 1.00 60.67 C
-ANISOU 1911 CA PRO L 44 11615 5958 5478 2088 -3378 -975 C
-ATOM 1912 C PRO L 44 -19.587 -16.040 -82.815 1.00 65.56 C
-ANISOU 1912 C PRO L 44 12062 6626 6223 2201 -3462 -680 C
-ATOM 1913 O PRO L 44 -18.782 -15.449 -83.538 1.00 71.26 O
-ANISOU 1913 O PRO L 44 12629 7360 7086 2260 -3598 -532 O
-ATOM 1914 CB PRO L 44 -21.802 -14.825 -82.865 1.00 59.47 C
-ANISOU 1914 CB PRO L 44 11362 5764 5471 2215 -3201 -1191 C
-ATOM 1915 CG PRO L 44 -22.195 -13.508 -82.295 1.00 60.79 C
-ANISOU 1915 CG PRO L 44 11645 5847 5607 2147 -3217 -1397 C
-ATOM 1916 CD PRO L 44 -20.929 -12.873 -81.801 1.00 62.08 C
-ANISOU 1916 CD PRO L 44 11885 5978 5725 2012 -3484 -1260 C
-ATOM 1917 N LYS L 45 -19.611 -17.361 -82.689 1.00 68.19 N
-ANISOU 1917 N LYS L 45 12422 6978 6509 2238 -3368 -584 N
-ATOM 1918 CA LYS L 45 -18.677 -18.245 -83.373 1.00 70.42 C
-ANISOU 1918 CA LYS L 45 12575 7280 6900 2382 -3398 -320 C
-ATOM 1919 C LYS L 45 -19.410 -18.932 -84.517 1.00 69.87 C
-ANISOU 1919 C LYS L 45 12437 7166 6944 2549 -3206 -439 C
-ATOM 1920 O LYS L 45 -20.412 -19.621 -84.293 1.00 75.46 O
-ANISOU 1920 O LYS L 45 13249 7824 7598 2508 -3055 -594 O
-ATOM 1921 CB LYS L 45 -18.097 -19.272 -82.400 1.00 65.35 C
-ANISOU 1921 CB LYS L 45 12032 6655 6144 2314 -3440 -102 C
-ATOM 1922 CG LYS L 45 -17.108 -20.257 -83.003 1.00 72.01 C
-ANISOU 1922 CG LYS L 45 12752 7494 7115 2499 -3442 190 C
-ATOM 1923 CD LYS L 45 -16.631 -21.235 -81.933 1.00 87.00 C
-ANISOU 1923 CD LYS L 45 14745 9397 8915 2426 -3483 427 C
-ATOM 1924 CE LYS L 45 -15.652 -22.267 -82.476 1.00 89.24 C
-ANISOU 1924 CE LYS L 45 14824 9679 9404 2576 -3361 692 C
-ATOM 1925 NZ LYS L 45 -15.251 -23.248 -81.425 1.00 82.69 N1+
-ANISOU 1925 NZ LYS L 45 14065 8842 8510 2512 -3391 950 N1+
-ATOM 1926 N LEU L 46 -18.923 -18.732 -85.739 1.00 64.88 N
-ANISOU 1926 N LEU L 46 11631 6568 6454 2716 -3221 -361 N
-ATOM 1927 CA LEU L 46 -19.511 -19.402 -86.890 1.00 67.70 C
-ANISOU 1927 CA LEU L 46 11941 6901 6882 2863 -3062 -475 C
-ATOM 1928 C LEU L 46 -19.144 -20.881 -86.857 1.00 68.40 C
-ANISOU 1928 C LEU L 46 12115 6907 6966 2951 -2978 -365 C
-ATOM 1929 O LEU L 46 -17.961 -21.237 -86.801 1.00 68.85 O
-ANISOU 1929 O LEU L 46 12117 6982 7062 3052 -3038 -104 O
-ATOM 1930 CB LEU L 46 -19.032 -18.753 -88.186 1.00 76.16 C
-ANISOU 1930 CB LEU L 46 12807 8065 8065 3018 -3098 -407 C
-ATOM 1931 CG LEU L 46 -19.545 -19.350 -89.503 1.00 65.79 C
-ANISOU 1931 CG LEU L 46 11446 6767 6783 3165 -2955 -527 C
-ATOM 1932 CD1 LEU L 46 -21.065 -19.285 -89.600 1.00 61.46 C
-ANISOU 1932 CD1 LEU L 46 10953 6192 6207 3057 -2860 -807 C
-ATOM 1933 CD2 LEU L 46 -18.895 -18.672 -90.698 1.00 55.09 C
-ANISOU 1933 CD2 LEU L 46 9816 5586 5529 3218 -2909 -431 C
-ATOM 1934 N LEU L 47 -20.160 -21.741 -86.871 1.00 68.33 N
-ANISOU 1934 N LEU L 47 12232 6801 6930 2906 -2838 -543 N
-ATOM 1935 CA LEU L 47 -19.968 -23.185 -86.851 1.00 78.73 C
-ANISOU 1935 CA LEU L 47 13668 7976 8269 2975 -2749 -470 C
-ATOM 1936 C LEU L 47 -20.214 -23.828 -88.206 1.00 79.39 C
-ANISOU 1936 C LEU L 47 13753 7994 8419 3129 -2633 -601 C
-ATOM 1937 O LEU L 47 -19.367 -24.578 -88.704 1.00 70.21 O
-ANISOU 1937 O LEU L 47 12604 6757 7314 3326 -2586 -476 O
-ATOM 1938 CB LEU L 47 -20.892 -23.821 -85.804 1.00 78.87 C
-ANISOU 1938 CB LEU L 47 13854 7906 8208 2776 -2690 -548 C
-ATOM 1939 CG LEU L 47 -20.593 -23.571 -84.328 1.00 70.21 C
-ANISOU 1939 CG LEU L 47 12818 6864 6993 2622 -2782 -400 C
-ATOM 1940 CD1 LEU L 47 -21.590 -24.332 -83.474 1.00 67.80 C
-ANISOU 1940 CD1 LEU L 47 12662 6493 6605 2445 -2685 -466 C
-ATOM 1941 CD2 LEU L 47 -19.172 -23.998 -83.993 1.00 68.44 C
-ANISOU 1941 CD2 LEU L 47 12569 6633 6803 2724 -2882 -71 C
-ATOM 1942 N ILE L 48 -21.362 -23.549 -88.820 1.00 78.16 N
-ANISOU 1942 N ILE L 48 13583 7872 8244 3049 -2582 -848 N
-ATOM 1943 CA ILE L 48 -21.774 -24.192 -90.060 1.00 65.52 C
-ANISOU 1943 CA ILE L 48 12017 6221 6656 3132 -2492 -1011 C
-ATOM 1944 C ILE L 48 -22.277 -23.123 -91.015 1.00 66.01 C
-ANISOU 1944 C ILE L 48 11905 6472 6706 3138 -2522 -1131 C
-ATOM 1945 O ILE L 48 -23.095 -22.280 -90.633 1.00 72.82 O
-ANISOU 1945 O ILE L 48 12689 7418 7560 2995 -2555 -1207 O
-ATOM 1946 CB ILE L 48 -22.862 -25.255 -89.812 1.00 68.08 C
-ANISOU 1946 CB ILE L 48 12521 6378 6967 2963 -2414 -1171 C
-ATOM 1947 CG1 ILE L 48 -22.315 -26.372 -88.918 1.00 75.05 C
-ANISOU 1947 CG1 ILE L 48 13575 7052 7887 2971 -2384 -1012 C
-ATOM 1948 CG2 ILE L 48 -23.367 -25.822 -91.123 1.00 75.95 C
-ANISOU 1948 CG2 ILE L 48 13573 7331 7953 2998 -2356 -1375 C
-ATOM 1949 CD1 ILE L 48 -23.307 -27.471 -88.649 1.00 81.72 C
-ANISOU 1949 CD1 ILE L 48 14600 7704 8746 2790 -2319 -1126 C
-ATOM 1950 N TYR L 49 -21.776 -23.147 -92.246 1.00 72.32 N
-ANISOU 1950 N TYR L 49 12636 7344 7499 3318 -2499 -1132 N
-ATOM 1951 CA TYR L 49 -22.255 -22.287 -93.317 1.00 71.33 C
-ANISOU 1951 CA TYR L 49 12343 7410 7348 3331 -2526 -1221 C
-ATOM 1952 C TYR L 49 -22.798 -23.154 -94.444 1.00 76.35 C
-ANISOU 1952 C TYR L 49 13081 8026 7903 3348 -2450 -1420 C
-ATOM 1953 O TYR L 49 -22.586 -24.368 -94.477 1.00 78.96 O
-ANISOU 1953 O TYR L 49 13618 8168 8214 3395 -2370 -1482 O
-ATOM 1954 CB TYR L 49 -21.144 -21.360 -93.831 1.00 60.65 C
-ANISOU 1954 CB TYR L 49 10791 6225 6028 3508 -2587 -1014 C
-ATOM 1955 CG TYR L 49 -19.990 -22.067 -94.507 1.00 63.44 C
-ANISOU 1955 CG TYR L 49 11165 6581 6358 3755 -2512 -896 C
-ATOM 1956 CD1 TYR L 49 -19.991 -22.288 -95.878 1.00 66.96 C
-ANISOU 1956 CD1 TYR L 49 11588 7143 6713 3892 -2437 -988 C
-ATOM 1957 CD2 TYR L 49 -18.893 -22.502 -93.776 1.00 72.80 C
-ANISOU 1957 CD2 TYR L 49 12385 7673 7602 3861 -2509 -680 C
-ATOM 1958 CE1 TYR L 49 -18.931 -22.928 -96.500 1.00 78.03 C
-ANISOU 1958 CE1 TYR L 49 13014 8554 8079 4156 -2328 -891 C
-ATOM 1959 CE2 TYR L 49 -17.831 -23.144 -94.388 1.00 77.98 C
-ANISOU 1959 CE2 TYR L 49 13007 8363 8258 4072 -2380 -557 C
-ATOM 1960 CZ TYR L 49 -17.855 -23.353 -95.749 1.00 80.37 C
-ANISOU 1960 CZ TYR L 49 13323 8747 8465 4277 -2299 -667 C
-ATOM 1961 OH TYR L 49 -16.797 -23.990 -96.357 1.00 81.24 O
-ANISOU 1961 OH TYR L 49 13401 8904 8562 4503 -2131 -556 O
-ATOM 1962 N ALA L 50 -23.509 -22.515 -95.375 1.00 76.60 N
-ANISOU 1962 N ALA L 50 12974 8245 7886 3301 -2483 -1516 N
-ATOM 1963 CA ALA L 50 -24.123 -23.206 -96.512 1.00 71.42 C
-ANISOU 1963 CA ALA L 50 12407 7619 7111 3269 -2448 -1719 C
-ATOM 1964 C ALA L 50 -24.973 -24.388 -96.050 1.00 75.72 C
-ANISOU 1964 C ALA L 50 13186 7936 7649 3073 -2413 -1895 C
-ATOM 1965 O ALA L 50 -24.909 -25.484 -96.611 1.00 76.83 O
-ANISOU 1965 O ALA L 50 13543 7932 7717 3096 -2358 -2041 O
-ATOM 1966 CB ALA L 50 -23.064 -23.653 -97.520 1.00 68.43 C
-ANISOU 1966 CB ALA L 50 12085 7277 6638 3522 -2374 -1700 C
-ATOM 1967 N ALA L 51 -25.752 -24.162 -94.987 1.00 77.70 N
-ANISOU 1967 N ALA L 51 13401 8143 7977 2880 -2440 -1876 N
-ATOM 1968 CA ALA L 51 -26.712 -25.118 -94.439 1.00 78.99 C
-ANISOU 1968 CA ALA L 51 13725 8135 8152 2648 -2420 -1991 C
-ATOM 1969 C ALA L 51 -26.053 -26.342 -93.809 1.00 84.27 C
-ANISOU 1969 C ALA L 51 14655 8504 8860 2694 -2354 -1961 C
-ATOM 1970 O ALA L 51 -26.525 -26.838 -92.780 1.00 83.85 O
-ANISOU 1970 O ALA L 51 14688 8312 8860 2529 -2340 -1927 O
-ATOM 1971 CB ALA L 51 -27.710 -25.559 -95.515 1.00 82.36 C
-ANISOU 1971 CB ALA L 51 14180 8622 8490 2487 -2457 -2188 C
-ATOM 1972 N SER L 52 -24.965 -26.840 -94.404 1.00 82.37 N
-ANISOU 1972 N SER L 52 14529 8170 8598 2931 -2302 -1949 N
-ATOM 1973 CA SER L 52 -24.384 -28.084 -93.912 1.00 73.45 C
-ANISOU 1973 CA SER L 52 13651 6724 7533 2999 -2227 -1914 C
-ATOM 1974 C SER L 52 -22.862 -28.146 -94.007 1.00 65.08 C
-ANISOU 1974 C SER L 52 12590 5632 6506 3332 -2161 -1739 C
-ATOM 1975 O SER L 52 -22.301 -29.225 -93.783 1.00 67.07 O
-ANISOU 1975 O SER L 52 13047 5612 6827 3447 -2078 -1702 O
-ATOM 1976 CB SER L 52 -24.986 -29.273 -94.674 1.00 87.21 C
-ANISOU 1976 CB SER L 52 15654 8250 9233 2895 -2197 -2164 C
-ATOM 1977 OG SER L 52 -24.748 -29.163 -96.069 1.00 86.06 O
-ANISOU 1977 OG SER L 52 15520 8225 8953 3038 -2176 -2321 O
-ATOM 1978 N SER L 53 -22.171 -27.058 -94.327 1.00 63.51 N
-ANISOU 1978 N SER L 53 12159 5690 6282 3492 -2192 -1604 N
-ATOM 1979 CA SER L 53 -20.718 -27.078 -94.455 1.00 70.42 C
-ANISOU 1979 CA SER L 53 12981 6579 7195 3802 -2132 -1392 C
-ATOM 1980 C SER L 53 -20.098 -26.649 -93.130 1.00 80.92 C
-ANISOU 1980 C SER L 53 14202 7919 8623 3781 -2205 -1107 C
-ATOM 1981 O SER L 53 -20.367 -25.545 -92.641 1.00 82.13 O
-ANISOU 1981 O SER L 53 14186 8249 8772 3642 -2316 -1044 O
-ATOM 1982 CB SER L 53 -20.254 -26.165 -95.592 1.00 71.66 C
-ANISOU 1982 CB SER L 53 12931 7029 7266 3970 -2135 -1364 C
-ATOM 1983 OG SER L 53 -20.885 -26.492 -96.821 1.00 73.62 O
-ANISOU 1983 OG SER L 53 13279 7318 7375 3957 -2087 -1632 O
-ATOM 1984 N LEU L 54 -19.273 -27.520 -92.553 1.00 91.42 N
-ANISOU 1984 N LEU L 54 15640 9056 10039 3918 -2147 -933 N
-ATOM 1985 CA LEU L 54 -18.639 -27.244 -91.272 1.00 83.52 C
-ANISOU 1985 CA LEU L 54 14552 8075 9106 3880 -2234 -640 C
-ATOM 1986 C LEU L 54 -17.370 -26.426 -91.457 1.00 85.44 C
-ANISOU 1986 C LEU L 54 14516 8574 9374 4027 -2261 -371 C
-ATOM 1987 O LEU L 54 -16.616 -26.629 -92.412 1.00 90.28 O
-ANISOU 1987 O LEU L 54 15027 9278 9998 4224 -2130 -328 O
-ATOM 1988 CB LEU L 54 -18.308 -28.541 -90.535 1.00 81.19 C
-ANISOU 1988 CB LEU L 54 14449 7493 8907 3928 -2167 -513 C
-ATOM 1989 CG LEU L 54 -19.331 -29.011 -89.501 1.00 90.42 C
-ANISOU 1989 CG LEU L 54 15771 8510 10073 3631 -2203 -581 C
-ATOM 1990 CD1 LEU L 54 -20.598 -29.494 -90.184 1.00109.68 C
-ANISOU 1990 CD1 LEU L 54 18373 10825 12476 3476 -2147 -921 C
-ATOM 1991 CD2 LEU L 54 -18.745 -30.099 -88.617 1.00 83.00 C
-ANISOU 1991 CD2 LEU L 54 14958 7333 9244 3692 -2169 -336 C
-ATOM 1992 N LEU L 55 -17.141 -25.507 -90.526 1.00 80.62 N
-ANISOU 1992 N LEU L 55 13748 8115 8768 3856 -2399 -202 N
-ATOM 1993 CA LEU L 55 -15.932 -24.704 -90.529 1.00 78.64 C
-ANISOU 1993 CA LEU L 55 13173 8130 8579 3840 -2408 62 C
-ATOM 1994 C LEU L 55 -14.774 -25.509 -89.952 1.00 96.00 C
-ANISOU 1994 C LEU L 55 15293 10298 10886 3910 -2334 363 C
-ATOM 1995 O LEU L 55 -14.967 -26.415 -89.136 1.00111.18 O
-ANISOU 1995 O LEU L 55 17402 12016 12825 3894 -2335 402 O
-ATOM 1996 CB LEU L 55 -16.147 -23.423 -89.725 1.00 60.71 C
-ANISOU 1996 CB LEU L 55 10798 5988 6281 3595 -2585 94 C
-ATOM 1997 CG LEU L 55 -15.507 -22.146 -90.269 1.00 71.95 C
-ANISOU 1997 CG LEU L 55 11910 7666 7763 3530 -2612 206 C
-ATOM 1998 CD1 LEU L 55 -15.946 -21.902 -91.693 1.00 66.60 C
-ANISOU 1998 CD1 LEU L 55 11188 7064 7053 3660 -2532 36 C
-ATOM 1999 CD2 LEU L 55 -15.872 -20.954 -89.405 1.00 73.07 C
-ANISOU 1999 CD2 LEU L 55 12036 7847 7882 3292 -2786 180 C
-ATOM 2000 N SER L 56 -13.564 -25.182 -90.397 1.00100.51 N
-ANISOU 2000 N SER L 56 15564 11075 11550 3989 -2269 610 N
-ATOM 2001 CA SER L 56 -12.383 -25.895 -89.932 1.00105.83 C
-ANISOU 2001 CA SER L 56 16097 11750 12362 4076 -2199 946 C
-ATOM 2002 C SER L 56 -12.194 -25.689 -88.434 1.00112.93 C
-ANISOU 2002 C SER L 56 16964 12667 13275 3840 -2373 1157 C
-ATOM 2003 O SER L 56 -12.203 -24.558 -87.940 1.00121.98 O
-ANISOU 2003 O SER L 56 17999 13971 14375 3612 -2536 1193 O
-ATOM 2004 CB SER L 56 -11.149 -25.423 -90.699 1.00117.00 C
-ANISOU 2004 CB SER L 56 17156 13414 13883 4176 -2121 1200 C
-ATOM 2005 OG SER L 56 -10.992 -24.018 -90.595 1.00126.94 O
-ANISOU 2005 OG SER L 56 18190 14899 15144 3945 -2272 1284 O
-ATOM 2006 N GLY L 57 -12.031 -26.792 -87.709 1.00 96.84 N
-ANISOU 2006 N GLY L 57 15043 10458 11294 3893 -2338 1295 N
-ATOM 2007 CA GLY L 57 -11.918 -26.771 -86.272 1.00 92.28 C
-ANISOU 2007 CA GLY L 57 14476 9897 10688 3685 -2502 1502 C
-ATOM 2008 C GLY L 57 -13.181 -27.169 -85.539 1.00 92.29 C
-ANISOU 2008 C GLY L 57 14838 9679 10547 3576 -2574 1280 C
-ATOM 2009 O GLY L 57 -13.104 -27.565 -84.370 1.00101.78 O
-ANISOU 2009 O GLY L 57 16106 10847 11719 3456 -2666 1473 O
-ATOM 2010 N VAL L 58 -14.333 -27.075 -86.189 1.00 82.00 N
-ANISOU 2010 N VAL L 58 13756 8244 9155 3605 -2543 913 N
-ATOM 2011 CA VAL L 58 -15.587 -27.481 -85.548 1.00 79.73 C
-ANISOU 2011 CA VAL L 58 13802 7739 8754 3499 -2607 729 C
-ATOM 2012 C VAL L 58 -15.608 -29.000 -85.410 1.00 82.17 C
-ANISOU 2012 C VAL L 58 14289 7759 9172 3617 -2482 809 C
-ATOM 2013 O VAL L 58 -15.291 -29.711 -86.380 1.00 89.74 O
-ANISOU 2013 O VAL L 58 15243 8597 10257 3831 -2303 754 O
-ATOM 2014 CB VAL L 58 -16.781 -26.983 -86.357 1.00 66.87 C
-ANISOU 2014 CB VAL L 58 12314 6054 7040 3501 -2609 355 C
-ATOM 2015 CG1 VAL L 58 -18.085 -27.466 -85.736 1.00 74.98 C
-ANISOU 2015 CG1 VAL L 58 13554 6936 7999 3277 -2578 159 C
-ATOM 2016 CG2 VAL L 58 -16.751 -25.467 -86.439 1.00 63.34 C
-ANISOU 2016 CG2 VAL L 58 11683 5867 6518 3384 -2729 301 C
-ATOM 2017 N PRO L 59 -15.954 -29.540 -84.243 1.00 75.60 N
-ANISOU 2017 N PRO L 59 13625 6804 8295 3482 -2561 946 N
-ATOM 2018 CA PRO L 59 -15.963 -30.997 -84.075 1.00 79.48 C
-ANISOU 2018 CA PRO L 59 14277 6989 8931 3572 -2440 1055 C
-ATOM 2019 C PRO L 59 -16.956 -31.670 -85.013 1.00 85.57 C
-ANISOU 2019 C PRO L 59 15311 7448 9752 3643 -2315 707 C
-ATOM 2020 O PRO L 59 -17.896 -31.054 -85.520 1.00 91.06 O
-ANISOU 2020 O PRO L 59 16022 8232 10346 3498 -2312 376 O
-ATOM 2021 CB PRO L 59 -16.372 -31.184 -82.609 1.00 84.77 C
-ANISOU 2021 CB PRO L 59 15077 7647 9485 3339 -2579 1247 C
-ATOM 2022 CG PRO L 59 -16.045 -29.883 -81.949 1.00 90.71 C
-ANISOU 2022 CG PRO L 59 15668 8751 10046 3176 -2766 1331 C
-ATOM 2023 CD PRO L 59 -16.275 -28.835 -82.990 1.00 79.85 C
-ANISOU 2023 CD PRO L 59 14202 7498 8639 3226 -2756 1030 C
-ATOM 2024 N SER L 60 -16.734 -32.970 -85.227 1.00 91.00 N
-ANISOU 2024 N SER L 60 16106 7848 10622 3766 -2160 763 N
-ATOM 2025 CA SER L 60 -17.596 -33.772 -86.088 1.00 85.31 C
-ANISOU 2025 CA SER L 60 15647 6803 9965 3785 -2037 431 C
-ATOM 2026 C SER L 60 -19.023 -33.885 -85.563 1.00 89.54 C
-ANISOU 2026 C SER L 60 16342 7261 10417 3430 -2094 247 C
-ATOM 2027 O SER L 60 -19.943 -34.117 -86.355 1.00 87.22 O
-ANISOU 2027 O SER L 60 16183 6842 10115 3334 -2038 -90 O
-ATOM 2028 CB SER L 60 -17.005 -35.176 -86.249 1.00101.17 C
-ANISOU 2028 CB SER L 60 17723 8513 12202 3947 -1858 557 C
-ATOM 2029 OG SER L 60 -15.619 -35.130 -86.531 1.00109.74 O
-ANISOU 2029 OG SER L 60 18532 9773 13391 4198 -1756 793 O
-ATOM 2030 N ARG L 61 -19.234 -33.738 -84.252 1.00 92.15 N
-ANISOU 2030 N ARG L 61 16624 7717 10673 3200 -2192 467 N
-ATOM 2031 CA ARG L 61 -20.560 -33.969 -83.685 1.00 85.41 C
-ANISOU 2031 CA ARG L 61 15873 6829 9751 2855 -2200 342 C
-ATOM 2032 C ARG L 61 -21.581 -32.935 -84.146 1.00 87.04 C
-ANISOU 2032 C ARG L 61 15994 7278 9798 2678 -2219 5 C
-ATOM 2033 O ARG L 61 -22.787 -33.183 -84.039 1.00 90.51 O
-ANISOU 2033 O ARG L 61 16505 7674 10210 2425 -2196 -152 O
-ATOM 2034 CB ARG L 61 -20.482 -34.002 -82.154 1.00 77.37 C
-ANISOU 2034 CB ARG L 61 14811 5939 8645 2671 -2283 675 C
-ATOM 2035 CG ARG L 61 -19.736 -32.828 -81.532 1.00 88.28 C
-ANISOU 2035 CG ARG L 61 15995 7694 9853 2687 -2408 837 C
-ATOM 2036 CD ARG L 61 -19.596 -32.978 -80.014 1.00 84.40 C
-ANISOU 2036 CD ARG L 61 15495 7333 9240 2499 -2497 1175 C
-ATOM 2037 NE ARG L 61 -19.026 -31.785 -79.389 1.00 75.98 N
-ANISOU 2037 NE ARG L 61 14279 6628 7962 2446 -2640 1270 N
-ATOM 2038 CZ ARG L 61 -17.756 -31.660 -79.015 1.00 85.99 C
-ANISOU 2038 CZ ARG L 61 15434 8001 9238 2572 -2761 1604 C
-ATOM 2039 NH1 ARG L 61 -16.900 -32.654 -79.206 1.00 94.20 N1+
-ANISOU 2039 NH1 ARG L 61 16470 8821 10502 2802 -2728 1897 N1+
-ATOM 2040 NH2 ARG L 61 -17.337 -30.534 -78.455 1.00 80.98 N
-ANISOU 2040 NH2 ARG L 61 14690 7684 8396 2465 -2916 1654 N
-ATOM 2041 N PHE L 62 -21.133 -31.794 -84.661 1.00 71.41 N
-ANISOU 2041 N PHE L 62 13847 5553 7734 2804 -2262 -78 N
-ATOM 2042 CA PHE L 62 -22.046 -30.799 -85.207 1.00 76.12 C
-ANISOU 2042 CA PHE L 62 14349 6359 8216 2679 -2274 -374 C
-ATOM 2043 C PHE L 62 -22.387 -31.147 -86.649 1.00 81.82 C
-ANISOU 2043 C PHE L 62 15145 6941 9004 2775 -2204 -652 C
-ATOM 2044 O PHE L 62 -21.501 -31.468 -87.448 1.00 76.67 O
-ANISOU 2044 O PHE L 62 14524 6178 8427 3045 -2156 -638 O
-ATOM 2045 CB PHE L 62 -21.430 -29.405 -85.122 1.00 74.56 C
-ANISOU 2045 CB PHE L 62 13948 6468 7914 2754 -2364 -325 C
-ATOM 2046 CG PHE L 62 -21.300 -28.890 -83.718 1.00 84.91 C
-ANISOU 2046 CG PHE L 62 15213 7952 9096 2597 -2452 -133 C
-ATOM 2047 CD1 PHE L 62 -20.214 -29.246 -82.932 1.00 93.54 C
-ANISOU 2047 CD1 PHE L 62 16306 9033 10204 2669 -2521 202 C
-ATOM 2048 CD2 PHE L 62 -22.261 -28.048 -83.185 1.00 75.02 C
-ANISOU 2048 CD2 PHE L 62 13920 6887 7697 2385 -2462 -283 C
-ATOM 2049 CE1 PHE L 62 -20.095 -28.776 -81.642 1.00 94.11 C
-ANISOU 2049 CE1 PHE L 62 16357 9289 10113 2496 -2621 369 C
-ATOM 2050 CE2 PHE L 62 -22.145 -27.572 -81.898 1.00 78.89 C
-ANISOU 2050 CE2 PHE L 62 14407 7540 8027 2243 -2529 -144 C
-ATOM 2051 CZ PHE L 62 -21.061 -27.936 -81.124 1.00 93.44 C
-ANISOU 2051 CZ PHE L 62 16269 9382 9851 2281 -2621 174 C
-ATOM 2052 N SER L 63 -23.674 -31.087 -86.979 1.00 94.35 N
-ANISOU 2052 N SER L 63 16751 8552 10546 2553 -2194 -893 N
-ATOM 2053 CA SER L 63 -24.162 -31.515 -88.280 1.00 87.39 C
-ANISOU 2053 CA SER L 63 15967 7543 9693 2567 -2155 -1165 C
-ATOM 2054 C SER L 63 -25.270 -30.578 -88.739 1.00 80.46 C
-ANISOU 2054 C SER L 63 14933 6927 8712 2390 -2196 -1374 C
-ATOM 2055 O SER L 63 -26.107 -30.150 -87.938 1.00 76.74 O
-ANISOU 2055 O SER L 63 14365 6602 8192 2174 -2214 -1342 O
-ATOM 2056 CB SER L 63 -24.669 -32.961 -88.222 1.00 72.69 C
-ANISOU 2056 CB SER L 63 14361 5312 7944 2427 -2115 -1205 C
-ATOM 2057 OG SER L 63 -24.944 -33.458 -89.517 1.00 91.33 O
-ANISOU 2057 OG SER L 63 16871 7515 10316 2458 -2089 -1482 O
-ATOM 2058 N GLY L 64 -25.263 -30.258 -90.029 1.00 77.09 N
-ANISOU 2058 N GLY L 64 14470 6574 8245 2497 -2198 -1568 N
-ATOM 2059 CA GLY L 64 -26.247 -29.368 -90.610 1.00 74.66 C
-ANISOU 2059 CA GLY L 64 13991 6523 7856 2359 -2244 -1733 C
-ATOM 2060 C GLY L 64 -27.086 -30.081 -91.654 1.00 80.18 C
-ANISOU 2060 C GLY L 64 14814 7116 8535 2214 -2257 -1972 C
-ATOM 2061 O GLY L 64 -26.604 -30.966 -92.364 1.00 76.95 O
-ANISOU 2061 O GLY L 64 14621 6476 8140 2327 -2222 -2076 O
-ATOM 2062 N SER L 65 -28.352 -29.683 -91.743 1.00 84.41 N
-ANISOU 2062 N SER L 65 15214 7826 9034 1963 -2308 -2057 N
-ATOM 2063 CA SER L 65 -29.290 -30.327 -92.647 1.00 78.95 C
-ANISOU 2063 CA SER L 65 14615 7070 8311 1747 -2361 -2261 C
-ATOM 2064 C SER L 65 -30.358 -29.325 -93.057 1.00 85.66 C
-ANISOU 2064 C SER L 65 15182 8265 9100 1596 -2427 -2306 C
-ATOM 2065 O SER L 65 -30.485 -28.243 -92.478 1.00 97.94 O
-ANISOU 2065 O SER L 65 16500 10050 10664 1646 -2406 -2185 O
-ATOM 2066 CB SER L 65 -29.931 -31.558 -92.002 1.00 94.97 C
-ANISOU 2066 CB SER L 65 16839 8813 10432 1479 -2364 -2242 C
-ATOM 2067 OG SER L 65 -31.036 -32.015 -92.761 1.00108.56 O
-ANISOU 2067 OG SER L 65 18600 10526 12123 1189 -2454 -2415 O
-ATOM 2068 N GLY L 66 -31.130 -29.706 -94.066 1.00 86.84 N
-ANISOU 2068 N GLY L 66 15368 8439 9188 1410 -2509 -2479 N
-ATOM 2069 CA GLY L 66 -32.236 -28.902 -94.534 1.00 89.27 C
-ANISOU 2069 CA GLY L 66 15395 9074 9451 1241 -2587 -2492 C
-ATOM 2070 C GLY L 66 -31.913 -28.172 -95.828 1.00 89.84 C
-ANISOU 2070 C GLY L 66 15364 9373 9401 1402 -2641 -2586 C
-ATOM 2071 O GLY L 66 -30.753 -27.992 -96.210 1.00 83.78 O
-ANISOU 2071 O GLY L 66 14675 8570 8586 1689 -2592 -2601 O
-ATOM 2072 N SER L 67 -32.973 -27.741 -96.510 1.00 95.04 N
-ANISOU 2072 N SER L 67 15812 10294 10004 1208 -2743 -2614 N
-ATOM 2073 CA SER L 67 -32.823 -27.022 -97.770 1.00 95.84 C
-ANISOU 2073 CA SER L 67 15780 10660 9973 1319 -2813 -2669 C
-ATOM 2074 C SER L 67 -34.132 -26.358 -98.176 1.00102.59 C
-ANISOU 2074 C SER L 67 16311 11846 10824 1098 -2922 -2598 C
-ATOM 2075 O SER L 67 -35.193 -26.992 -98.149 1.00110.04 O
-ANISOU 2075 O SER L 67 17253 12782 11776 772 -3006 -2627 O
-ATOM 2076 CB SER L 67 -32.345 -27.959 -98.880 1.00 98.85 C
-ANISOU 2076 CB SER L 67 16474 10901 10182 1324 -2854 -2902 C
-ATOM 2077 OG SER L 67 -32.124 -27.244-100.083 1.00107.38 O
-ANISOU 2077 OG SER L 67 17423 12276 11099 1447 -2908 -2933 O
-ATOM 2078 N GLY L 68 -34.067 -25.085 -98.554 1.00 96.18 N
-ANISOU 2078 N GLY L 68 15206 11323 10017 1269 -2929 -2476 N
-ATOM 2079 CA GLY L 68 -35.252 -24.356 -98.957 1.00 97.22 C
-ANISOU 2079 CA GLY L 68 14989 11781 10171 1110 -3022 -2361 C
-ATOM 2080 C GLY L 68 -35.837 -23.509 -97.847 1.00 87.27 C
-ANISOU 2080 C GLY L 68 13455 10594 9109 1150 -2922 -2170 C
-ATOM 2081 O GLY L 68 -35.570 -22.306 -97.771 1.00 85.45 O
-ANISOU 2081 O GLY L 68 13014 10495 8959 1377 -2872 -2045 O
-ATOM 2082 N THR L 69 -36.644 -24.124 -96.981 1.00 76.17 N
-ANISOU 2082 N THR L 69 12059 9100 7782 930 -2884 -2143 N
-ATOM 2083 CA THR L 69 -37.242 -23.421 -95.856 1.00 71.39 C
-ANISOU 2083 CA THR L 69 11222 8569 7333 973 -2751 -1980 C
-ATOM 2084 C THR L 69 -37.126 -24.157 -94.531 1.00 80.10 C
-ANISOU 2084 C THR L 69 12525 9427 8483 911 -2630 -1982 C
-ATOM 2085 O THR L 69 -37.433 -23.561 -93.494 1.00 90.06 O
-ANISOU 2085 O THR L 69 13648 10738 9833 990 -2489 -1872 O
-ATOM 2086 CB THR L 69 -38.729 -23.132 -96.119 1.00 75.55 C
-ANISOU 2086 CB THR L 69 11390 9390 7924 759 -2805 -1838 C
-ATOM 2087 OG1 THR L 69 -39.380 -24.329 -96.564 1.00 85.17 O
-ANISOU 2087 OG1 THR L 69 12711 10583 9065 397 -2947 -1903 O
-ATOM 2088 CG2 THR L 69 -38.894 -22.040 -97.164 1.00 70.67 C
-ANISOU 2088 CG2 THR L 69 10483 9061 7309 884 -2889 -1748 C
-ATOM 2089 N ASP L 70 -36.705 -25.420 -94.525 1.00 82.04 N
-ANISOU 2089 N ASP L 70 13096 9410 8667 781 -2673 -2099 N
-ATOM 2090 CA ASP L 70 -36.562 -26.201 -93.304 1.00 80.92 C
-ANISOU 2090 CA ASP L 70 13147 9030 8571 710 -2573 -2064 C
-ATOM 2091 C ASP L 70 -35.097 -26.564 -93.113 1.00 89.34 C
-ANISOU 2091 C ASP L 70 14525 9819 9599 933 -2537 -2141 C
-ATOM 2092 O ASP L 70 -34.461 -27.104 -94.029 1.00103.03 O
-ANISOU 2092 O ASP L 70 16461 11424 11261 977 -2614 -2279 O
-ATOM 2093 CB ASP L 70 -37.426 -27.463 -93.348 1.00 99.85 C
-ANISOU 2093 CB ASP L 70 15640 11319 10978 334 -2657 -2078 C
-ATOM 2094 CG ASP L 70 -38.905 -27.152 -93.478 1.00117.66 C
-ANISOU 2094 CG ASP L 70 17542 13879 13283 88 -2700 -1947 C
-ATOM 2095 OD1 ASP L 70 -39.331 -26.075 -93.013 1.00118.33 O
-ANISOU 2095 OD1 ASP L 70 17324 14207 13429 229 -2586 -1811 O
-ATOM 2096 OD2 ASP L 70 -39.644 -27.986 -94.043 1.00135.18 O1-
-ANISOU 2096 OD2 ASP L 70 19785 16089 15487 -246 -2848 -1974 O1-
-ATOM 2097 N PHE L 71 -34.565 -26.258 -91.930 1.00 75.63 N
-ANISOU 2097 N PHE L 71 12823 8013 7900 1079 -2416 -2045 N
-ATOM 2098 CA PHE L 71 -33.159 -26.481 -91.633 1.00 65.84 C
-ANISOU 2098 CA PHE L 71 11820 6558 6640 1299 -2387 -2054 C
-ATOM 2099 C PHE L 71 -33.027 -27.056 -90.231 1.00 84.36 C
-ANISOU 2099 C PHE L 71 14298 8743 9013 1235 -2299 -1939 C
-ATOM 2100 O PHE L 71 -33.906 -26.887 -89.381 1.00 81.18 O
-ANISOU 2100 O PHE L 71 13763 8457 8624 1095 -2227 -1847 O
-ATOM 2101 CB PHE L 71 -32.346 -25.187 -91.774 1.00 70.97 C
-ANISOU 2101 CB PHE L 71 12342 7344 7278 1586 -2373 -2024 C
-ATOM 2102 CG PHE L 71 -32.419 -24.577 -93.148 1.00 74.47 C
-ANISOU 2102 CG PHE L 71 12637 7968 7690 1659 -2459 -2093 C
-ATOM 2103 CD1 PHE L 71 -31.454 -24.866 -94.099 1.00 73.69 C
-ANISOU 2103 CD1 PHE L 71 12677 7798 7523 1806 -2509 -2169 C
-ATOM 2104 CD2 PHE L 71 -33.452 -23.716 -93.488 1.00 69.15 C
-ANISOU 2104 CD2 PHE L 71 11671 7553 7049 1593 -2478 -2057 C
-ATOM 2105 CE1 PHE L 71 -31.521 -24.313 -95.362 1.00 76.74 C
-ANISOU 2105 CE1 PHE L 71 12925 8387 7846 1864 -2585 -2213 C
-ATOM 2106 CE2 PHE L 71 -33.521 -23.157 -94.747 1.00 71.34 C
-ANISOU 2106 CE2 PHE L 71 11797 8019 7289 1649 -2570 -2081 C
-ATOM 2107 CZ PHE L 71 -32.555 -23.456 -95.685 1.00 80.14 C
-ANISOU 2107 CZ PHE L 71 13063 9079 8306 1774 -2628 -2161 C
-ATOM 2108 N THR L 72 -31.914 -27.749 -89.999 1.00 87.25 N
-ANISOU 2108 N THR L 72 14913 8858 9379 1352 -2296 -1921 N
-ATOM 2109 CA THR L 72 -31.732 -28.508 -88.769 1.00 80.51 C
-ANISOU 2109 CA THR L 72 14210 7830 8549 1272 -2236 -1784 C
-ATOM 2110 C THR L 72 -30.268 -28.484 -88.365 1.00 68.23 C
-ANISOU 2110 C THR L 72 12792 6146 6986 1523 -2224 -1697 C
-ATOM 2111 O THR L 72 -29.390 -28.738 -89.195 1.00 69.69 O
-ANISOU 2111 O THR L 72 13087 6208 7186 1700 -2259 -1760 O
-ATOM 2112 CB THR L 72 -32.200 -29.960 -88.942 1.00 95.84 C
-ANISOU 2112 CB THR L 72 16348 9511 10555 1035 -2272 -1807 C
-ATOM 2113 OG1 THR L 72 -33.550 -29.978 -89.423 1.00113.13 O
-ANISOU 2113 OG1 THR L 72 18385 11846 12753 771 -2317 -1869 O
-ATOM 2114 CG2 THR L 72 -32.129 -30.707 -87.623 1.00100.52 C
-ANISOU 2114 CG2 THR L 72 17060 9950 11185 930 -2211 -1613 C
-ATOM 2115 N LEU L 73 -30.015 -28.178 -87.096 1.00 65.76 N
-ANISOU 2115 N LEU L 73 12465 5887 6633 1535 -2173 -1543 N
-ATOM 2116 CA LEU L 73 -28.698 -28.312 -86.489 1.00 65.37 C
-ANISOU 2116 CA LEU L 73 12538 5725 6573 1709 -2184 -1398 C
-ATOM 2117 C LEU L 73 -28.741 -29.460 -85.489 1.00 67.50 C
-ANISOU 2117 C LEU L 73 12971 5809 6868 1564 -2151 -1228 C
-ATOM 2118 O LEU L 73 -29.674 -29.551 -84.686 1.00 68.50 O
-ANISOU 2118 O LEU L 73 13049 6028 6951 1354 -2098 -1169 O
-ATOM 2119 CB LEU L 73 -28.274 -27.016 -85.796 1.00 66.37 C
-ANISOU 2119 CB LEU L 73 12539 6071 6609 1814 -2186 -1340 C
-ATOM 2120 CG LEU L 73 -26.916 -27.059 -85.098 1.00 66.65 C
-ANISOU 2120 CG LEU L 73 12667 6041 6615 1953 -2232 -1155 C
-ATOM 2121 CD1 LEU L 73 -25.825 -27.357 -86.108 1.00 66.81 C
-ANISOU 2121 CD1 LEU L 73 12731 5932 6724 2175 -2281 -1145 C
-ATOM 2122 CD2 LEU L 73 -26.632 -25.759 -84.369 1.00 63.17 C
-ANISOU 2122 CD2 LEU L 73 12131 5807 6065 1990 -2259 -1128 C
-ATOM 2123 N THR L 74 -27.743 -30.340 -85.544 1.00 70.64 N
-ANISOU 2123 N THR L 74 13545 5951 7343 1687 -2172 -1126 N
-ATOM 2124 CA THR L 74 -27.735 -31.547 -84.727 1.00 80.42 C
-ANISOU 2124 CA THR L 74 14949 6960 8646 1563 -2150 -938 C
-ATOM 2125 C THR L 74 -26.395 -31.707 -84.027 1.00 84.61 C
-ANISOU 2125 C THR L 74 15544 7421 9182 1751 -2171 -694 C
-ATOM 2126 O THR L 74 -25.342 -31.642 -84.669 1.00 94.82 O
-ANISOU 2126 O THR L 74 16858 8638 10530 2006 -2193 -694 O
-ATOM 2127 CB THR L 74 -28.029 -32.792 -85.576 1.00 74.83 C
-ANISOU 2127 CB THR L 74 14431 5914 8087 1493 -2154 -1044 C
-ATOM 2128 OG1 THR L 74 -29.323 -32.669 -86.178 1.00 73.46 O
-ANISOU 2128 OG1 THR L 74 14178 5835 7897 1265 -2168 -1237 O
-ATOM 2129 CG2 THR L 74 -27.988 -34.046 -84.720 1.00 83.39 C
-ANISOU 2129 CG2 THR L 74 15692 6716 9278 1367 -2137 -818 C
-ATOM 2130 N ILE L 75 -26.439 -31.919 -82.716 1.00 72.25 N
-ANISOU 2130 N ILE L 75 13993 5910 7550 1621 -2163 -461 N
-ATOM 2131 CA ILE L 75 -25.273 -32.319 -81.937 1.00 79.78 C
-ANISOU 2131 CA ILE L 75 15012 6785 8517 1742 -2202 -164 C
-ATOM 2132 C ILE L 75 -25.522 -33.741 -81.448 1.00 79.80 C
-ANISOU 2132 C ILE L 75 15176 6497 8648 1607 -2172 32 C
-ATOM 2133 O ILE L 75 -26.503 -33.998 -80.737 1.00 81.46 O
-ANISOU 2133 O ILE L 75 15380 6771 8799 1342 -2138 91 O
-ATOM 2134 CB ILE L 75 -25.010 -31.363 -80.766 1.00 80.71 C
-ANISOU 2134 CB ILE L 75 15025 7224 8416 1692 -2243 -26 C
-ATOM 2135 CG1 ILE L 75 -25.060 -29.911 -81.244 1.00 86.01 C
-ANISOU 2135 CG1 ILE L 75 15550 8147 8981 1769 -2266 -256 C
-ATOM 2136 CG2 ILE L 75 -23.654 -31.654 -80.160 1.00 73.50 C
-ANISOU 2136 CG2 ILE L 75 14143 6269 7514 1833 -2324 291 C
-ATOM 2137 CD1 ILE L 75 -24.937 -28.890 -80.123 1.00 69.30 C
-ANISOU 2137 CD1 ILE L 75 13376 6319 6636 1694 -2304 -193 C
-ATOM 2138 N SER L 76 -24.632 -34.660 -81.831 1.00 69.95 N
-ANISOU 2138 N SER L 76 14887 5371 6322 1631 -1560 -442 N
-ATOM 2139 CA SER L 76 -24.876 -36.086 -81.635 1.00 83.04 C
-ANISOU 2139 CA SER L 76 17017 6679 7855 1609 -1437 -395 C
-ATOM 2140 C SER L 76 -24.646 -36.508 -80.188 1.00117.40 C
-ANISOU 2140 C SER L 76 21326 11083 12197 1610 -1478 -197 C
-ATOM 2141 O SER L 76 -25.542 -37.058 -79.540 1.00139.71 O
-ANISOU 2141 O SER L 76 24339 13823 14921 1308 -1517 -260 O
-ATOM 2142 CB SER L 76 -23.989 -36.898 -82.578 1.00 88.75 C
-ANISOU 2142 CB SER L 76 18091 7080 8549 1983 -1203 -297 C
-ATOM 2143 OG SER L 76 -24.291 -38.280 -82.485 1.00109.67 O
-ANISOU 2143 OG SER L 76 21304 9318 11050 1946 -1053 -277 O
-ATOM 2144 N SER L 77 -23.439 -36.286 -79.673 1.00116.96 N
-ANISOU 2144 N SER L 77 21021 11193 12227 1922 -1476 67 N
-ATOM 2145 CA SER L 77 -23.121 -36.546 -78.272 1.00114.57 C
-ANISOU 2145 CA SER L 77 20617 11011 11904 1906 -1551 295 C
-ATOM 2146 C SER L 77 -22.613 -35.244 -77.670 1.00112.54 C
-ANISOU 2146 C SER L 77 19845 11197 11716 1851 -1722 367 C
-ATOM 2147 O SER L 77 -21.490 -34.817 -77.959 1.00123.22 O
-ANISOU 2147 O SER L 77 20951 12728 13140 2126 -1712 556 O
-ATOM 2148 CB SER L 77 -22.089 -37.665 -78.127 1.00115.20 C
-ANISOU 2148 CB SER L 77 20918 10876 11975 2324 -1389 626 C
-ATOM 2149 OG SER L 77 -20.802 -37.232 -78.527 1.00119.98 O
-ANISOU 2149 OG SER L 77 21220 11681 12687 2719 -1341 855 O
-ATOM 2150 N LEU L 78 -23.444 -34.614 -76.843 1.00 97.23 N
-ANISOU 2150 N LEU L 78 17770 9436 9736 1478 -1859 220 N
-ATOM 2151 CA LEU L 78 -23.098 -33.323 -76.270 1.00 85.86 C
-ANISOU 2151 CA LEU L 78 15946 8361 8316 1355 -1997 238 C
-ATOM 2152 C LEU L 78 -21.874 -33.428 -75.368 1.00 96.65 C
-ANISOU 2152 C LEU L 78 17134 9939 9650 1486 -2066 602 C
-ATOM 2153 O LEU L 78 -21.585 -34.476 -74.785 1.00 93.44 O
-ANISOU 2153 O LEU L 78 16884 9421 9196 1597 -2035 830 O
-ATOM 2154 CB LEU L 78 -24.277 -32.762 -75.476 1.00 84.56 C
-ANISOU 2154 CB LEU L 78 15748 8292 8088 956 -2069 18 C
-ATOM 2155 CG LEU L 78 -25.311 -31.963 -76.263 1.00 77.34 C
-ANISOU 2155 CG LEU L 78 14780 7381 7225 817 -2054 -292 C
-ATOM 2156 CD1 LEU L 78 -26.487 -31.605 -75.371 1.00 84.68 C
-ANISOU 2156 CD1 LEU L 78 15682 8405 8089 484 -2073 -454 C
-ATOM 2157 CD2 LEU L 78 -24.664 -30.711 -76.821 1.00 64.90 C
-ANISOU 2157 CD2 LEU L 78 12951 5985 5722 924 -2094 -313 C
-ATOM 2158 N GLN L 79 -21.151 -32.324 -75.265 1.00104.51 N
-ANISOU 2158 N GLN L 79 17805 11254 10652 1454 -2168 678 N
-ATOM 2159 CA GLN L 79 -20.025 -32.164 -74.362 1.00107.67 C
-ANISOU 2159 CA GLN L 79 17959 11969 10981 1462 -2287 1033 C
-ATOM 2160 C GLN L 79 -20.192 -30.850 -73.619 1.00108.57 C
-ANISOU 2160 C GLN L 79 17904 12359 10990 1060 -2433 916 C
-ATOM 2161 O GLN L 79 -20.920 -29.962 -74.075 1.00111.17 O
-ANISOU 2161 O GLN L 79 18254 12639 11346 909 -2409 597 O
-ATOM 2162 CB GLN L 79 -18.688 -32.191 -75.120 1.00104.72 C
-ANISOU 2162 CB GLN L 79 17361 11745 10683 1843 -2247 1322 C
-ATOM 2163 CG GLN L 79 -18.266 -33.584 -75.564 1.00106.51 C
-ANISOU 2163 CG GLN L 79 17777 11715 10978 2294 -2068 1544 C
-ATOM 2164 CD GLN L 79 -16.764 -33.718 -75.715 1.00126.00 C
-ANISOU 2164 CD GLN L 79 19932 14460 13483 2671 -2045 1994 C
-ATOM 2165 OE1 GLN L 79 -16.021 -32.756 -75.525 1.00129.38 O
-ANISOU 2165 OE1 GLN L 79 19978 15308 13872 2543 -2192 2142 O
-ATOM 2166 NE2 GLN L 79 -16.309 -34.918 -76.054 1.00139.28 N
-ANISOU 2166 NE2 GLN L 79 21784 15911 15224 3135 -1846 2231 N
-ATOM 2167 N PRO L 80 -19.551 -30.702 -72.452 1.00104.19 N
-ANISOU 2167 N PRO L 80 17211 12085 10291 869 -2576 1178 N
-ATOM 2168 CA PRO L 80 -19.754 -29.471 -71.667 1.00 98.92 C
-ANISOU 2168 CA PRO L 80 16488 11629 9469 430 -2685 1043 C
-ATOM 2169 C PRO L 80 -19.428 -28.202 -72.433 1.00 93.41 C
-ANISOU 2169 C PRO L 80 15648 11052 8790 386 -2699 912 C
-ATOM 2170 O PRO L 80 -20.113 -27.186 -72.265 1.00 85.19 O
-ANISOU 2170 O PRO L 80 14706 9976 7685 115 -2681 625 O
-ATOM 2171 CB PRO L 80 -18.819 -29.671 -70.468 1.00105.09 C
-ANISOU 2171 CB PRO L 80 17128 12731 10070 262 -2855 1439 C
-ATOM 2172 CG PRO L 80 -18.687 -31.150 -70.344 1.00104.65 C
-ANISOU 2172 CG PRO L 80 17151 12527 10084 570 -2807 1689 C
-ATOM 2173 CD PRO L 80 -18.699 -31.673 -71.743 1.00 89.10 C
-ANISOU 2173 CD PRO L 80 15234 10294 8328 1020 -2635 1611 C
-ATOM 2174 N GLU L 81 -18.413 -28.240 -73.293 1.00 91.08 N
-ANISOU 2174 N GLU L 81 15144 10885 8579 666 -2705 1122 N
-ATOM 2175 CA GLU L 81 -18.020 -27.070 -74.067 1.00 86.17 C
-ANISOU 2175 CA GLU L 81 14392 10387 7962 614 -2723 1026 C
-ATOM 2176 C GLU L 81 -19.051 -26.664 -75.115 1.00 79.95 C
-ANISOU 2176 C GLU L 81 13771 9293 7312 703 -2589 627 C
-ATOM 2177 O GLU L 81 -18.824 -25.672 -75.815 1.00 89.39 O
-ANISOU 2177 O GLU L 81 14899 10550 8516 667 -2595 527 O
-ATOM 2178 CB GLU L 81 -16.672 -27.339 -74.736 1.00106.84 C
-ANISOU 2178 CB GLU L 81 16717 13245 10634 915 -2742 1384 C
-ATOM 2179 CG GLU L 81 -16.593 -28.699 -75.411 1.00126.02 C
-ANISOU 2179 CG GLU L 81 19198 15450 13234 1410 -2583 1503 C
-ATOM 2180 CD GLU L 81 -15.226 -28.985 -75.993 1.00146.52 C
-ANISOU 2180 CD GLU L 81 21487 18304 15879 1760 -2553 1894 C
-ATOM 2181 OE1 GLU L 81 -14.318 -28.146 -75.818 1.00155.40 O
-ANISOU 2181 OE1 GLU L 81 22308 19841 16896 1575 -2692 2104 O
-ATOM 2182 OE2 GLU L 81 -15.061 -30.047 -76.628 1.00154.14 O1-
-ANISOU 2182 OE2 GLU L 81 22532 19062 16973 2210 -2372 2000 O1-
-ATOM 2183 N ASP L 82 -20.169 -27.382 -75.237 1.00 66.76 N
-ANISOU 2183 N ASP L 82 12311 7323 5730 787 -2483 420 N
-ATOM 2184 CA ASP L 82 -21.142 -27.133 -76.292 1.00 71.24 C
-ANISOU 2184 CA ASP L 82 12996 7651 6421 875 -2376 104 C
-ATOM 2185 C ASP L 82 -22.407 -26.434 -75.816 1.00 70.76 C
-ANISOU 2185 C ASP L 82 13057 7505 6323 615 -2344 -191 C
-ATOM 2186 O ASP L 82 -23.251 -26.092 -76.651 1.00 82.48 O
-ANISOU 2186 O ASP L 82 14589 8847 7902 674 -2273 -420 O
-ATOM 2187 CB ASP L 82 -21.533 -28.451 -76.975 1.00 76.14 C
-ANISOU 2187 CB ASP L 82 13771 8011 7148 1140 -2268 93 C
-ATOM 2188 CG ASP L 82 -20.386 -29.069 -77.747 1.00 81.71 C
-ANISOU 2188 CG ASP L 82 14400 8732 7914 1490 -2218 339 C
-ATOM 2189 OD1 ASP L 82 -19.555 -28.307 -78.287 1.00 84.81 O
-ANISOU 2189 OD1 ASP L 82 14594 9312 8318 1556 -2248 420 O
-ATOM 2190 OD2 ASP L 82 -20.317 -30.316 -77.810 1.00 78.76 O1-
-ANISOU 2190 OD2 ASP L 82 14185 8175 7565 1704 -2126 460 O1-
-ATOM 2191 N PHE L 83 -22.567 -26.216 -74.514 1.00 68.79 N
-ANISOU 2191 N PHE L 83 12856 7351 5931 340 -2382 -173 N
-ATOM 2192 CA PHE L 83 -23.770 -25.579 -73.988 1.00 67.76 C
-ANISOU 2192 CA PHE L 83 12849 7140 5756 130 -2298 -437 C
-ATOM 2193 C PHE L 83 -23.642 -24.070 -74.147 1.00 70.15 C
-ANISOU 2193 C PHE L 83 13156 7494 6003 14 -2282 -562 C
-ATOM 2194 O PHE L 83 -22.796 -23.439 -73.504 1.00 78.87 O
-ANISOU 2194 O PHE L 83 14265 8761 6940 -201 -2362 -446 O
-ATOM 2195 CB PHE L 83 -23.989 -25.974 -72.530 1.00 65.01 C
-ANISOU 2195 CB PHE L 83 12600 6851 5251 -126 -2312 -377 C
-ATOM 2196 CG PHE L 83 -24.380 -27.414 -72.349 1.00 83.65 C
-ANISOU 2196 CG PHE L 83 15025 9102 7654 -41 -2301 -297 C
-ATOM 2197 CD1 PHE L 83 -25.713 -27.772 -72.231 1.00 87.67 C
-ANISOU 2197 CD1 PHE L 83 15639 9478 8193 -109 -2194 -495 C
-ATOM 2198 CD2 PHE L 83 -23.419 -28.411 -72.308 1.00 82.25 C
-ANISOU 2198 CD2 PHE L 83 14811 8961 7479 110 -2384 -3 C
-ATOM 2199 CE1 PHE L 83 -26.080 -29.096 -72.074 1.00 92.11 C
-ANISOU 2199 CE1 PHE L 83 16313 9924 8762 -87 -2186 -424 C
-ATOM 2200 CE2 PHE L 83 -23.781 -29.736 -72.151 1.00 87.11 C
-ANISOU 2200 CE2 PHE L 83 15564 9418 8115 191 -2351 70 C
-ATOM 2201 CZ PHE L 83 -25.113 -30.077 -72.033 1.00 89.55 C
-ANISOU 2201 CZ PHE L 83 16022 9573 8429 62 -2260 -153 C
-ATOM 2202 N ALA L 84 -24.476 -23.492 -75.005 1.00 65.08 N
-ANISOU 2202 N ALA L 84 12531 6716 5479 136 -2184 -779 N
-ATOM 2203 CA ALA L 84 -24.431 -22.064 -75.294 1.00 75.99 C
-ANISOU 2203 CA ALA L 84 13966 8084 6822 79 -2141 -900 C
-ATOM 2204 C ALA L 84 -25.774 -21.655 -75.886 1.00 78.13 C
-ANISOU 2204 C ALA L 84 14261 8201 7224 220 -1999 -1123 C
-ATOM 2205 O ALA L 84 -26.758 -22.400 -75.815 1.00 77.63 O
-ANISOU 2205 O ALA L 84 14166 8093 7235 273 -1941 -1183 O
-ATOM 2206 CB ALA L 84 -23.266 -21.731 -76.231 1.00 69.62 C
-ANISOU 2206 CB ALA L 84 13049 7366 6039 175 -2245 -769 C
-ATOM 2207 N THR L 85 -25.819 -20.461 -76.470 1.00 77.94 N
-ANISOU 2207 N THR L 85 14286 8114 7213 270 -1947 -1221 N
-ATOM 2208 CA THR L 85 -27.002 -19.971 -77.162 1.00 74.97 C
-ANISOU 2208 CA THR L 85 13888 7625 6970 453 -1824 -1373 C
-ATOM 2209 C THR L 85 -26.724 -20.004 -78.656 1.00 79.67 C
-ANISOU 2209 C THR L 85 14364 8206 7700 655 -1913 -1339 C
-ATOM 2210 O THR L 85 -25.840 -19.290 -79.138 1.00 84.58 O
-ANISOU 2210 O THR L 85 15022 8833 8282 649 -1968 -1299 O
-ATOM 2211 CB THR L 85 -27.363 -18.557 -76.710 1.00 78.61 C
-ANISOU 2211 CB THR L 85 14546 7981 7341 400 -1659 -1499 C
-ATOM 2212 OG1 THR L 85 -27.727 -18.575 -75.325 1.00 89.87 O
-ANISOU 2212 OG1 THR L 85 16117 9406 8624 207 -1540 -1551 O
-ATOM 2213 CG2 THR L 85 -28.527 -18.024 -77.522 1.00 75.83 C
-ANISOU 2213 CG2 THR L 85 14124 7542 7147 658 -1532 -1594 C
-ATOM 2214 N TYR L 86 -27.474 -20.823 -79.385 1.00 58.36 N
-ANISOU 2214 N TYR L 86 11545 5499 5131 791 -1927 -1352 N
-ATOM 2215 CA TYR L 86 -27.247 -21.013 -80.811 1.00 61.39 C
-ANISOU 2215 CA TYR L 86 11852 5863 5610 947 -2008 -1323 C
-ATOM 2216 C TYR L 86 -28.226 -20.178 -81.627 1.00 64.03 C
-ANISOU 2216 C TYR L 86 12133 6162 6035 1074 -1956 -1406 C
-ATOM 2217 O TYR L 86 -29.404 -20.060 -81.277 1.00 62.53 O
-ANISOU 2217 O TYR L 86 11886 5992 5882 1091 -1862 -1460 O
-ATOM 2218 CB TYR L 86 -27.360 -22.493 -81.177 1.00 57.28 C
-ANISOU 2218 CB TYR L 86 11302 5336 5124 972 -2062 -1270 C
-ATOM 2219 CG TYR L 86 -26.234 -23.312 -80.588 1.00 73.39 C
-ANISOU 2219 CG TYR L 86 13388 7401 7095 934 -2108 -1132 C
-ATOM 2220 CD1 TYR L 86 -26.252 -23.692 -79.249 1.00 72.56 C
-ANISOU 2220 CD1 TYR L 86 13325 7337 6906 786 -2092 -1091 C
-ATOM 2221 CD2 TYR L 86 -25.139 -23.678 -81.359 1.00 63.08 C
-ANISOU 2221 CD2 TYR L 86 12071 6097 5800 1062 -2156 -1017 C
-ATOM 2222 CE1 TYR L 86 -25.220 -24.428 -78.699 1.00 72.80 C
-ANISOU 2222 CE1 TYR L 86 13371 7419 6872 771 -2147 -916 C
-ATOM 2223 CE2 TYR L 86 -24.102 -24.413 -80.819 1.00 68.88 C
-ANISOU 2223 CE2 TYR L 86 12803 6888 6482 1084 -2182 -837 C
-ATOM 2224 CZ TYR L 86 -24.146 -24.785 -79.486 1.00 70.71 C
-ANISOU 2224 CZ TYR L 86 13060 7169 6636 940 -2190 -774 C
-ATOM 2225 OH TYR L 86 -23.114 -25.518 -78.941 1.00 65.36 O
-ANISOU 2225 OH TYR L 86 12355 6574 5905 979 -2229 -547 O
-ATOM 2226 N TYR L 87 -27.725 -19.594 -82.715 1.00 66.04 N
-ANISOU 2226 N TYR L 87 12388 6385 6320 1172 -2012 -1389 N
-ATOM 2227 CA TYR L 87 -28.486 -18.684 -83.559 1.00 71.48 C
-ANISOU 2227 CA TYR L 87 13035 7040 7084 1309 -1982 -1426 C
-ATOM 2228 C TYR L 87 -28.551 -19.201 -84.992 1.00 80.24 C
-ANISOU 2228 C TYR L 87 14062 8173 8252 1384 -2093 -1389 C
-ATOM 2229 O TYR L 87 -27.634 -19.873 -85.475 1.00 63.09 O
-ANISOU 2229 O TYR L 87 11927 5995 6048 1363 -2164 -1348 O
-ATOM 2230 CB TYR L 87 -27.880 -17.272 -83.536 1.00 64.11 C
-ANISOU 2230 CB TYR L 87 12251 6016 6093 1321 -1935 -1445 C
-ATOM 2231 CG TYR L 87 -28.158 -16.514 -82.257 1.00 64.28 C
-ANISOU 2231 CG TYR L 87 12428 5964 6032 1251 -1776 -1510 C
-ATOM 2232 CD1 TYR L 87 -29.357 -15.837 -82.082 1.00 62.07 C
-ANISOU 2232 CD1 TYR L 87 12152 5621 5812 1405 -1610 -1559 C
-ATOM 2233 CD2 TYR L 87 -27.228 -16.476 -81.226 1.00 69.74 C
-ANISOU 2233 CD2 TYR L 87 13268 6662 6569 1030 -1779 -1505 C
-ATOM 2234 CE1 TYR L 87 -29.625 -15.145 -80.923 1.00 62.05 C
-ANISOU 2234 CE1 TYR L 87 12348 5515 5715 1360 -1412 -1633 C
-ATOM 2235 CE2 TYR L 87 -27.488 -15.784 -80.058 1.00 73.35 C
-ANISOU 2235 CE2 TYR L 87 13933 7031 6907 919 -1619 -1582 C
-ATOM 2236 CZ TYR L 87 -28.689 -15.120 -79.912 1.00 73.43 C
-ANISOU 2236 CZ TYR L 87 13995 6929 6975 1094 -1417 -1662 C
-ATOM 2237 OH TYR L 87 -28.955 -14.428 -78.750 1.00 75.03 O
-ANISOU 2237 OH TYR L 87 14461 7007 7041 1004 -1205 -1751 O
-ATOM 2238 N CYS L 88 -29.650 -18.874 -85.670 1.00 93.69 N
-ANISOU 2238 N CYS L 88 15655 9915 10027 1474 -2094 -1385 N
-ATOM 2239 CA CYS L 88 -29.895 -19.268 -87.053 1.00 65.84 C
-ANISOU 2239 CA CYS L 88 12066 6429 6521 1493 -2208 -1346 C
-ATOM 2240 C CYS L 88 -29.911 -18.012 -87.915 1.00 57.79 C
-ANISOU 2240 C CYS L 88 11044 5377 5537 1629 -2224 -1315 C
-ATOM 2241 O CYS L 88 -30.762 -17.139 -87.721 1.00 72.84 O
-ANISOU 2241 O CYS L 88 12876 7300 7502 1752 -2149 -1289 O
-ATOM 2242 CB CYS L 88 -31.218 -20.026 -87.174 1.00 63.60 C
-ANISOU 2242 CB CYS L 88 11629 6279 6257 1420 -2239 -1316 C
-ATOM 2243 SG CYS L 88 -31.741 -20.368 -88.862 1.00130.04 S
-ANISOU 2243 SG CYS L 88 19982 14781 14646 1364 -2397 -1250 S
-ATOM 2244 N GLN L 89 -28.972 -17.919 -88.856 1.00 63.90 N
-ANISOU 2244 N GLN L 89 11908 6101 6270 1626 -2300 -1304 N
-ATOM 2245 CA GLN L 89 -28.858 -16.764 -89.737 1.00 75.32 C
-ANISOU 2245 CA GLN L 89 13390 7502 7727 1726 -2328 -1267 C
-ATOM 2246 C GLN L 89 -29.090 -17.169 -91.187 1.00 80.42 C
-ANISOU 2246 C GLN L 89 13993 8208 8356 1704 -2455 -1219 C
-ATOM 2247 O GLN L 89 -28.785 -18.295 -91.590 1.00 91.93 O
-ANISOU 2247 O GLN L 89 15491 9682 9756 1597 -2500 -1240 O
-ATOM 2248 CB GLN L 89 -27.481 -16.102 -89.612 1.00 74.20 C
-ANISOU 2248 CB GLN L 89 13410 7270 7513 1691 -2306 -1284 C
-ATOM 2249 CG GLN L 89 -27.333 -14.820 -90.416 1.00 62.97 C
-ANISOU 2249 CG GLN L 89 12079 5769 6077 1765 -2322 -1249 C
-ATOM 2250 CD GLN L 89 -25.991 -14.704 -91.112 1.00 69.56 C
-ANISOU 2250 CD GLN L 89 13005 6604 6820 1678 -2379 -1230 C
-ATOM 2251 OE1 GLN L 89 -25.080 -15.497 -90.876 1.00 84.41 O
-ANISOU 2251 OE1 GLN L 89 14866 8553 8653 1594 -2384 -1226 O
-ATOM 2252 NE2 GLN L 89 -25.864 -13.710 -91.977 1.00 74.00 N
-ANISOU 2252 NE2 GLN L 89 13657 7104 7355 1712 -2412 -1193 N
-ATOM 2253 N GLN L 90 -29.640 -16.241 -91.968 1.00 78.44 N
-ANISOU 2253 N GLN L 90 13695 7973 8135 1805 -2500 -1145 N
-ATOM 2254 CA GLN L 90 -29.745 -16.388 -93.413 1.00 78.54 C
-ANISOU 2254 CA GLN L 90 13701 8042 8098 1756 -2634 -1085 C
-ATOM 2255 C GLN L 90 -28.631 -15.612 -94.107 1.00 83.67 C
-ANISOU 2255 C GLN L 90 14514 8585 8693 1779 -2645 -1090 C
-ATOM 2256 O GLN L 90 -28.049 -14.674 -93.555 1.00 88.25 O
-ANISOU 2256 O GLN L 90 15192 9059 9280 1842 -2566 -1108 O
-ATOM 2257 CB GLN L 90 -31.094 -15.888 -93.929 1.00 61.76 C
-ANISOU 2257 CB GLN L 90 11384 6056 6028 1840 -2707 -945 C
-ATOM 2258 CG GLN L 90 -31.164 -14.377 -93.989 1.00 85.31 C
-ANISOU 2258 CG GLN L 90 14397 8944 9073 2062 -2650 -869 C
-ATOM 2259 CD GLN L 90 -32.245 -13.872 -94.908 1.00 95.88 C
-ANISOU 2259 CD GLN L 90 15552 10432 10447 2169 -2756 -673 C
-ATOM 2260 OE1 GLN L 90 -33.046 -14.648 -95.425 1.00111.09 O
-ANISOU 2260 OE1 GLN L 90 17286 12581 12341 2038 -2888 -584 O
-ATOM 2261 NE2 GLN L 90 -32.276 -12.562 -95.120 1.00 91.73 N
-ANISOU 2261 NE2 GLN L 90 15100 9789 9966 2389 -2703 -583 N
-ATOM 2262 N ALA L 91 -28.347 -16.014 -95.343 1.00 74.55 N
-ANISOU 2262 N ALA L 91 13415 7458 7452 1689 -2739 -1073 N
-ATOM 2263 CA ALA L 91 -27.385 -15.310 -96.180 1.00 78.16 C
-ANISOU 2263 CA ALA L 91 14008 7851 7840 1690 -2756 -1061 C
-ATOM 2264 C ALA L 91 -27.941 -15.089 -97.579 1.00 84.21 C
-ANISOU 2264 C ALA L 91 14771 8677 8547 1650 -2891 -973 C
-ATOM 2265 O ALA L 91 -27.177 -14.860 -98.521 1.00 80.13 O
-ANISOU 2265 O ALA L 91 14382 8129 7934 1595 -2917 -970 O
-ATOM 2266 CB ALA L 91 -26.060 -16.072 -96.245 1.00 71.15 C
-ANISOU 2266 CB ALA L 91 13225 6938 6869 1616 -2689 -1128 C
-ATOM 2267 N ASN L 92 -29.263 -15.138 -97.723 1.00 90.07 N
-ANISOU 2267 N ASN L 92 15351 9540 9333 1663 -2981 -877 N
-ATOM 2268 CA ASN L 92 -29.906 -15.189 -99.027 1.00 84.32 C
-ANISOU 2268 CA ASN L 92 14587 8934 8516 1558 -3146 -762 C
-ATOM 2269 C ASN L 92 -30.294 -13.813 -99.549 1.00 79.20 C
-ANISOU 2269 C ASN L 92 13891 8291 7913 1718 -3212 -600 C
-ATOM 2270 O ASN L 92 -30.151 -13.552-100.746 1.00 64.86 O
-ANISOU 2270 O ASN L 92 12155 6501 5989 1631 -3328 -527 O
-ATOM 2271 CB ASN L 92 -31.143 -16.087 -98.950 1.00 85.08 C
-ANISOU 2271 CB ASN L 92 14500 9228 8599 1426 -3237 -697 C
-ATOM 2272 CG ASN L 92 -31.887 -16.168-100.257 1.00 87.63 C
-ANISOU 2272 CG ASN L 92 14768 9735 8793 1249 -3441 -545 C
-ATOM 2273 OD1 ASN L 92 -33.104 -16.336-100.282 1.00 93.28 O
-ANISOU 2273 OD1 ASN L 92 15239 10689 9514 1182 -3558 -387 O
-ATOM 2274 ND2 ASN L 92 -31.159 -16.061-101.357 1.00100.55 N
-ANISOU 2274 ND2 ASN L 92 16619 11294 10293 1145 -3489 -572 N
-ATOM 2275 N SER L 93 -30.786 -12.929 -98.684 1.00 84.14 N
-ANISOU 2275 N SER L 93 14419 8870 8679 1957 -3122 -535 N
-ATOM 2276 CA SER L 93 -31.289 -11.643 -99.143 1.00 84.27 C
-ANISOU 2276 CA SER L 93 14411 8861 8745 2165 -3154 -348 C
-ATOM 2277 C SER L 93 -31.108 -10.600 -98.054 1.00 76.62 C
-ANISOU 2277 C SER L 93 13562 7670 7879 2409 -2950 -384 C
-ATOM 2278 O SER L 93 -30.893 -10.923 -96.884 1.00 90.78 O
-ANISOU 2278 O SER L 93 15376 9400 9716 2409 -2809 -522 O
-ATOM 2279 CB SER L 93 -32.768 -11.727 -99.538 1.00 96.38 C
-ANISOU 2279 CB SER L 93 15625 10668 10327 2232 -3283 -107 C
-ATOM 2280 OG SER L 93 -33.580 -12.055 -98.424 1.00 98.24 O
-ANISOU 2280 OG SER L 93 15640 11005 10680 2344 -3176 -95 O
-ATOM 2281 N PHE L 94 -31.204 -9.339 -98.459 1.00 78.66 N
-ANISOU 2281 N PHE L 94 13942 7793 8153 2600 -2930 -253 N
-ATOM 2282 CA PHE L 94 -31.251 -8.231 -97.519 1.00 70.89 C
-ANISOU 2282 CA PHE L 94 13137 6558 7239 2851 -2711 -257 C
-ATOM 2283 C PHE L 94 -32.713 -7.851 -97.283 1.00 90.65 C
-ANISOU 2283 C PHE L 94 15386 9167 9889 3192 -2642 -36 C
-ATOM 2284 O PHE L 94 -33.519 -7.863 -98.215 1.00109.72 O
-ANISOU 2284 O PHE L 94 17558 11803 12328 3265 -2803 199 O
-ATOM 2285 CB PHE L 94 -30.458 -7.027 -98.033 1.00 70.28 C
-ANISOU 2285 CB PHE L 94 13417 6215 7070 2866 -2687 -241 C
-ATOM 2286 CG PHE L 94 -28.968 -7.249 -98.090 1.00 67.82 C
-ANISOU 2286 CG PHE L 94 13333 5826 6611 2549 -2711 -432 C
-ATOM 2287 CD1 PHE L 94 -28.389 -8.371 -97.519 1.00 65.40 C
-ANISOU 2287 CD1 PHE L 94 12928 5638 6283 2346 -2708 -599 C
-ATOM 2288 CD2 PHE L 94 -28.142 -6.316 -98.695 1.00 68.35 C
-ANISOU 2288 CD2 PHE L 94 13700 5716 6554 2464 -2726 -416 C
-ATOM 2289 CE1 PHE L 94 -27.020 -8.566 -97.567 1.00 63.72 C
-ANISOU 2289 CE1 PHE L 94 12864 5405 5943 2100 -2715 -719 C
-ATOM 2290 CE2 PHE L 94 -26.775 -6.503 -98.745 1.00 66.58 C
-ANISOU 2290 CE2 PHE L 94 13625 5485 6187 2170 -2742 -551 C
-ATOM 2291 CZ PHE L 94 -26.213 -7.629 -98.180 1.00 64.85 C
-ANISOU 2291 CZ PHE L 94 13257 5422 5963 2006 -2733 -690 C
-ATOM 2292 N PRO L 95 -33.068 -7.513 -96.034 1.00 86.33 N
-ANISOU 2292 N PRO L 95 14885 8490 9428 3398 -2395 -88 N
-ATOM 2293 CA PRO L 95 -32.175 -7.436 -94.874 1.00 71.74 C
-ANISOU 2293 CA PRO L 95 13340 6398 7521 3278 -2213 -340 C
-ATOM 2294 C PRO L 95 -31.813 -8.800 -94.293 1.00 78.33 C
-ANISOU 2294 C PRO L 95 14022 7408 8331 2995 -2274 -515 C
-ATOM 2295 O PRO L 95 -32.653 -9.701 -94.245 1.00100.01 O
-ANISOU 2295 O PRO L 95 16436 10418 11146 2989 -2340 -455 O
-ATOM 2296 CB PRO L 95 -32.992 -6.627 -93.873 1.00 74.55 C
-ANISOU 2296 CB PRO L 95 13769 6587 7969 3632 -1919 -285 C
-ATOM 2297 CG PRO L 95 -34.400 -6.972 -94.201 1.00 76.78 C
-ANISOU 2297 CG PRO L 95 13584 7193 8397 3875 -1968 -37 C
-ATOM 2298 CD PRO L 95 -34.449 -7.133 -95.687 1.00 76.87 C
-ANISOU 2298 CD PRO L 95 13426 7402 8377 3779 -2263 136 C
-ATOM 2299 N ILE L 96 -30.556 -8.942 -93.872 1.00 66.74 N
-ANISOU 2299 N ILE L 96 12799 5808 6752 2752 -2256 -705 N
-ATOM 2300 CA ILE L 96 -30.102 -10.169 -93.230 1.00 64.43 C
-ANISOU 2300 CA ILE L 96 12403 5643 6433 2524 -2287 -848 C
-ATOM 2301 C ILE L 96 -30.808 -10.330 -91.892 1.00 69.88 C
-ANISOU 2301 C ILE L 96 13026 6333 7194 2626 -2107 -894 C
-ATOM 2302 O ILE L 96 -30.906 -9.380 -91.104 1.00 91.19 O
-ANISOU 2302 O ILE L 96 15945 8819 9884 2763 -1903 -921 O
-ATOM 2303 CB ILE L 96 -28.577 -10.147 -93.059 1.00 62.65 C
-ANISOU 2303 CB ILE L 96 12418 5315 6071 2277 -2299 -977 C
-ATOM 2304 CG1 ILE L 96 -27.887 -10.377 -94.405 1.00 75.95 C
-ANISOU 2304 CG1 ILE L 96 14096 7078 7684 2150 -2471 -939 C
-ATOM 2305 CG2 ILE L 96 -28.132 -11.163 -92.022 1.00 61.02 C
-ANISOU 2305 CG2 ILE L 96 12149 5192 5845 2115 -2266 -1093 C
-ATOM 2306 CD1 ILE L 96 -26.384 -10.231 -94.341 1.00 84.92 C
-ANISOU 2306 CD1 ILE L 96 15418 8166 8682 1932 -2472 -1012 C
-ATOM 2307 N THR L 97 -31.314 -11.531 -91.628 1.00 64.35 N
-ANISOU 2307 N THR L 97 12061 5851 6539 2544 -2166 -906 N
-ATOM 2308 CA THR L 97 -32.107 -11.778 -90.434 1.00 73.62 C
-ANISOU 2308 CA THR L 97 13124 7072 7775 2627 -2004 -930 C
-ATOM 2309 C THR L 97 -31.600 -13.016 -89.713 1.00 71.37 C
-ANISOU 2309 C THR L 97 12811 6867 7439 2373 -2042 -1061 C
-ATOM 2310 O THR L 97 -31.226 -14.010 -90.344 1.00 68.88 O
-ANISOU 2310 O THR L 97 12419 6665 7088 2197 -2209 -1072 O
-ATOM 2311 CB THR L 97 -33.595 -11.949 -90.773 1.00 67.48 C
-ANISOU 2311 CB THR L 97 11990 6538 7112 2813 -2020 -744 C
-ATOM 2312 OG1 THR L 97 -33.750 -12.950 -91.785 1.00 66.73 O
-ANISOU 2312 OG1 THR L 97 11687 6678 6990 2618 -2267 -680 O
-ATOM 2313 CG2 THR L 97 -34.176 -10.637 -91.278 1.00 70.27 C
-ANISOU 2313 CG2 THR L 97 12363 6803 7534 3149 -1932 -570 C
-ATOM 2314 N PHE L 98 -31.593 -12.943 -88.384 1.00 83.89 N
-ANISOU 2314 N PHE L 98 14496 8373 9007 2362 -1869 -1152 N
-ATOM 2315 CA PHE L 98 -31.211 -14.048 -87.524 1.00 61.86 C
-ANISOU 2315 CA PHE L 98 11683 5651 6168 2148 -1885 -1248 C
-ATOM 2316 C PHE L 98 -32.457 -14.680 -86.907 1.00 63.03 C
-ANISOU 2316 C PHE L 98 11591 5971 6387 2193 -1812 -1213 C
-ATOM 2317 O PHE L 98 -33.587 -14.244 -87.132 1.00 67.78 O
-ANISOU 2317 O PHE L 98 12007 6671 7077 2400 -1743 -1099 O
-ATOM 2318 CB PHE L 98 -30.265 -13.576 -86.419 1.00 61.74 C
-ANISOU 2318 CB PHE L 98 11953 5464 6040 2029 -1768 -1358 C
-ATOM 2319 CG PHE L 98 -28.941 -13.065 -86.910 1.00 60.59 C
-ANISOU 2319 CG PHE L 98 12014 5214 5792 1907 -1854 -1373 C
-ATOM 2320 CD1 PHE L 98 -28.799 -11.749 -87.316 1.00 61.83 C
-ANISOU 2320 CD1 PHE L 98 12388 5193 5913 1999 -1790 -1357 C
-ATOM 2321 CD2 PHE L 98 -27.828 -13.886 -86.921 1.00 60.91 C
-ANISOU 2321 CD2 PHE L 98 12039 5342 5761 1705 -1979 -1383 C
-ATOM 2322 CE1 PHE L 98 -27.576 -11.271 -87.749 1.00 61.26 C
-ANISOU 2322 CE1 PHE L 98 12501 5055 5721 1836 -1873 -1359 C
-ATOM 2323 CE2 PHE L 98 -26.602 -13.413 -87.351 1.00 58.46 C
-ANISOU 2323 CE2 PHE L 98 11865 4998 5349 1585 -2048 -1364 C
-ATOM 2324 CZ PHE L 98 -26.477 -12.105 -87.766 1.00 74.75 C
-ANISOU 2324 CZ PHE L 98 14133 6907 7361 1622 -2005 -1358 C
-ATOM 2325 N GLY L 99 -32.239 -15.721 -86.105 1.00 61.98 N
-ANISOU 2325 N GLY L 99 11447 5895 6206 2000 -1823 -1286 N
-ATOM 2326 CA GLY L 99 -33.297 -16.302 -85.308 1.00 70.12 C
-ANISOU 2326 CA GLY L 99 12295 7077 7270 1989 -1732 -1270 C
-ATOM 2327 C GLY L 99 -33.362 -15.680 -83.925 1.00 82.32 C
-ANISOU 2327 C GLY L 99 13997 8502 8777 2038 -1490 -1351 C
-ATOM 2328 O GLY L 99 -32.579 -14.802 -83.562 1.00 98.97 O
-ANISOU 2328 O GLY L 99 16391 10400 10815 2046 -1401 -1424 O
-ATOM 2329 N GLN L 100 -34.329 -16.150 -83.139 1.00 84.30 N
-ANISOU 2329 N GLN L 100 14082 8899 9050 2034 -1375 -1337 N
-ATOM 2330 CA GLN L 100 -34.479 -15.664 -81.773 1.00 88.04 C
-ANISOU 2330 CA GLN L 100 14723 9267 9463 2059 -1116 -1423 C
-ATOM 2331 C GLN L 100 -33.536 -16.355 -80.795 1.00 86.53 C
-ANISOU 2331 C GLN L 100 14734 9009 9135 1761 -1162 -1534 C
-ATOM 2332 O GLN L 100 -33.552 -16.026 -79.604 1.00100.75 O
-ANISOU 2332 O GLN L 100 16717 10721 10841 1707 -967 -1615 O
-ATOM 2333 CB GLN L 100 -35.929 -15.827 -81.302 1.00 96.88 C
-ANISOU 2333 CB GLN L 100 15559 10599 10652 2192 -941 -1342 C
-ATOM 2334 CG GLN L 100 -36.304 -17.231 -80.846 1.00112.60 C
-ANISOU 2334 CG GLN L 100 17364 12811 12608 1929 -1040 -1337 C
-ATOM 2335 CD GLN L 100 -36.628 -18.167 -81.994 1.00127.76 C
-ANISOU 2335 CD GLN L 100 19025 14947 14571 1811 -1307 -1225 C
-ATOM 2336 OE1 GLN L 100 -36.490 -17.811 -83.166 1.00132.09 O
-ANISOU 2336 OE1 GLN L 100 19523 15491 15173 1911 -1441 -1154 O
-ATOM 2337 NE2 GLN L 100 -37.065 -19.376 -81.659 1.00129.69 N
-ANISOU 2337 NE2 GLN L 100 19144 15369 14764 1562 -1383 -1210 N
-ATOM 2338 N GLY L 101 -32.720 -17.292 -81.264 1.00 78.20 N
-ANISOU 2338 N GLY L 101 13665 7993 8056 1578 -1397 -1524 N
-ATOM 2339 CA GLY L 101 -31.776 -17.990 -80.420 1.00 66.56 C
-ANISOU 2339 CA GLY L 101 12342 6484 6463 1336 -1458 -1570 C
-ATOM 2340 C GLY L 101 -32.374 -19.225 -79.768 1.00 70.58 C
-ANISOU 2340 C GLY L 101 12729 7130 6958 1192 -1468 -1557 C
-ATOM 2341 O GLY L 101 -33.586 -19.434 -79.743 1.00 73.23 O
-ANISOU 2341 O GLY L 101 12868 7603 7353 1245 -1391 -1529 O
-ATOM 2342 N THR L 102 -31.485 -20.060 -79.233 1.00 80.74 N
-ANISOU 2342 N THR L 102 14127 8397 8155 1001 -1567 -1552 N
-ATOM 2343 CA THR L 102 -31.869 -21.261 -78.498 1.00 78.67 C
-ANISOU 2343 CA THR L 102 13827 8218 7846 832 -1579 -1535 C
-ATOM 2344 C THR L 102 -30.872 -21.471 -77.371 1.00 83.24 C
-ANISOU 2344 C THR L 102 14596 8745 8288 657 -1591 -1529 C
-ATOM 2345 O THR L 102 -29.685 -21.695 -77.626 1.00 88.10 O
-ANISOU 2345 O THR L 102 15280 9322 8870 631 -1722 -1462 O
-ATOM 2346 CB THR L 102 -31.912 -22.493 -79.411 1.00 72.37 C
-ANISOU 2346 CB THR L 102 12951 7457 7088 791 -1743 -1473 C
-ATOM 2347 OG1 THR L 102 -32.945 -22.334 -80.392 1.00 71.46 O
-ANISOU 2347 OG1 THR L 102 12646 7445 7061 879 -1755 -1455 O
-ATOM 2348 CG2 THR L 102 -32.175 -23.752 -78.603 1.00 69.98 C
-ANISOU 2348 CG2 THR L 102 12691 7190 6708 591 -1754 -1450 C
-ATOM 2349 N ARG L 103 -31.346 -21.388 -76.131 1.00 79.58 N
-ANISOU 2349 N ARG L 103 14199 8306 7731 534 -1449 -1576 N
-ATOM 2350 CA ARG L 103 -30.490 -21.633 -74.979 1.00 79.02 C
-ANISOU 2350 CA ARG L 103 14305 8221 7497 316 -1477 -1547 C
-ATOM 2351 C ARG L 103 -30.384 -23.128 -74.717 1.00 74.26 C
-ANISOU 2351 C ARG L 103 13669 7670 6875 196 -1598 -1451 C
-ATOM 2352 O ARG L 103 -31.399 -23.821 -74.595 1.00 73.15 O
-ANISOU 2352 O ARG L 103 13446 7586 6761 155 -1549 -1469 O
-ATOM 2353 CB ARG L 103 -31.028 -20.918 -73.741 1.00 94.12 C
-ANISOU 2353 CB ARG L 103 16364 10116 9280 205 -1256 -1645 C
-ATOM 2354 CG ARG L 103 -30.622 -19.461 -73.639 1.00113.37 C
-ANISOU 2354 CG ARG L 103 19013 12427 11637 230 -1137 -1724 C
-ATOM 2355 CD ARG L 103 -31.045 -18.849 -72.307 1.00124.43 C
-ANISOU 2355 CD ARG L 103 20657 13767 12855 81 -888 -1831 C
-ATOM 2356 NE ARG L 103 -30.442 -19.518 -71.155 1.00123.46 N
-ANISOU 2356 NE ARG L 103 20662 13713 12536 -249 -974 -1779 N
-ATOM 2357 CZ ARG L 103 -31.086 -20.365 -70.356 1.00117.00 C
-ANISOU 2357 CZ ARG L 103 19793 12984 11677 -362 -919 -1775 C
-ATOM 2358 NH1 ARG L 103 -32.363 -20.650 -70.577 1.00112.23 N
-ANISOU 2358 NH1 ARG L 103 18992 12440 11210 -192 -775 -1817 N
-ATOM 2359 NH2 ARG L 103 -30.455 -20.924 -69.330 1.00108.59 N
-ANISOU 2359 NH2 ARG L 103 18862 11979 10420 -667 -1018 -1703 N
-ATOM 2360 N LEU L 104 -29.153 -23.623 -74.637 1.00 72.52 N
-ANISOU 2360 N LEU L 104 13515 7440 6598 143 -1747 -1327 N
-ATOM 2361 CA LEU L 104 -28.875 -25.010 -74.297 1.00 71.78 C
-ANISOU 2361 CA LEU L 104 13452 7352 6470 65 -1843 -1203 C
-ATOM 2362 C LEU L 104 -28.308 -25.061 -72.885 1.00 78.53 C
-ANISOU 2362 C LEU L 104 14424 8268 7146 -158 -1857 -1121 C
-ATOM 2363 O LEU L 104 -27.354 -24.342 -72.571 1.00 84.80 O
-ANISOU 2363 O LEU L 104 15263 9113 7845 -229 -1907 -1062 O
-ATOM 2364 CB LEU L 104 -27.896 -25.632 -75.293 1.00 71.70 C
-ANISOU 2364 CB LEU L 104 13418 7293 6532 232 -1974 -1072 C
-ATOM 2365 CG LEU L 104 -27.864 -27.159 -75.300 1.00 69.36 C
-ANISOU 2365 CG LEU L 104 13203 6921 6232 238 -2021 -962 C
-ATOM 2366 CD1 LEU L 104 -29.225 -27.703 -75.683 1.00 63.59 C
-ANISOU 2366 CD1 LEU L 104 12479 6144 5539 178 -1963 -1080 C
-ATOM 2367 CD2 LEU L 104 -26.789 -27.671 -76.242 1.00 76.32 C
-ANISOU 2367 CD2 LEU L 104 14096 7731 7171 456 -2090 -824 C
-ATOM 2368 N GLU L 105 -28.894 -25.909 -72.042 1.00 77.23 N
-ANISOU 2368 N GLU L 105 14318 8117 6910 -311 -1824 -1106 N
-ATOM 2369 CA GLU L 105 -28.599 -25.942 -70.616 1.00 74.09 C
-ANISOU 2369 CA GLU L 105 14047 7788 6316 -567 -1821 -1045 C
-ATOM 2370 C GLU L 105 -28.376 -27.379 -70.163 1.00 83.20 C
-ANISOU 2370 C GLU L 105 15257 8931 7424 -637 -1922 -871 C
-ATOM 2371 O GLU L 105 -29.017 -28.305 -70.669 1.00 81.47 O
-ANISOU 2371 O GLU L 105 15036 8629 7290 -568 -1911 -884 O
-ATOM 2372 CB GLU L 105 -29.742 -25.282 -69.820 1.00 74.23 C
-ANISOU 2372 CB GLU L 105 14125 7825 6252 -712 -1609 -1231 C
-ATOM 2373 CG GLU L 105 -30.039 -25.901 -68.462 1.00 93.70 C
-ANISOU 2373 CG GLU L 105 16718 10345 8538 -988 -1571 -1196 C
-ATOM 2374 CD GLU L 105 -31.273 -25.305 -67.810 1.00114.68 C
-ANISOU 2374 CD GLU L 105 19412 13028 11133 -1078 -1309 -1383 C
-ATOM 2375 OE1 GLU L 105 -31.656 -24.174 -68.180 1.00116.96 O
-ANISOU 2375 OE1 GLU L 105 19682 13281 11478 -935 -1148 -1523 O
-ATOM 2376 OE2 GLU L 105 -31.868 -25.972 -66.936 1.00124.11 O1-
-ANISOU 2376 OE2 GLU L 105 20659 14276 12220 -1272 -1246 -1377 O1-
-ATOM 2377 N ILE L 106 -27.456 -27.564 -69.214 1.00 95.30 N
-ANISOU 2377 N ILE L 106 16862 10547 8799 -793 -2025 -688 N
-ATOM 2378 CA ILE L 106 -27.118 -28.896 -68.722 1.00 92.06 C
-ANISOU 2378 CA ILE L 106 16525 10119 8337 -828 -2123 -472 C
-ATOM 2379 C ILE L 106 -28.196 -29.374 -67.760 1.00 89.79 C
-ANISOU 2379 C ILE L 106 16362 9818 7936 -1075 -2025 -563 C
-ATOM 2380 O ILE L 106 -28.681 -28.613 -66.913 1.00 80.72 O
-ANISOU 2380 O ILE L 106 15264 8749 6656 -1298 -1918 -695 O
-ATOM 2381 CB ILE L 106 -25.736 -28.892 -68.044 1.00 82.45 C
-ANISOU 2381 CB ILE L 106 15288 9055 6982 -905 -2287 -187 C
-ATOM 2382 CG1 ILE L 106 -24.752 -28.027 -68.831 1.00 92.31 C
-ANISOU 2382 CG1 ILE L 106 16385 10396 8292 -757 -2359 -130 C
-ATOM 2383 CG2 ILE L 106 -25.205 -30.309 -67.935 1.00 71.69 C
-ANISOU 2383 CG2 ILE L 106 13965 7641 5633 -776 -2384 97 C
-ATOM 2384 N LYS L 107 -28.571 -30.644 -67.883 1.00 93.08 N
-ANISOU 2384 N LYS L 107 16863 10119 8383 -1048 -2041 -491 N
-ATOM 2385 CA LYS L 107 -29.554 -31.261 -67.003 1.00 84.62 C
-ANISOU 2385 CA LYS L 107 15915 9046 7191 -1309 -1964 -544 C
-ATOM 2386 C LYS L 107 -28.836 -31.990 -65.875 1.00 95.43 C
-ANISOU 2386 C LYS L 107 17432 10441 8385 -1469 -2078 -294 C
-ATOM 2387 O LYS L 107 -27.922 -32.782 -66.125 1.00110.30 O
-ANISOU 2387 O LYS L 107 19361 12245 10303 -1290 -2201 -47 O
-ATOM 2388 CB LYS L 107 -30.456 -32.232 -67.771 1.00 72.10 C
-ANISOU 2388 CB LYS L 107 14382 7321 5692 -1269 -1921 -607 C
-ATOM 2389 N ARG L 108 -29.249 -31.713 -64.639 1.00 86.08 N
-ANISOU 2389 N ARG L 108 16328 9372 7007 -1788 -2020 -342 N
-ATOM 2390 CA ARG L 108 -28.719 -32.384 -63.462 1.00 84.68 C
-ANISOU 2390 CA ARG L 108 16302 9245 6629 -2003 -2132 -104 C
-ATOM 2391 C ARG L 108 -29.886 -32.762 -62.558 1.00 84.44 C
-ANISOU 2391 C ARG L 108 16410 9224 6447 -2320 -2001 -227 C
-ATOM 2392 O ARG L 108 -31.053 -32.523 -62.884 1.00 81.17 O
-ANISOU 2392 O ARG L 108 15937 8806 6097 -2347 -1826 -470 O
-ATOM 2393 CB ARG L 108 -27.713 -31.498 -62.720 1.00 90.03 C
-ANISOU 2393 CB ARG L 108 16950 10114 7142 -2153 -2234 16 C
-ATOM 2394 CG ARG L 108 -28.352 -30.371 -61.922 1.00 91.95 C
-ANISOU 2394 CG ARG L 108 17271 10456 7211 -2457 -2069 -233 C
-ATOM 2395 CD ARG L 108 -27.317 -29.614 -61.113 1.00 99.57 C
-ANISOU 2395 CD ARG L 108 18293 11597 7940 -2707 -2191 -94 C
-ATOM 2396 NE ARG L 108 -26.595 -30.472 -60.178 1.00101.96 N
-ANISOU 2396 NE ARG L 108 18668 12015 8057 -2902 -2396 245 N
-ATOM 2397 CZ ARG L 108 -26.885 -30.580 -58.887 1.00107.72 C
-ANISOU 2397 CZ ARG L 108 19598 12824 8507 -3299 -2375 260 C
-ATOM 2398 NH1 ARG L 108 -27.882 -29.876 -58.371 1.00105.61 N1+
-ANISOU 2398 NH1 ARG L 108 19488 12524 8116 -3526 -2125 -58 N1+
-ATOM 2399 NH2 ARG L 108 -26.174 -31.386 -58.110 1.00125.52 N
-ANISOU 2399 NH2 ARG L 108 21898 15194 10599 -3452 -2588 613 N
-ATOM 2400 N THR L 109 -29.562 -33.362 -61.414 1.00 89.81 N
-ANISOU 2400 N THR L 109 17255 9951 6918 -2565 -2090 -30 N
-ATOM 2401 CA THR L 109 -30.575 -33.706 -60.424 1.00 87.80 C
-ANISOU 2401 CA THR L 109 17149 9732 6480 -2911 -1967 -126 C
-ATOM 2402 C THR L 109 -31.145 -32.441 -59.795 1.00 85.08 C
-ANISOU 2402 C THR L 109 16780 9538 6009 -3121 -1770 -377 C
-ATOM 2403 O THR L 109 -30.435 -31.448 -59.613 1.00 89.30 O
-ANISOU 2403 O THR L 109 17299 10153 6478 -3137 -1797 -385 O
-ATOM 2404 CB THR L 109 -29.973 -34.608 -59.344 1.00112.04 C
-ANISOU 2404 CB THR L 109 20418 12815 9337 -3123 -2128 177 C
-ATOM 2405 OG1 THR L 109 -29.371 -35.755 -59.956 1.00115.56 O
-ANISOU 2405 OG1 THR L 109 20925 13077 9906 -2854 -2272 434 O
-ATOM 2406 CG2 THR L 109 -31.035 -35.069 -58.354 1.00128.16 C
-ANISOU 2406 CG2 THR L 109 22635 14884 11177 -3500 -2001 86 C
-ATOM 2407 N VAL L 110 -32.442 -32.476 -59.476 1.00 86.38 N
-ANISOU 2407 N VAL L 110 16957 9739 6125 -3286 -1549 -576 N
-ATOM 2408 CA VAL L 110 -33.077 -31.337 -58.824 1.00 99.35 C
-ANISOU 2408 CA VAL L 110 18615 11496 7637 -3444 -1289 -811 C
-ATOM 2409 C VAL L 110 -32.373 -31.041 -57.506 1.00 95.60 C
-ANISOU 2409 C VAL L 110 18379 11096 6847 -3783 -1343 -715 C
-ATOM 2410 O VAL L 110 -31.971 -31.954 -56.772 1.00 99.41 O
-ANISOU 2410 O VAL L 110 19005 11597 7168 -4002 -1514 -490 O
-ATOM 2411 CB VAL L 110 -34.575 -31.611 -58.608 1.00102.57 C
-ANISOU 2411 CB VAL L 110 18964 11980 8027 -3567 -1038 -973 C
-ATOM 2412 CG1 VAL L 110 -35.258 -30.397 -57.987 1.00 95.14 C
-ANISOU 2412 CG1 VAL L 110 18041 11141 6969 -3644 -701 -1209 C
-ATOM 2413 CG2 VAL L 110 -35.236 -31.993 -59.923 1.00 98.50 C
-ANISOU 2413 CG2 VAL L 110 18210 11434 7782 -3307 -1038 -1019 C
-ATOM 2414 N ALA L 111 -32.205 -29.752 -57.209 1.00 86.83 N
-ANISOU 2414 N ALA L 111 17345 10021 5626 -3845 -1200 -873 N
-ATOM 2415 CA ALA L 111 -31.504 -29.307 -56.009 1.00 97.55 C
-ANISOU 2415 CA ALA L 111 18970 11457 6636 -4229 -1250 -801 C
-ATOM 2416 C ALA L 111 -32.278 -28.157 -55.381 1.00 97.80 C
-ANISOU 2416 C ALA L 111 19184 11479 6496 -4382 -868 -1103 C
-ATOM 2417 O ALA L 111 -32.484 -27.123 -56.025 1.00 91.11 O
-ANISOU 2417 O ALA L 111 18302 10552 5763 -4151 -684 -1305 O
-ATOM 2418 CB ALA L 111 -30.072 -28.875 -56.336 1.00102.13 C
-ANISOU 2418 CB ALA L 111 19524 12074 7208 -4185 -1525 -610 C
-ATOM 2419 N ALA L 112 -32.692 -28.332 -54.129 1.00101.11 N
-ANISOU 2419 N ALA L 112 19762 11953 6703 -4721 -717 -1102 N
-ATOM 2420 CA ALA L 112 -33.474 -27.306 -53.458 1.00105.15 C
-ANISOU 2420 CA ALA L 112 20439 12427 7086 -4823 -290 -1364 C
-ATOM 2421 C ALA L 112 -32.612 -26.075 -53.182 1.00110.82 C
-ANISOU 2421 C ALA L 112 21294 13062 7750 -4907 -255 -1370 C
-ATOM 2422 O ALA L 112 -31.426 -26.206 -52.860 1.00107.59 O
-ANISOU 2422 O ALA L 112 20888 12708 7282 -5112 -560 -1117 O
-ATOM 2423 CB ALA L 112 -34.053 -27.844 -52.152 1.00119.20 C
-ANISOU 2423 CB ALA L 112 22374 14284 8633 -5195 -147 -1342 C
-ATOM 2424 N PRO L 113 -33.173 -24.873 -53.297 1.00115.71 N
-ANISOU 2424 N PRO L 113 22041 13553 8371 -4764 118 -1636 N
-ATOM 2425 CA PRO L 113 -32.387 -23.662 -53.039 1.00112.21 C
-ANISOU 2425 CA PRO L 113 21788 12990 7858 -4881 170 -1644 C
-ATOM 2426 C PRO L 113 -32.122 -23.464 -51.556 1.00110.29 C
-ANISOU 2426 C PRO L 113 21827 12746 7332 -5374 251 -1575 C
-ATOM 2427 O PRO L 113 -32.809 -24.011 -50.691 1.00107.31 O
-ANISOU 2427 O PRO L 113 21537 12422 6813 -5569 398 -1603 O
-ATOM 2428 CB PRO L 113 -33.275 -22.542 -53.591 1.00110.28 C
-ANISOU 2428 CB PRO L 113 21638 12568 7696 -4537 600 -1954 C
-ATOM 2429 CG PRO L 113 -34.661 -23.076 -53.448 1.00110.72 C
-ANISOU 2429 CG PRO L 113 21644 12694 7730 -4417 894 -2117 C
-ATOM 2430 CD PRO L 113 -34.550 -24.557 -53.717 1.00111.33 C
-ANISOU 2430 CD PRO L 113 21468 12959 7872 -4475 521 -1924 C
-ATOM 2431 N SER L 114 -31.096 -22.662 -51.270 1.00 99.95 N
-ANISOU 2431 N SER L 114 15842 11925 10209 -2652 -2060 -1319 N
-ATOM 2432 CA SER L 114 -30.816 -22.196 -49.915 1.00102.95 C
-ANISOU 2432 CA SER L 114 16331 12535 10249 -2543 -1789 -1070 C
-ATOM 2433 C SER L 114 -31.247 -20.736 -49.824 1.00107.84 C
-ANISOU 2433 C SER L 114 16533 13606 10835 -2541 -1706 -1225 C
-ATOM 2434 O SER L 114 -30.643 -19.865 -50.458 1.00122.81 O
-ANISOU 2434 O SER L 114 18299 15715 12646 -2315 -1888 -1442 O
-ATOM 2435 CB SER L 114 -29.338 -22.362 -49.569 1.00102.64 C
-ANISOU 2435 CB SER L 114 16648 12548 9801 -2118 -1935 -1024 C
-ATOM 2436 OG SER L 114 -28.973 -23.731 -49.544 1.00113.36 O
-ANISOU 2436 OG SER L 114 18437 13466 11170 -2073 -2001 -851 O
-ATOM 2437 N VAL L 115 -32.289 -20.471 -49.038 1.00 94.23 N
-ANISOU 2437 N VAL L 115 14604 12007 9192 -2792 -1402 -1112 N
-ATOM 2438 CA VAL L 115 -32.945 -19.166 -49.011 1.00 86.18 C
-ANISOU 2438 CA VAL L 115 13156 11368 8219 -2825 -1330 -1289 C
-ATOM 2439 C VAL L 115 -32.382 -18.336 -47.866 1.00 85.08 C
-ANISOU 2439 C VAL L 115 13015 11585 7728 -2594 -1171 -1226 C
-ATOM 2440 O VAL L 115 -32.395 -18.768 -46.707 1.00 98.93 O
-ANISOU 2440 O VAL L 115 14939 13386 9263 -2596 -932 -978 O
-ATOM 2441 CB VAL L 115 -34.470 -19.311 -48.880 1.00 89.44 C
-ANISOU 2441 CB VAL L 115 13259 11776 8949 -3225 -1117 -1307 C
-ATOM 2442 CG1 VAL L 115 -35.124 -17.941 -48.823 1.00 87.74 C
-ANISOU 2442 CG1 VAL L 115 12613 11973 8751 -3192 -1074 -1510 C
-ATOM 2443 CG2 VAL L 115 -35.027 -20.128 -50.035 1.00104.67 C
-ANISOU 2443 CG2 VAL L 115 15111 13390 11267 -3433 -1302 -1493 C
-ATOM 2444 N PHE L 116 -31.903 -17.136 -48.191 1.00 92.45 N
-ANISOU 2444 N PHE L 116 13749 12767 8611 -2376 -1281 -1465 N
-ATOM 2445 CA PHE L 116 -31.412 -16.176 -47.214 1.00 89.42 C
-ANISOU 2445 CA PHE L 116 13248 12740 7986 -2162 -1153 -1547 C
-ATOM 2446 C PHE L 116 -32.146 -14.857 -47.407 1.00 91.48 C
-ANISOU 2446 C PHE L 116 13093 13223 8441 -2212 -1092 -1756 C
-ATOM 2447 O PHE L 116 -32.741 -14.606 -48.457 1.00 96.82 O
-ANISOU 2447 O PHE L 116 13628 13788 9370 -2301 -1204 -1850 O
-ATOM 2448 CB PHE L 116 -29.895 -15.960 -47.344 1.00 78.51 C
-ANISOU 2448 CB PHE L 116 12026 11398 6405 -1825 -1314 -1709 C
-ATOM 2449 CG PHE L 116 -29.087 -17.225 -47.239 1.00 85.59 C
-ANISOU 2449 CG PHE L 116 13344 12089 7086 -1691 -1431 -1550 C
-ATOM 2450 CD1 PHE L 116 -28.591 -17.648 -46.019 1.00 89.75 C
-ANISOU 2450 CD1 PHE L 116 14080 12779 7241 -1468 -1332 -1423 C
-ATOM 2451 CD2 PHE L 116 -28.823 -17.991 -48.362 1.00 97.06 C
-ANISOU 2451 CD2 PHE L 116 14992 13207 8678 -1728 -1656 -1542 C
-ATOM 2452 CE1 PHE L 116 -27.847 -18.810 -45.920 1.00 97.89 C
-ANISOU 2452 CE1 PHE L 116 15543 13603 8049 -1274 -1450 -1265 C
-ATOM 2453 CE2 PHE L 116 -28.080 -19.155 -48.269 1.00 96.30 C
-ANISOU 2453 CE2 PHE L 116 15292 12896 8401 -1577 -1782 -1417 C
-ATOM 2454 CZ PHE L 116 -27.592 -19.564 -47.047 1.00 92.89 C
-ANISOU 2454 CZ PHE L 116 15101 12589 7604 -1344 -1677 -1265 C
-ATOM 2455 N ILE L 117 -32.108 -14.010 -46.382 1.00 88.82 N
-ANISOU 2455 N ILE L 117 12559 13221 7967 -2101 -930 -1854 N
-ATOM 2456 CA ILE L 117 -32.736 -12.694 -46.446 1.00 94.93 C
-ANISOU 2456 CA ILE L 117 12950 14192 8927 -2101 -867 -2075 C
-ATOM 2457 C ILE L 117 -31.859 -11.694 -45.703 1.00 98.98 C
-ANISOU 2457 C ILE L 117 13327 14960 9320 -1841 -802 -2324 C
-ATOM 2458 O ILE L 117 -31.384 -11.971 -44.596 1.00 96.52 O
-ANISOU 2458 O ILE L 117 13074 14886 8713 -1706 -723 -2315 O
-ATOM 2459 CB ILE L 117 -34.171 -12.709 -45.878 1.00100.20 C
-ANISOU 2459 CB ILE L 117 13364 15044 9664 -2343 -691 -2008 C
-ATOM 2460 CG1 ILE L 117 -34.796 -11.312 -45.954 1.00101.13 C
-ANISOU 2460 CG1 ILE L 117 13090 15370 9963 -2280 -664 -2272 C
-ATOM 2461 CG2 ILE L 117 -34.197 -13.257 -44.454 1.00101.71 C
-ANISOU 2461 CG2 ILE L 117 13631 15468 9546 -2357 -463 -1823 C
-ATOM 2462 CD1 ILE L 117 -36.293 -11.304 -45.738 1.00108.56 C
-ANISOU 2462 CD1 ILE L 117 13731 16487 11030 -2514 -553 -2287 C
-ATOM 2463 N PHE L 118 -31.629 -10.539 -46.323 1.00 99.85 N
-ANISOU 2463 N PHE L 118 13259 15015 9665 -1743 -824 -2564 N
-ATOM 2464 CA PHE L 118 -30.769 -9.504 -45.767 1.00 85.28 C
-ANISOU 2464 CA PHE L 118 11229 13334 7841 -1537 -743 -2894 C
-ATOM 2465 C PHE L 118 -31.561 -8.215 -45.606 1.00 84.16 C
-ANISOU 2465 C PHE L 118 10728 13302 7946 -1540 -624 -3091 C
-ATOM 2466 O PHE L 118 -32.127 -7.707 -46.593 1.00 89.12 O
-ANISOU 2466 O PHE L 118 11330 13707 8824 -1577 -647 -3049 O
-ATOM 2467 CB PHE L 118 -29.544 -9.267 -46.651 1.00 78.31 C
-ANISOU 2467 CB PHE L 118 10480 12197 7077 -1420 -806 -3034 C
-ATOM 2468 CG PHE L 118 -28.662 -10.471 -46.800 1.00 76.54 C
-ANISOU 2468 CG PHE L 118 10583 11893 6604 -1363 -955 -2915 C
-ATOM 2469 CD1 PHE L 118 -27.650 -10.718 -45.890 1.00 81.11 C
-ANISOU 2469 CD1 PHE L 118 11184 12708 6925 -1159 -970 -3110 C
-ATOM 2470 CD2 PHE L 118 -28.835 -11.349 -47.855 1.00 76.41 C
-ANISOU 2470 CD2 PHE L 118 10835 11593 6602 -1463 -1105 -2659 C
-ATOM 2471 CE1 PHE L 118 -26.834 -11.821 -46.023 1.00 88.08 C
-ANISOU 2471 CE1 PHE L 118 12385 13521 7560 -1046 -1130 -3016 C
-ATOM 2472 CE2 PHE L 118 -28.019 -12.456 -47.996 1.00 84.35 C
-ANISOU 2472 CE2 PHE L 118 12145 12506 7399 -1387 -1258 -2575 C
-ATOM 2473 CZ PHE L 118 -27.017 -12.692 -47.077 1.00 88.74 C
-ANISOU 2473 CZ PHE L 118 12753 13273 7689 -1174 -1269 -2737 C
-ATOM 2474 N PRO L 119 -31.624 -7.665 -44.397 1.00 88.39 N
-ANISOU 2474 N PRO L 119 10992 14196 8396 -1448 -513 -3321 N
-ATOM 2475 CA PRO L 119 -32.344 -6.414 -44.170 1.00 94.15 C
-ANISOU 2475 CA PRO L 119 11361 15035 9375 -1420 -415 -3560 C
-ATOM 2476 C PRO L 119 -31.501 -5.223 -44.587 1.00 97.90 C
-ANISOU 2476 C PRO L 119 11724 15279 10196 -1286 -344 -3892 C
-ATOM 2477 O PRO L 119 -30.284 -5.356 -44.788 1.00 99.89 O
-ANISOU 2477 O PRO L 119 12099 15401 10453 -1218 -347 -4010 O
-ATOM 2478 CB PRO L 119 -32.580 -6.428 -42.653 1.00 91.50 C
-ANISOU 2478 CB PRO L 119 10787 15216 8763 -1339 -330 -3706 C
-ATOM 2479 CG PRO L 119 -31.414 -7.185 -42.118 1.00 88.27 C
-ANISOU 2479 CG PRO L 119 10578 14932 8029 -1185 -373 -3719 C
-ATOM 2480 CD PRO L 119 -31.076 -8.228 -43.150 1.00 90.68 C
-ANISOU 2480 CD PRO L 119 11302 14847 8305 -1307 -489 -3373 C
-ATOM 2481 N PRO L 120 -32.103 -4.040 -44.720 1.00 97.42 N
-ANISOU 2481 N PRO L 120 11424 15140 10452 -1245 -255 -4067 N
-ATOM 2482 CA PRO L 120 -31.330 -2.876 -45.167 1.00 96.38 C
-ANISOU 2482 CA PRO L 120 11216 14674 10728 -1147 -108 -4349 C
-ATOM 2483 C PRO L 120 -30.371 -2.392 -44.092 1.00 91.67 C
-ANISOU 2483 C PRO L 120 10325 14312 10194 -1046 -19 -4857 C
-ATOM 2484 O PRO L 120 -30.725 -2.293 -42.915 1.00108.23 O
-ANISOU 2484 O PRO L 120 12133 16863 12125 -968 -42 -5088 O
-ATOM 2485 CB PRO L 120 -32.408 -1.829 -45.463 1.00 93.85 C
-ANISOU 2485 CB PRO L 120 10742 14227 10692 -1088 -46 -4372 C
-ATOM 2486 CG PRO L 120 -33.526 -2.196 -44.562 1.00 86.76 C
-ANISOU 2486 CG PRO L 120 9625 13806 9533 -1131 -142 -4360 C
-ATOM 2487 CD PRO L 120 -33.520 -3.699 -44.497 1.00 92.08 C
-ANISOU 2487 CD PRO L 120 10536 14647 9803 -1278 -261 -4030 C
-ATOM 2488 N SER L 121 -29.148 -2.087 -44.513 1.00 81.72 N
-ANISOU 2488 N SER L 121 9107 12775 9170 -1032 90 -5074 N
-ATOM 2489 CA SER L 121 -28.167 -1.519 -43.603 1.00 97.12 C
-ANISOU 2489 CA SER L 121 10702 14927 11271 -927 180 -5690 C
-ATOM 2490 C SER L 121 -28.601 -0.126 -43.161 1.00 98.66 C
-ANISOU 2490 C SER L 121 10506 15068 11913 -879 343 -6094 C
-ATOM 2491 O SER L 121 -29.343 0.570 -43.860 1.00 95.10 O
-ANISOU 2491 O SER L 121 10134 14239 11761 -921 448 -5891 O
-ATOM 2492 CB SER L 121 -26.793 -1.460 -44.270 1.00101.27 C
-ANISOU 2492 CB SER L 121 11316 15130 12031 -970 304 -5879 C
-ATOM 2493 OG SER L 121 -26.823 -0.646 -45.428 1.00104.21 O
-ANISOU 2493 OG SER L 121 11827 14897 12871 -1078 547 -5725 O
-ATOM 2494 N ASP L 122 -28.132 0.279 -41.978 1.00105.28 N
-ANISOU 2494 N ASP L 122 10915 16309 12779 -740 343 -6704 N
-ATOM 2495 CA ASP L 122 -28.522 1.576 -41.436 1.00111.01 C
-ANISOU 2495 CA ASP L 122 11214 17023 13941 -673 471 -7180 C
-ATOM 2496 C ASP L 122 -27.937 2.737 -42.230 1.00111.60 C
-ANISOU 2496 C ASP L 122 11240 16402 14759 -783 784 -7426 C
-ATOM 2497 O ASP L 122 -28.471 3.850 -42.155 1.00111.23 O
-ANISOU 2497 O ASP L 122 10985 16118 15159 -755 927 -7639 O
-ATOM 2498 CB ASP L 122 -28.106 1.682 -39.966 1.00105.89 C
-ANISOU 2498 CB ASP L 122 10079 17015 13139 -444 369 -7747 C
-ATOM 2499 N GLU L 123 -26.865 2.502 -42.993 1.00111.79 N
-ANISOU 2499 N GLU L 123 11464 16078 14933 -903 923 -7392 N
-ATOM 2500 CA GLU L 123 -26.266 3.568 -43.791 1.00119.50 C
-ANISOU 2500 CA GLU L 123 12431 16345 16628 -1040 1316 -7569 C
-ATOM 2501 C GLU L 123 -27.260 4.114 -44.809 1.00122.22 C
-ANISOU 2501 C GLU L 123 13131 16139 17167 -1049 1457 -6992 C
-ATOM 2502 O GLU L 123 -27.555 5.315 -44.828 1.00134.10 O
-ANISOU 2502 O GLU L 123 14489 17246 19218 -1024 1700 -7199 O
-ATOM 2503 CB GLU L 123 -25.004 3.063 -44.496 1.00122.82 C
-ANISOU 2503 CB GLU L 123 13033 16552 17080 -1173 1446 -7560 C
-ATOM 2504 CG GLU L 123 -23.889 2.595 -43.575 1.00127.10 C
-ANISOU 2504 CG GLU L 123 13205 17620 17468 -1080 1268 -7874 C
-ATOM 2505 CD GLU L 123 -24.032 1.138 -43.175 1.00123.12 C
-ANISOU 2505 CD GLU L 123 12925 17690 16164 -919 869 -7559 C
-ATOM 2506 OE1 GLU L 123 -25.124 0.754 -42.703 1.00122.22 O
-ANISOU 2506 OE1 GLU L 123 12900 17906 15632 -827 666 -7394 O
-ATOM 2507 OE2 GLU L 123 -23.055 0.376 -43.342 1.00108.51 O1-
-ANISOU 2507 OE2 GLU L 123 11167 15943 14120 -885 781 -7465 O1-
-ATOM 2508 N GLN L 124 -27.791 3.241 -45.669 1.00102.57 N
-ANISOU 2508 N GLN L 124 11111 13628 14234 -1043 1295 -6295 N
-ATOM 2509 CA GLN L 124 -28.711 3.704 -46.702 1.00106.65 C
-ANISOU 2509 CA GLN L 124 11972 13694 14857 -960 1389 -5774 C
-ATOM 2510 C GLN L 124 -30.030 4.179 -46.104 1.00111.77 C
-ANISOU 2510 C GLN L 124 12424 14574 15471 -809 1230 -5821 C
-ATOM 2511 O GLN L 124 -30.626 5.145 -46.597 1.00117.91 O
-ANISOU 2511 O GLN L 124 13294 14926 16581 -676 1393 -5711 O
-ATOM 2512 CB GLN L 124 -28.949 2.602 -47.735 1.00107.58 C
-ANISOU 2512 CB GLN L 124 12561 13821 14491 -953 1207 -5130 C
-ATOM 2513 CG GLN L 124 -29.393 1.266 -47.170 1.00103.41 C
-ANISOU 2513 CG GLN L 124 12026 13913 13353 -981 806 -4991 C
-ATOM 2514 CD GLN L 124 -29.767 0.281 -48.262 1.00 95.58 C
-ANISOU 2514 CD GLN L 124 11464 12864 11990 -971 631 -4414 C
-ATOM 2515 OE1 GLN L 124 -30.242 0.674 -49.329 1.00 98.18 O
-ANISOU 2515 OE1 GLN L 124 12053 12841 12408 -848 711 -4083 O
-ATOM 2516 NE2 GLN L 124 -29.537 -1.004 -48.008 1.00 84.00 N
-ANISOU 2516 NE2 GLN L 124 10077 11740 10099 -1058 390 -4311 N
-ATOM 2517 N LEU L 125 -30.500 3.523 -45.041 1.00108.71 N
-ANISOU 2517 N LEU L 125 11776 14860 14668 -798 932 -5977 N
-ATOM 2518 CA LEU L 125 -31.754 3.945 -44.426 1.00 99.85 C
-ANISOU 2518 CA LEU L 125 10419 14029 13492 -667 793 -6063 C
-ATOM 2519 C LEU L 125 -31.620 5.319 -43.784 1.00111.13 C
-ANISOU 2519 C LEU L 125 11446 15285 15492 -580 988 -6662 C
-ATOM 2520 O LEU L 125 -32.601 6.067 -43.716 1.00120.76 O
-ANISOU 2520 O LEU L 125 12563 16447 16873 -427 970 -6699 O
-ATOM 2521 CB LEU L 125 -32.217 2.910 -43.402 1.00 89.03 C
-ANISOU 2521 CB LEU L 125 8867 13419 11540 -691 510 -6076 C
-ATOM 2522 CG LEU L 125 -33.652 3.073 -42.898 1.00 89.98 C
-ANISOU 2522 CG LEU L 125 8781 13918 11491 -596 360 -6058 C
-ATOM 2523 N LYS L 126 -30.421 5.673 -43.322 1.00122.76 N
-ANISOU 2523 N LYS L 126 12662 16677 17304 -661 1168 -7191 N
-ATOM 2524 CA LYS L 126 -30.144 7.025 -42.855 1.00138.20 C
-ANISOU 2524 CA LYS L 126 14228 18334 19946 -616 1409 -7826 C
-ATOM 2525 C LYS L 126 -29.979 8.017 -44.001 1.00147.37 C
-ANISOU 2525 C LYS L 126 15698 18556 21740 -643 1807 -7612 C
-ATOM 2526 O LYS L 126 -29.634 9.178 -43.753 1.00153.97 O
-ANISOU 2526 O LYS L 126 16264 18968 23272 -650 2096 -8119 O
-ATOM 2527 CB LYS L 126 -28.890 7.037 -41.975 1.00137.69 C
-ANISOU 2527 CB LYS L 126 13721 18538 20058 -686 1465 -8564 C
-ATOM 2528 N SER L 127 -30.215 7.583 -45.243 1.00146.04 N
-ANISOU 2528 N SER L 127 16092 18050 21347 -634 1846 -6883 N
-ATOM 2529 CA SER L 127 -30.102 8.442 -46.411 1.00146.53 C
-ANISOU 2529 CA SER L 127 16546 17246 21884 -582 2248 -6550 C
-ATOM 2530 C SER L 127 -31.407 8.627 -47.170 1.00145.78 C
-ANISOU 2530 C SER L 127 16826 17006 21560 -282 2123 -5978 C
-ATOM 2531 O SER L 127 -31.468 9.492 -48.051 1.00153.67 O
-ANISOU 2531 O SER L 127 18166 17292 22931 -123 2458 -5699 O
-ATOM 2532 CB SER L 127 -29.040 7.896 -47.378 1.00143.25 C
-ANISOU 2532 CB SER L 127 16488 16511 21428 -757 2479 -6220 C
-ATOM 2533 OG SER L 127 -27.755 7.928 -46.786 1.00150.59 O
-ANISOU 2533 OG SER L 127 17051 17478 22689 -1007 2661 -6830 O
-ATOM 2534 N GLY L 128 -32.443 7.845 -46.870 1.00138.33 N
-ANISOU 2534 N GLY L 128 15830 16710 20018 -179 1678 -5808 N
-ATOM 2535 CA GLY L 128 -33.737 8.055 -47.489 1.00132.27 C
-ANISOU 2535 CA GLY L 128 15306 15903 19046 138 1518 -5418 C
-ATOM 2536 C GLY L 128 -34.387 6.808 -48.051 1.00124.77 C
-ANISOU 2536 C GLY L 128 14595 15392 17419 169 1170 -4941 C
-ATOM 2537 O GLY L 128 -35.615 6.683 -48.031 1.00119.04 O
-ANISOU 2537 O GLY L 128 13810 15008 16411 362 890 -4858 O
-ATOM 2538 N THR L 129 -33.581 5.881 -48.563 1.00125.64 N
-ANISOU 2538 N THR L 129 14942 15499 17295 -19 1185 -4680 N
-ATOM 2539 CA THR L 129 -34.086 4.676 -49.204 1.00125.93 C
-ANISOU 2539 CA THR L 129 15218 15864 16766 -2 882 -4257 C
-ATOM 2540 C THR L 129 -33.533 3.440 -48.509 1.00125.33 C
-ANISOU 2540 C THR L 129 14982 16270 16367 -320 705 -4364 C
-ATOM 2541 O THR L 129 -32.400 3.435 -48.019 1.00132.35 O
-ANISOU 2541 O THR L 129 15751 17107 17430 -505 865 -4631 O
-ATOM 2542 CB THR L 129 -33.718 4.637 -50.694 1.00117.66 C
-ANISOU 2542 CB THR L 129 14696 14339 15669 165 1041 -3760 C
-ATOM 2543 OG1 THR L 129 -32.293 4.626 -50.838 1.00117.54 O
-ANISOU 2543 OG1 THR L 129 14775 13994 15889 -60 1352 -3806 O
-ATOM 2544 CG2 THR L 129 -34.285 5.851 -51.414 1.00119.74 C
-ANISOU 2544 CG2 THR L 129 15202 14107 16187 573 1240 -3577 C
-ATOM 2545 N ALA L 130 -34.347 2.387 -48.475 1.00111.53 N
-ANISOU 2545 N ALA L 130 13231 14984 14161 -361 384 -4178 N
-ATOM 2546 CA ALA L 130 -33.966 1.115 -47.878 1.00 99.83 C
-ANISOU 2546 CA ALA L 130 11683 13917 12331 -618 221 -4182 C
-ATOM 2547 C ALA L 130 -34.318 -0.007 -48.841 1.00101.55 C
-ANISOU 2547 C ALA L 130 12209 14176 12201 -636 14 -3766 C
-ATOM 2548 O ALA L 130 -35.427 -0.036 -49.382 1.00111.14 O
-ANISOU 2548 O ALA L 130 13453 15469 13305 -490 -140 -3619 O
-ATOM 2549 CB ALA L 130 -34.667 0.899 -46.535 1.00 94.80 C
-ANISOU 2549 CB ALA L 130 10643 13853 11522 -704 87 -4452 C
-ATOM 2550 N SER L 131 -33.380 -0.927 -49.054 1.00 95.50 N
-ANISOU 2550 N SER L 131 11636 13381 11269 -789 -8 -3641 N
-ATOM 2551 CA SER L 131 -33.583 -2.052 -49.958 1.00 94.14 C
-ANISOU 2551 CA SER L 131 11738 13228 10802 -813 -212 -3307 C
-ATOM 2552 C SER L 131 -33.297 -3.352 -49.220 1.00 95.00 C
-ANISOU 2552 C SER L 131 11815 13653 10626 -1060 -355 -3306 C
-ATOM 2553 O SER L 131 -32.164 -3.589 -48.786 1.00 92.99 O
-ANISOU 2553 O SER L 131 11593 13387 10352 -1137 -280 -3419 O
-ATOM 2554 CB SER L 131 -32.700 -1.926 -51.204 1.00 98.02 C
-ANISOU 2554 CB SER L 131 12585 13299 11359 -689 -92 -3094 C
-ATOM 2555 OG SER L 131 -31.362 -1.617 -50.859 1.00 96.32 O
-ANISOU 2555 OG SER L 131 12356 12903 11338 -794 142 -3281 O
-ATOM 2556 N VAL L 132 -34.330 -4.183 -49.072 1.00 93.02 N
-ANISOU 2556 N VAL L 132 11499 13677 10169 -1166 -540 -3197 N
-ATOM 2557 CA VAL L 132 -34.215 -5.532 -48.526 1.00 88.35 C
-ANISOU 2557 CA VAL L 132 10963 13295 9312 -1390 -642 -3096 C
-ATOM 2558 C VAL L 132 -33.892 -6.483 -49.667 1.00 86.67 C
-ANISOU 2558 C VAL L 132 11071 12862 8998 -1404 -796 -2860 C
-ATOM 2559 O VAL L 132 -34.415 -6.325 -50.775 1.00 97.43 O
-ANISOU 2559 O VAL L 132 12513 14094 10414 -1265 -894 -2771 O
-ATOM 2560 CB VAL L 132 -35.522 -5.940 -47.821 1.00 87.16 C
-ANISOU 2560 CB VAL L 132 10563 13494 9062 -1545 -684 -3107 C
-ATOM 2561 CG1 VAL L 132 -35.364 -7.281 -47.119 1.00 94.92 C
-ANISOU 2561 CG1 VAL L 132 11643 14629 9792 -1775 -692 -2954 C
-ATOM 2562 CG2 VAL L 132 -35.959 -4.862 -46.851 1.00 93.03 C
-ANISOU 2562 CG2 VAL L 132 10957 14483 9907 -1470 -557 -3375 C
-ATOM 2563 N VAL L 133 -33.039 -7.478 -49.421 1.00 76.10 N
-ANISOU 2563 N VAL L 133 9916 11509 7487 -1515 -841 -2781 N
-ATOM 2564 CA VAL L 133 -32.723 -8.420 -50.490 1.00 86.16 C
-ANISOU 2564 CA VAL L 133 11475 12585 8675 -1517 -1011 -2601 C
-ATOM 2565 C VAL L 133 -33.031 -9.840 -50.032 1.00 93.40 C
-ANISOU 2565 C VAL L 133 12471 13593 9425 -1738 -1120 -2473 C
-ATOM 2566 O VAL L 133 -32.980 -10.160 -48.840 1.00102.46 O
-ANISOU 2566 O VAL L 133 13562 14923 10447 -1846 -1022 -2472 O
-ATOM 2567 CB VAL L 133 -31.258 -8.304 -50.979 1.00 79.94 C
-ANISOU 2567 CB VAL L 133 10905 11588 7882 -1396 -967 -2624 C
-ATOM 2568 CG1 VAL L 133 -30.873 -6.845 -51.204 1.00 72.32 C
-ANISOU 2568 CG1 VAL L 133 9850 10474 7154 -1237 -741 -2758 C
-ATOM 2569 CG2 VAL L 133 -30.306 -8.977 -50.020 1.00 84.20 C
-ANISOU 2569 CG2 VAL L 133 11502 12241 8248 -1465 -964 -2699 C
-ATOM 2570 N CYS L 134 -33.379 -10.690 -51.001 1.00 82.79 N
-ANISOU 2570 N CYS L 134 11259 12113 8084 -1781 -1306 -2370 N
-ATOM 2571 CA CYS L 134 -33.624 -12.110 -50.784 1.00 81.40 C
-ANISOU 2571 CA CYS L 134 11198 11891 7840 -2007 -1391 -2251 C
-ATOM 2572 C CYS L 134 -32.747 -12.909 -51.736 1.00 87.92 C
-ANISOU 2572 C CYS L 134 12322 12480 8604 -1919 -1583 -2192 C
-ATOM 2573 O CYS L 134 -32.549 -12.514 -52.890 1.00 97.06 O
-ANISOU 2573 O CYS L 134 13524 13558 9796 -1720 -1696 -2240 O
-ATOM 2574 CB CYS L 134 -35.104 -12.470 -50.996 1.00 97.01 C
-ANISOU 2574 CB CYS L 134 12944 13947 9969 -2196 -1436 -2298 C
-ATOM 2575 SG CYS L 134 -35.618 -14.080 -50.326 1.00120.15 S
-ANISOU 2575 SG CYS L 134 15941 16782 12929 -2588 -1365 -2156 S
-ATOM 2576 N LEU L 135 -32.231 -14.035 -51.250 1.00 92.12 N
-ANISOU 2576 N LEU L 135 13075 12908 9020 -2030 -1612 -2079 N
-ATOM 2577 CA LEU L 135 -31.236 -14.820 -51.969 1.00 90.13 C
-ANISOU 2577 CA LEU L 135 13111 12452 8681 -1920 -1800 -2057 C
-ATOM 2578 C LEU L 135 -31.685 -16.271 -52.054 1.00100.96 C
-ANISOU 2578 C LEU L 135 14624 13619 10118 -2123 -1913 -1959 C
-ATOM 2579 O LEU L 135 -32.143 -16.847 -51.063 1.00111.71 O
-ANISOU 2579 O LEU L 135 16011 14959 11475 -2331 -1755 -1819 O
-ATOM 2580 CB LEU L 135 -29.876 -14.729 -51.273 1.00 83.15 C
-ANISOU 2580 CB LEU L 135 12394 11614 7586 -1765 -1739 -2076 C
-ATOM 2581 CG LEU L 135 -28.588 -15.007 -52.049 1.00 90.36 C
-ANISOU 2581 CG LEU L 135 13521 12413 8398 -1565 -1897 -2158 C
-ATOM 2582 CD1 LEU L 135 -27.421 -14.499 -51.231 1.00 95.56 C
-ANISOU 2582 CD1 LEU L 135 14177 13229 8903 -1406 -1783 -2309 C
-ATOM 2583 CD2 LEU L 135 -28.401 -16.478 -52.365 1.00 95.92 C
-ANISOU 2583 CD2 LEU L 135 14500 12906 9040 -1598 -2114 -2065 C
-ATOM 2584 N LEU L 136 -31.544 -16.857 -53.240 1.00 94.22 N
-ANISOU 2584 N LEU L 136 13863 12602 9333 -2053 -2158 -2039 N
-ATOM 2585 CA LEU L 136 -31.778 -18.276 -53.481 1.00 85.01 C
-ANISOU 2585 CA LEU L 136 12841 11168 8291 -2221 -2295 -2017 C
-ATOM 2586 C LEU L 136 -30.479 -18.849 -54.027 1.00 88.58 C
-ANISOU 2586 C LEU L 136 13597 11477 8582 -1995 -2505 -2037 C
-ATOM 2587 O LEU L 136 -30.068 -18.516 -55.145 1.00 83.45 O
-ANISOU 2587 O LEU L 136 12926 10893 7890 -1772 -2686 -2180 O
-ATOM 2588 CB LEU L 136 -32.935 -18.494 -54.455 1.00 87.90 C
-ANISOU 2588 CB LEU L 136 12944 11526 8927 -2323 -2445 -2224 C
-ATOM 2589 CG LEU L 136 -34.355 -18.170 -53.982 1.00101.49 C
-ANISOU 2589 CG LEU L 136 14314 13390 10857 -2581 -2268 -2290 C
-ATOM 2590 CD1 LEU L 136 -34.586 -16.672 -53.866 1.00101.64 C
-ANISOU 2590 CD1 LEU L 136 14123 13730 10767 -2397 -2167 -2321 C
-ATOM 2591 CD2 LEU L 136 -35.364 -18.789 -54.930 1.00106.48 C
-ANISOU 2591 CD2 LEU L 136 14692 13978 11788 -2691 -2463 -2591 C
-ATOM 2592 N ASN L 137 -29.830 -19.701 -53.241 1.00 92.66 N
-ANISOU 2592 N ASN L 137 14407 11822 8976 -2011 -2473 -1889 N
-ATOM 2593 CA ASN L 137 -28.464 -20.127 -53.506 1.00 84.33 C
-ANISOU 2593 CA ASN L 137 13632 10702 7708 -1746 -2656 -1935 C
-ATOM 2594 C ASN L 137 -28.433 -21.570 -53.989 1.00 87.79 C
-ANISOU 2594 C ASN L 137 14300 10783 8272 -1794 -2874 -1942 C
-ATOM 2595 O ASN L 137 -29.007 -22.459 -53.346 1.00 96.55 O
-ANISOU 2595 O ASN L 137 15544 11616 9523 -2017 -2758 -1771 O
-ATOM 2596 CB ASN L 137 -27.603 -19.977 -52.252 1.00 89.50 C
-ANISOU 2596 CB ASN L 137 14457 11478 8071 -1600 -2508 -1829 C
-ATOM 2597 CG ASN L 137 -26.137 -19.823 -52.573 1.00 97.11 C
-ANISOU 2597 CG ASN L 137 15538 12554 8805 -1278 -2664 -2016 C
-ATOM 2598 OD1 ASN L 137 -25.774 -19.185 -53.560 1.00 98.54 O
-ANISOU 2598 OD1 ASN L 137 15578 12838 9026 -1183 -2740 -2197 O
-ATOM 2599 ND2 ASN L 137 -25.282 -20.410 -51.743 1.00100.85 N
-ANISOU 2599 ND2 ASN L 137 16272 13028 9017 -1080 -2695 -1980 N
-ATOM 2600 N ASN L 138 -27.770 -21.782 -55.129 1.00 95.94 N
-ANISOU 2600 N ASN L 138 15375 11809 9270 -1584 -3158 -2146 N
-ATOM 2601 CA ASN L 138 -27.381 -23.099 -55.642 1.00 96.89 C
-ANISOU 2601 CA ASN L 138 15733 11621 9461 -1525 -3424 -2228 C
-ATOM 2602 C ASN L 138 -28.581 -24.044 -55.745 1.00 95.95 C
-ANISOU 2602 C ASN L 138 15555 11157 9745 -1852 -3422 -2234 C
-ATOM 2603 O ASN L 138 -28.756 -24.969 -54.951 1.00111.46 O
-ANISOU 2603 O ASN L 138 17762 12761 11826 -2024 -3290 -2037 O
-ATOM 2604 CB ASN L 138 -26.280 -23.706 -54.769 1.00102.25 C
-ANISOU 2604 CB ASN L 138 16793 12180 9877 -1337 -3429 -2097 C
-ATOM 2605 CG ASN L 138 -24.985 -22.929 -54.850 1.00102.73 C
-ANISOU 2605 CG ASN L 138 16848 12582 9602 -1010 -3484 -2244 C
-ATOM 2606 OD1 ASN L 138 -24.714 -22.260 -55.847 1.00105.01 O
-ANISOU 2606 OD1 ASN L 138 16864 13100 9936 -893 -3500 -2401 O
-ATOM 2607 ND2 ASN L 138 -24.179 -23.009 -53.799 1.00106.11 N
-ANISOU 2607 ND2 ASN L 138 17481 13081 9754 -826 -3411 -2170 N
-ATOM 2608 N PHE L 139 -29.396 -23.796 -56.768 1.00 91.60 N
-ANISOU 2608 N PHE L 139 14671 10724 9411 -1909 -3553 -2486 N
-ATOM 2609 CA PHE L 139 -30.592 -24.587 -57.010 1.00 98.35 C
-ANISOU 2609 CA PHE L 139 15337 11317 10713 -2228 -3566 -2643 C
-ATOM 2610 C PHE L 139 -30.677 -24.974 -58.481 1.00108.13 C
-ANISOU 2610 C PHE L 139 16388 12611 12085 -2051 -3957 -3063 C
-ATOM 2611 O PHE L 139 -29.960 -24.443 -59.335 1.00108.15 O
-ANISOU 2611 O PHE L 139 16384 12917 11792 -1680 -4169 -3177 O
-ATOM 2612 CB PHE L 139 -31.862 -23.834 -56.588 1.00 96.84 C
-ANISOU 2612 CB PHE L 139 14793 11317 10687 -2495 -3304 -2624 C
-ATOM 2613 CG PHE L 139 -32.047 -22.510 -57.278 1.00 89.69 C
-ANISOU 2613 CG PHE L 139 13599 10887 9591 -2246 -3382 -2763 C
-ATOM 2614 CD1 PHE L 139 -32.798 -22.418 -58.439 1.00 87.71 C
-ANISOU 2614 CD1 PHE L 139 13016 10820 9490 -2142 -3620 -3128 C
-ATOM 2615 CD2 PHE L 139 -31.482 -21.357 -56.760 1.00 85.99 C
-ANISOU 2615 CD2 PHE L 139 13195 10676 8803 -2081 -3207 -2548 C
-ATOM 2616 CE1 PHE L 139 -32.976 -21.207 -59.075 1.00 85.74 C
-ANISOU 2616 CE1 PHE L 139 12573 10982 9022 -1837 -3668 -3198 C
-ATOM 2617 CE2 PHE L 139 -31.656 -20.141 -57.393 1.00 84.80 C
-ANISOU 2617 CE2 PHE L 139 12833 10871 8518 -1846 -3227 -2633 C
-ATOM 2618 CZ PHE L 139 -32.404 -20.066 -58.553 1.00 90.57 C
-ANISOU 2618 CZ PHE L 139 13303 11761 9348 -1704 -3450 -2918 C
-ATOM 2619 N TYR L 140 -31.574 -25.916 -58.763 1.00 93.93 N
-ANISOU 2619 N TYR L 140 14417 10522 10750 -2320 -4023 -3318 N
-ATOM 2620 CA TYR L 140 -31.854 -26.372 -60.121 1.00 95.92 C
-ANISOU 2620 CA TYR L 140 14403 10854 11189 -2160 -4412 -3823 C
-ATOM 2621 C TYR L 140 -33.187 -27.121 -60.154 1.00124.04 C
-ANISOU 2621 C TYR L 140 17619 14151 15358 -2574 -4357 -4155 C
-ATOM 2622 O TYR L 140 -33.447 -27.961 -59.292 1.00127.44 O
-ANISOU 2622 O TYR L 140 18215 14065 16142 -2978 -4088 -3987 O
-ATOM 2623 CB TYR L 140 -30.730 -27.274 -60.646 1.00 96.14 C
-ANISOU 2623 CB TYR L 140 14731 10668 11129 -1908 -4718 -3925 C
-ATOM 2624 CG TYR L 140 -30.976 -27.777 -62.052 1.00108.89 C
-ANISOU 2624 CG TYR L 140 15995 12461 12918 -1678 -5015 -4402 C
-ATOM 2625 CD1 TYR L 140 -30.633 -27.006 -63.155 1.00115.37 C
-ANISOU 2625 CD1 TYR L 140 16572 13887 13375 -1204 -5016 -4387 C
-ATOM 2626 CD2 TYR L 140 -31.568 -29.013 -62.278 1.00103.85 C
-ANISOU 2626 CD2 TYR L 140 15230 11399 12831 -1931 -5137 -4768 C
-ATOM 2627 CE1 TYR L 140 -30.865 -27.454 -64.440 1.00 98.90 C
-ANISOU 2627 CE1 TYR L 140 14169 12023 11385 -945 -5182 -4700 C
-ATOM 2628 CE2 TYR L 140 -31.801 -29.470 -63.561 1.00106.52 C
-ANISOU 2628 CE2 TYR L 140 15181 11995 13297 -1678 -5293 -5142 C
-ATOM 2629 CZ TYR L 140 -31.447 -28.686 -64.638 1.00103.95 C
-ANISOU 2629 CZ TYR L 140 14659 12314 12525 -1163 -5339 -5094 C
-ATOM 2630 OH TYR L 140 -31.679 -29.132 -65.918 1.00107.04 O
-ANISOU 2630 OH TYR L 140 14717 12954 13000 -865 -5523 -5435 O
-ATOM 2631 N PRO L 141 -34.036 -26.827 -61.152 1.00102.89 N
-ANISOU 2631 N PRO L 141 14454 11831 12808 -2455 -4589 -4649 N
-ATOM 2632 CA PRO L 141 -33.820 -25.852 -62.223 1.00100.08 C
-ANISOU 2632 CA PRO L 141 13936 12081 12009 -1916 -4873 -4814 C
-ATOM 2633 C PRO L 141 -34.163 -24.430 -61.801 1.00115.76 C
-ANISOU 2633 C PRO L 141 15838 14452 13695 -1839 -4627 -4531 C
-ATOM 2634 O PRO L 141 -34.287 -24.154 -60.609 1.00128.92 O
-ANISOU 2634 O PRO L 141 17628 15954 15400 -2160 -4258 -4162 O
-ATOM 2635 CB PRO L 141 -34.767 -26.335 -63.315 1.00106.57 C
-ANISOU 2635 CB PRO L 141 14246 13109 13135 -1821 -5014 -5316 C
-ATOM 2636 CG PRO L 141 -35.913 -26.903 -62.552 1.00109.12 C
-ANISOU 2636 CG PRO L 141 14314 13063 14083 -2426 -4888 -5611 C
-ATOM 2637 CD PRO L 141 -35.317 -27.537 -61.318 1.00108.70 C
-ANISOU 2637 CD PRO L 141 14746 12383 14174 -2832 -4577 -5133 C
-ATOM 2638 N ARG L 142 -34.318 -23.536 -62.777 1.00107.21 N
-ANISOU 2638 N ARG L 142 14555 13882 12300 -1377 -4783 -4664 N
-ATOM 2639 CA ARG L 142 -34.646 -22.143 -62.509 1.00120.63 C
-ANISOU 2639 CA ARG L 142 16193 15915 13725 -1232 -4613 -4461 C
-ATOM 2640 C ARG L 142 -36.147 -21.918 -62.360 1.00139.76 C
-ANISOU 2640 C ARG L 142 18146 18514 16444 -1418 -4562 -4768 C
-ATOM 2641 O ARG L 142 -36.651 -20.838 -62.696 1.00136.97 O
-ANISOU 2641 O ARG L 142 17618 18566 15858 -1100 -4572 -4799 O
-ATOM 2642 CB ARG L 142 -34.071 -21.251 -63.609 1.00127.90 C
-ANISOU 2642 CB ARG L 142 17184 17239 14175 -618 -4678 -4329 C
-ATOM 2643 CG ARG L 142 -33.837 -19.809 -63.184 1.00137.81 C
-ANISOU 2643 CG ARG L 142 18598 18669 15093 -459 -4475 -4007 C
-ATOM 2644 CD ARG L 142 -33.796 -18.880 -64.385 1.00142.44 C
-ANISOU 2644 CD ARG L 142 19156 19654 15309 155 -4523 -3966 C
-ATOM 2645 NE ARG L 142 -32.784 -19.280 -65.354 1.00138.55 N
-ANISOU 2645 NE ARG L 142 18820 19181 14643 452 -4551 -3852 N
-ATOM 2646 CZ ARG L 142 -32.457 -18.568 -66.427 1.00138.02 C
-ANISOU 2646 CZ ARG L 142 18821 19398 14223 992 -4532 -3732 C
-ATOM 2647 NH1 ARG L 142 -33.069 -17.417 -66.674 1.00136.28 N1+
-ANISOU 2647 NH1 ARG L 142 18573 19446 13762 1339 -4499 -3690 N1+
-ATOM 2648 NH2 ARG L 142 -31.518 -19.007 -67.254 1.00139.23 N
-ANISOU 2648 NH2 ARG L 142 19082 19568 14250 1213 -4538 -3655 N
-ATOM 2649 N GLU L 143 -36.881 -22.910 -61.862 1.00157.86 N
-ANISOU 2649 N GLU L 143 20225 20495 19258 -1920 -4485 -5009 N
-ATOM 2650 CA GLU L 143 -38.317 -22.755 -61.671 1.00159.58 C
-ANISOU 2650 CA GLU L 143 19936 20890 19808 -2156 -4402 -5369 C
-ATOM 2651 C GLU L 143 -38.600 -22.014 -60.371 1.00155.06 C
-ANISOU 2651 C GLU L 143 19426 20289 19201 -2466 -3962 -4941 C
-ATOM 2652 O GLU L 143 -39.408 -22.469 -59.554 1.00167.87 O
-ANISOU 2652 O GLU L 143 20838 21714 21232 -2986 -3686 -5011 O
-ATOM 2653 CB GLU L 143 -39.011 -24.119 -61.676 1.00165.06 C
-ANISOU 2653 CB GLU L 143 20330 21233 21152 -2622 -4428 -5846 C
-ATOM 2654 N ALA L 144 -37.948 -20.872 -60.173 1.00128.65 N
-ANISOU 2654 N ALA L 144 16349 17141 15392 -2154 -3870 -4524 N
-ATOM 2655 CA ALA L 144 -38.067 -20.121 -58.934 1.00115.52 C
-ANISOU 2655 CA ALA L 144 14756 15476 13658 -2386 -3483 -4140 C
-ATOM 2656 C ALA L 144 -39.221 -19.131 -59.012 1.00120.92 C
-ANISOU 2656 C ALA L 144 15019 16588 14337 -2256 -3471 -4379 C
-ATOM 2657 O ALA L 144 -39.446 -18.500 -60.049 1.00121.38 O
-ANISOU 2657 O ALA L 144 14936 16999 14182 -1753 -3746 -4613 O
-ATOM 2658 CB ALA L 144 -36.765 -19.381 -58.626 1.00101.00 C
-ANISOU 2658 CB ALA L 144 13368 13611 11397 -2138 -3376 -3656 C
-ATOM 2659 N LYS L 145 -39.953 -19.004 -57.906 1.00122.18 N
-ANISOU 2659 N LYS L 145 14991 16734 14698 -2670 -3146 -4313 N
-ATOM 2660 CA LYS L 145 -41.045 -18.038 -57.777 1.00119.82 C
-ANISOU 2660 CA LYS L 145 14286 16845 14396 -2576 -3102 -4533 C
-ATOM 2661 C LYS L 145 -40.894 -17.342 -56.427 1.00120.74 C
-ANISOU 2661 C LYS L 145 14537 16943 14397 -2787 -2712 -4109 C
-ATOM 2662 O LYS L 145 -41.209 -17.922 -55.384 1.00126.47 O
-ANISOU 2662 O LYS L 145 15216 17491 15348 -3289 -2394 -3996 O
-ATOM 2663 CB LYS L 145 -42.405 -18.718 -57.905 1.00113.99 C
-ANISOU 2663 CB LYS L 145 12980 16214 14117 -2898 -3134 -5113 C
-ATOM 2664 N VAL L 146 -40.418 -16.099 -56.447 1.00116.60 N
-ANISOU 2664 N VAL L 146 14177 16599 13529 -2389 -2713 -3886 N
-ATOM 2665 CA VAL L 146 -40.149 -15.325 -55.239 1.00107.22 C
-ANISOU 2665 CA VAL L 146 13099 15428 12211 -2501 -2391 -3550 C
-ATOM 2666 C VAL L 146 -41.157 -14.189 -55.150 1.00106.44 C
-ANISOU 2666 C VAL L 146 12637 15712 12094 -2315 -2377 -3763 C
-ATOM 2667 O VAL L 146 -41.300 -13.403 -56.095 1.00109.65 O
-ANISOU 2667 O VAL L 146 13003 16312 12346 -1822 -2606 -3905 O
-ATOM 2668 CB VAL L 146 -38.713 -14.774 -55.232 1.00 93.62 C
-ANISOU 2668 CB VAL L 146 11831 13556 10186 -2226 -2362 -3179 C
-ATOM 2669 CG1 VAL L 146 -38.472 -13.946 -53.987 1.00 93.58 C
-ANISOU 2669 CG1 VAL L 146 11861 13616 10079 -2311 -2058 -2948 C
-ATOM 2670 CG2 VAL L 146 -37.710 -15.907 -55.324 1.00 86.41 C
-ANISOU 2670 CG2 VAL L 146 11263 12305 9263 -2358 -2412 -3015 C
-ATOM 2671 N GLN L 147 -41.846 -14.093 -54.016 1.00107.73 N
-ANISOU 2671 N GLN L 147 12554 15994 12384 -2666 -2100 -3772 N
-ATOM 2672 CA GLN L 147 -42.786 -13.002 -53.804 1.00115.57 C
-ANISOU 2672 CA GLN L 147 13187 17365 13358 -2493 -2082 -3993 C
-ATOM 2673 C GLN L 147 -42.601 -12.422 -52.411 1.00119.67 C
-ANISOU 2673 C GLN L 147 13739 17939 13793 -2676 -1743 -3735 C
-ATOM 2674 O GLN L 147 -42.422 -13.158 -51.434 1.00117.43 O
-ANISOU 2674 O GLN L 147 13533 17524 13560 -3094 -1470 -3529 O
-ATOM 2675 CB GLN L 147 -44.237 -13.456 -54.008 1.00119.30 C
-ANISOU 2675 CB GLN L 147 13105 18107 14118 -2696 -2149 -4510 C
-ATOM 2676 CG GLN L 147 -44.601 -14.757 -53.327 1.00125.12 C
-ANISOU 2676 CG GLN L 147 13707 18650 15182 -3354 -1882 -4537 C
-ATOM 2677 CD GLN L 147 -45.880 -15.347 -53.885 1.00130.66 C
-ANISOU 2677 CD GLN L 147 13845 19550 16250 -3539 -2000 -5159 C
-ATOM 2678 OE1 GLN L 147 -46.429 -14.845 -54.866 1.00124.01 O
-ANISOU 2678 OE1 GLN L 147 12729 19031 15357 -3098 -2356 -5592 O
-ATOM 2679 NE2 GLN L 147 -46.359 -16.420 -53.268 1.00140.45 N
-ANISOU 2679 NE2 GLN L 147 14903 20597 17865 -4168 -1684 -5227 N
-ATOM 2680 N TRP L 148 -42.643 -11.094 -52.337 1.00119.52 N
-ANISOU 2680 N TRP L 148 13670 18110 13632 -2316 -1761 -3752 N
-ATOM 2681 CA TRP L 148 -42.422 -10.364 -51.099 1.00114.53 C
-ANISOU 2681 CA TRP L 148 13028 17575 12913 -2389 -1492 -3591 C
-ATOM 2682 C TRP L 148 -43.733 -10.163 -50.355 1.00112.71 C
-ANISOU 2682 C TRP L 148 12299 17727 12801 -2598 -1356 -3872 C
-ATOM 2683 O TRP L 148 -44.779 -9.923 -50.964 1.00113.48 O
-ANISOU 2683 O TRP L 148 12043 18070 13003 -2455 -1536 -4249 O
-ATOM 2684 CB TRP L 148 -41.781 -9.007 -51.389 1.00113.00 C
-ANISOU 2684 CB TRP L 148 13016 17333 12585 -1914 -1549 -3511 C
-ATOM 2685 CG TRP L 148 -40.375 -9.101 -51.873 1.00109.39 C
-ANISOU 2685 CG TRP L 148 13022 16526 12016 -1767 -1577 -3227 C
-ATOM 2686 CD1 TRP L 148 -39.949 -9.076 -53.168 1.00107.11 C
-ANISOU 2686 CD1 TRP L 148 12966 16066 11663 -1443 -1783 -3186 C
-ATOM 2687 CD2 TRP L 148 -39.200 -9.221 -51.066 1.00105.18 C
-ANISOU 2687 CD2 TRP L 148 12746 15825 11395 -1904 -1389 -2985 C
-ATOM 2688 NE1 TRP L 148 -38.581 -9.180 -53.219 1.00 97.83 N
-ANISOU 2688 NE1 TRP L 148 12165 14608 10397 -1421 -1709 -2931 N
-ATOM 2689 CE2 TRP L 148 -38.097 -9.270 -51.941 1.00105.07 C
-ANISOU 2689 CE2 TRP L 148 13090 15526 11306 -1694 -1486 -2833 C
-ATOM 2690 CE3 TRP L 148 -38.974 -9.296 -49.689 1.00100.07 C
-ANISOU 2690 CE3 TRP L 148 12044 15290 10689 -2138 -1154 -2911 C
-ATOM 2691 CZ2 TRP L 148 -36.787 -9.387 -51.483 1.00108.72 C
-ANISOU 2691 CZ2 TRP L 148 13819 15812 11677 -1737 -1368 -2663 C
-ATOM 2692 CZ3 TRP L 148 -37.674 -9.413 -49.236 1.00104.64 C
-ANISOU 2692 CZ3 TRP L 148 12907 15711 11139 -2123 -1063 -2737 C
-ATOM 2693 CH2 TRP L 148 -36.597 -9.457 -50.130 1.00106.97 C
-ANISOU 2693 CH2 TRP L 148 13521 15720 11402 -1937 -1176 -2640 C
-ATOM 2694 N LYS L 149 -43.666 -10.257 -49.029 1.00109.99 N
-ANISOU 2694 N LYS L 149 11910 17477 12404 -2894 -1040 -3714 N
-ATOM 2695 CA LYS L 149 -44.821 -10.041 -48.169 1.00110.06 C
-ANISOU 2695 CA LYS L 149 11448 17885 12485 -3110 -845 -3948 C
-ATOM 2696 C LYS L 149 -44.412 -9.151 -47.007 1.00117.07 C
-ANISOU 2696 C LYS L 149 12347 18957 13179 -3001 -652 -3822 C
-ATOM 2697 O LYS L 149 -43.436 -9.448 -46.314 1.00117.85 O
-ANISOU 2697 O LYS L 149 12759 18910 13111 -3073 -486 -3501 O
-ATOM 2698 CB LYS L 149 -45.386 -11.368 -47.647 1.00102.72 C
-ANISOU 2698 CB LYS L 149 10383 16932 11713 -3681 -565 -3909 C
-ATOM 2699 CG LYS L 149 -45.837 -12.339 -48.734 1.00104.95 C
-ANISOU 2699 CG LYS L 149 10577 17023 12274 -3845 -739 -4134 C
-ATOM 2700 N VAL L 150 -45.145 -8.060 -46.800 1.00133.58 N
-ANISOU 2700 N VAL L 150 14080 21388 15285 -2781 -699 -4124 N
-ATOM 2701 CA VAL L 150 -44.941 -7.184 -45.650 1.00140.59 C
-ANISOU 2701 CA VAL L 150 14865 22521 16033 -2678 -528 -4124 C
-ATOM 2702 C VAL L 150 -46.190 -7.249 -44.778 1.00149.60 C
-ANISOU 2702 C VAL L 150 15494 24154 17195 -2939 -320 -4370 C
-ATOM 2703 O VAL L 150 -47.313 -7.070 -45.268 1.00155.14 O
-ANISOU 2703 O VAL L 150 15809 25084 18054 -2918 -447 -4740 O
-ATOM 2704 CB VAL L 150 -44.602 -5.741 -46.074 1.00139.87 C
-ANISOU 2704 CB VAL L 150 14816 22361 15966 -2167 -728 -4269 C
-ATOM 2705 CG1 VAL L 150 -43.396 -5.740 -46.998 1.00135.63 C
-ANISOU 2705 CG1 VAL L 150 14773 21335 15427 -1956 -865 -4017 C
-ATOM 2706 CG2 VAL L 150 -45.780 -5.049 -46.755 1.00143.19 C
-ANISOU 2706 CG2 VAL L 150 14893 23000 16511 -1901 -946 -4653 C
-ATOM 2707 N ASP L 151 -45.992 -7.547 -43.492 1.00149.05 N
-ANISOU 2707 N ASP L 151 15413 24281 16937 -3160 9 -4181 N
-ATOM 2708 CA ASP L 151 -47.092 -7.754 -42.549 1.00153.42 C
-ANISOU 2708 CA ASP L 151 15515 25311 17466 -3461 307 -4337 C
-ATOM 2709 C ASP L 151 -48.120 -8.736 -43.110 1.00150.31 C
-ANISOU 2709 C ASP L 151 14880 24894 17336 -3872 382 -4482 C
-ATOM 2710 O ASP L 151 -49.330 -8.534 -42.995 1.00154.67 O
-ANISOU 2710 O ASP L 151 14902 25845 18022 -3996 438 -4879 O
-ATOM 2711 CB ASP L 151 -47.751 -6.426 -42.172 1.00164.62 C
-ANISOU 2711 CB ASP L 151 16489 27186 18872 -3157 206 -4758 C
-ATOM 2712 CG ASP L 151 -46.788 -5.467 -41.491 1.00170.43 C
-ANISOU 2712 CG ASP L 151 17380 27958 19419 -2798 178 -4703 C
-ATOM 2713 OD1 ASP L 151 -45.871 -5.937 -40.785 1.00172.55 O
-ANISOU 2713 OD1 ASP L 151 17947 28154 19460 -2865 365 -4373 O
-ATOM 2714 OD2 ASP L 151 -46.954 -4.240 -41.658 1.00171.61 O
-ANISOU 2714 OD2 ASP L 151 17340 28206 19659 -2424 -32 -5026 O
-ATOM 2715 N ASN L 152 -47.622 -9.806 -43.737 1.00144.10 N
-ANISOU 2715 N ASN L 152 14452 23643 16656 -4079 373 -4221 N
-ATOM 2716 CA ASN L 152 -48.459 -10.843 -44.346 1.00152.24 C
-ANISOU 2716 CA ASN L 152 15271 24558 18015 -4490 439 -4399 C
-ATOM 2717 C ASN L 152 -49.360 -10.261 -45.439 1.00152.28 C
-ANISOU 2717 C ASN L 152 14854 24764 18241 -4250 51 -4982 C
-ATOM 2718 O ASN L 152 -50.575 -10.472 -45.456 1.00154.37 O
-ANISOU 2718 O ASN L 152 14578 25341 18736 -4504 141 -5416 O
-ATOM 2719 CB ASN L 152 -49.282 -11.579 -43.284 1.00162.88 C
-ANISOU 2719 CB ASN L 152 16329 26131 19425 -5036 979 -4350 C
-ATOM 2720 CG ASN L 152 -49.556 -13.025 -43.652 1.00164.88 C
-ANISOU 2720 CG ASN L 152 16640 25988 20019 -5566 1210 -4270 C
-ATOM 2721 OD1 ASN L 152 -49.622 -13.379 -44.829 1.00161.52 O
-ANISOU 2721 OD1 ASN L 152 16199 25301 19870 -5545 896 -4518 O
-ATOM 2722 ND2 ASN L 152 -49.719 -13.872 -42.640 1.00167.98 N
-ANISOU 2722 ND2 ASN L 152 17104 26325 20394 -6023 1782 -3926 N
-ATOM 2723 N ALA L 153 -48.746 -9.525 -46.366 1.00150.57 N
-ANISOU 2723 N ALA L 153 14891 24380 17941 -3726 -367 -5001 N
-ATOM 2724 CA ALA L 153 -49.468 -8.926 -47.483 1.00149.87 C
-ANISOU 2724 CA ALA L 153 14513 24468 17962 -3341 -769 -5488 C
-ATOM 2725 C ALA L 153 -48.539 -8.841 -48.685 1.00145.38 C
-ANISOU 2725 C ALA L 153 14419 23497 17323 -2935 -1113 -5307 C
-ATOM 2726 O ALA L 153 -47.425 -8.323 -48.573 1.00139.90 O
-ANISOU 2726 O ALA L 153 14169 22544 16442 -2693 -1123 -4934 O
-ATOM 2727 CB ALA L 153 -50.002 -7.536 -47.119 1.00149.10 C
-ANISOU 2727 CB ALA L 153 14115 24788 17749 -2942 -871 -5771 C
-ATOM 2728 N LEU L 154 -49.009 -9.332 -49.831 1.00146.11 N
-ANISOU 2728 N LEU L 154 14374 23575 17565 -2848 -1386 -5621 N
-ATOM 2729 CA LEU L 154 -48.173 -9.465 -51.017 1.00139.83 C
-ANISOU 2729 CA LEU L 154 14010 22434 16684 -2497 -1685 -5454 C
-ATOM 2730 C LEU L 154 -47.709 -8.097 -51.523 1.00146.50 C
-ANISOU 2730 C LEU L 154 15116 23260 17287 -1813 -1909 -5351 C
-ATOM 2731 O LEU L 154 -48.269 -7.051 -51.184 1.00151.69 O
-ANISOU 2731 O LEU L 154 15544 24201 17891 -1544 -1929 -5543 O
-ATOM 2732 CB LEU L 154 -48.936 -10.209 -52.116 1.00127.80 C
-ANISOU 2732 CB LEU L 154 12180 21022 15355 -2478 -1958 -5934 C
-ATOM 2733 CG LEU L 154 -48.133 -10.888 -53.227 1.00110.29 C
-ANISOU 2733 CG LEU L 154 10345 18453 13109 -2319 -2196 -5791 C
-ATOM 2734 N GLN L 155 -46.660 -8.120 -52.347 1.00144.81 N
-ANISOU 2734 N GLN L 155 15397 22680 16943 -1535 -2050 -5040 N
-ATOM 2735 CA GLN L 155 -46.068 -6.919 -52.920 1.00146.64 C
-ANISOU 2735 CA GLN L 155 15965 22770 16982 -924 -2175 -4857 C
-ATOM 2736 C GLN L 155 -46.001 -7.046 -54.435 1.00143.70 C
-ANISOU 2736 C GLN L 155 15773 22342 16484 -443 -2506 -4925 C
-ATOM 2737 O GLN L 155 -45.934 -8.152 -54.978 1.00142.27 O
-ANISOU 2737 O GLN L 155 15590 22105 16360 -635 -2621 -5000 O
-ATOM 2738 CB GLN L 155 -44.659 -6.668 -52.362 1.00144.39 C
-ANISOU 2738 CB GLN L 155 16142 22090 16629 -1026 -1936 -4368 C
-ATOM 2739 CG GLN L 155 -44.431 -5.256 -51.858 1.00139.63 C
-ANISOU 2739 CG GLN L 155 15595 21460 15998 -728 -1818 -4304 C
-ATOM 2740 CD GLN L 155 -45.176 -4.981 -50.572 1.00137.89 C
-ANISOU 2740 CD GLN L 155 14949 21585 15857 -992 -1648 -4523 C
-ATOM 2741 OE1 GLN L 155 -45.472 -5.900 -49.810 1.00132.77 O
-ANISOU 2741 OE1 GLN L 155 14092 21101 15255 -1489 -1495 -4554 O
-ATOM 2742 NE2 GLN L 155 -45.478 -3.713 -50.318 1.00140.53 N
-ANISOU 2742 NE2 GLN L 155 15168 22020 16207 -645 -1648 -4665 N
-ATOM 2743 N SER L 156 -46.014 -5.900 -55.113 1.00142.04 N
-ANISOU 2743 N SER L 156 15734 22140 16094 221 -2645 -4895 N
-ATOM 2744 CA SER L 156 -45.938 -5.879 -56.568 1.00142.99 C
-ANISOU 2744 CA SER L 156 16073 22258 15998 811 -2938 -4914 C
-ATOM 2745 C SER L 156 -45.458 -4.512 -57.028 1.00144.05 C
-ANISOU 2745 C SER L 156 16624 22172 15935 1458 -2887 -4600 C
-ATOM 2746 O SER L 156 -45.807 -3.491 -56.430 1.00147.98 O
-ANISOU 2746 O SER L 156 17034 22704 16488 1603 -2777 -4637 O
-ATOM 2747 CB SER L 156 -47.295 -6.202 -57.204 1.00142.34 C
-ANISOU 2747 CB SER L 156 15493 22692 15899 1069 -3288 -5528 C
-ATOM 2748 OG SER L 156 -47.674 -7.542 -56.947 1.00139.97 O
-ANISOU 2748 OG SER L 156 14827 22503 15851 454 -3297 -5829 O
-ATOM 2749 N GLY L 157 -44.662 -4.503 -58.097 1.00139.30 N
-ANISOU 2749 N GLY L 157 16477 21332 15120 1845 -2941 -4298 N
-ATOM 2750 CA GLY L 157 -44.195 -3.269 -58.692 1.00134.23 C
-ANISOU 2750 CA GLY L 157 16286 20420 14295 2482 -2830 -3952 C
-ATOM 2751 C GLY L 157 -42.949 -2.681 -58.072 1.00131.14 C
-ANISOU 2751 C GLY L 157 16263 19500 14063 2219 -2416 -3502 C
-ATOM 2752 O GLY L 157 -42.553 -1.573 -58.450 1.00134.97 O
-ANISOU 2752 O GLY L 157 17110 19675 14496 2673 -2230 -3216 O
-ATOM 2753 N ASN L 158 -42.315 -3.384 -57.136 1.00125.02 N
-ANISOU 2753 N ASN L 158 15405 18606 13491 1524 -2248 -3452 N
-ATOM 2754 CA ASN L 158 -41.124 -2.869 -56.478 1.00122.79 C
-ANISOU 2754 CA ASN L 158 15386 17898 13372 1277 -1884 -3145 C
-ATOM 2755 C ASN L 158 -40.005 -3.892 -56.363 1.00119.85 C
-ANISOU 2755 C ASN L 158 15185 17344 13008 831 -1803 -2965 C
-ATOM 2756 O ASN L 158 -38.942 -3.557 -55.833 1.00114.06 O
-ANISOU 2756 O ASN L 158 14632 16305 12402 628 -1523 -2781 O
-ATOM 2757 CB ASN L 158 -41.475 -2.342 -55.078 1.00122.34 C
-ANISOU 2757 CB ASN L 158 15004 17930 13549 965 -1725 -3332 C
-ATOM 2758 CG ASN L 158 -42.482 -3.220 -54.363 1.00122.88 C
-ANISOU 2758 CG ASN L 158 14589 18452 13649 571 -1885 -3672 C
-ATOM 2759 OD1 ASN L 158 -42.585 -4.416 -54.637 1.00128.74 O
-ANISOU 2759 OD1 ASN L 158 15262 19318 14335 318 -2029 -3727 O
-ATOM 2760 ND2 ASN L 158 -43.232 -2.629 -53.440 1.00112.76 N
-ANISOU 2760 ND2 ASN L 158 12957 17404 12483 507 -1831 -3917 N
-ATOM 2761 N SER L 159 -40.205 -5.117 -56.835 1.00123.83 N
-ANISOU 2761 N SER L 159 15617 18029 13403 692 -2047 -3065 N
-ATOM 2762 CA SER L 159 -39.188 -6.154 -56.782 1.00115.22 C
-ANISOU 2762 CA SER L 159 14705 16764 12308 323 -2012 -2914 C
-ATOM 2763 C SER L 159 -38.475 -6.240 -58.123 1.00108.22 C
-ANISOU 2763 C SER L 159 14190 15722 11207 714 -2086 -2709 C
-ATOM 2764 O SER L 159 -39.111 -6.191 -59.180 1.00113.04 O
-ANISOU 2764 O SER L 159 14802 16525 11623 1185 -2319 -2799 O
-ATOM 2765 CB SER L 159 -39.809 -7.509 -56.436 1.00114.99 C
-ANISOU 2765 CB SER L 159 14383 16960 12348 -102 -2198 -3153 C
-ATOM 2766 OG SER L 159 -40.869 -7.363 -55.507 1.00114.04 O
-ANISOU 2766 OG SER L 159 13856 17101 12372 -326 -2162 -3399 O
-ATOM 2767 N GLN L 160 -37.151 -6.364 -58.078 1.00 99.28 N
-ANISOU 2767 N GLN L 160 13350 14290 10080 556 -1889 -2465 N
-ATOM 2768 CA GLN L 160 -36.356 -6.595 -59.276 1.00100.61 C
-ANISOU 2768 CA GLN L 160 13854 14336 10036 853 -1926 -2272 C
-ATOM 2769 C GLN L 160 -35.449 -7.791 -59.036 1.00103.12 C
-ANISOU 2769 C GLN L 160 14239 14573 10370 445 -1977 -2267 C
-ATOM 2770 O GLN L 160 -34.737 -7.844 -58.027 1.00101.88 O
-ANISOU 2770 O GLN L 160 14083 14264 10362 67 -1781 -2230 O
-ATOM 2771 CB GLN L 160 -35.539 -5.359 -59.658 1.00 93.87 C
-ANISOU 2771 CB GLN L 160 13336 13157 9173 1160 -1567 -1966 C
-ATOM 2772 CG GLN L 160 -36.391 -4.215 -60.182 1.00109.10 C
-ANISOU 2772 CG GLN L 160 15318 15112 11022 1715 -1531 -1904 C
-ATOM 2773 CD GLN L 160 -35.574 -3.009 -60.599 1.00117.54 C
-ANISOU 2773 CD GLN L 160 16771 15756 12131 2006 -1096 -1552 C
-ATOM 2774 OE1 GLN L 160 -34.401 -2.885 -60.245 1.00116.71 O
-ANISOU 2774 OE1 GLN L 160 16791 15341 12213 1693 -779 -1436 O
-ATOM 2775 NE2 GLN L 160 -36.196 -2.103 -61.345 1.00123.21 N
-ANISOU 2775 NE2 GLN L 160 17674 16449 12690 2624 -1056 -1399 N
-ATOM 2776 N GLU L 161 -35.483 -8.747 -59.958 1.00102.48 N
-ANISOU 2776 N GLU L 161 14180 14147 10609 234 -3509 -2257 N
-ATOM 2777 CA GLU L 161 -34.774 -10.010 -59.819 1.00 95.37 C
-ANISOU 2777 CA GLU L 161 13201 13364 9671 -94 -3307 -2077 C
-ATOM 2778 C GLU L 161 -33.534 -10.036 -60.702 1.00 88.25 C
-ANISOU 2778 C GLU L 161 12786 12262 8482 -102 -3241 -1792 C
-ATOM 2779 O GLU L 161 -33.358 -9.214 -61.605 1.00 94.24 O
-ANISOU 2779 O GLU L 161 13988 12764 9053 129 -3366 -1742 O
-ATOM 2780 CB GLU L 161 -35.692 -11.187 -60.166 1.00104.11 C
-ANISOU 2780 CB GLU L 161 14003 14595 10957 -114 -3478 -2266 C
-ATOM 2781 CG GLU L 161 -36.176 -11.969 -58.962 1.00124.61 C
-ANISOU 2781 CG GLU L 161 16137 17428 13782 -439 -3219 -2390 C
-ATOM 2782 CD GLU L 161 -37.364 -12.853 -59.282 1.00142.68 C
-ANISOU 2782 CD GLU L 161 18064 19827 16321 -485 -3375 -2706 C
-ATOM 2783 OE1 GLU L 161 -37.321 -13.571 -60.304 1.00144.12 O
-ANISOU 2783 OE1 GLU L 161 18407 19919 16434 -441 -3570 -2694 O
-ATOM 2784 OE2 GLU L 161 -38.345 -12.827 -58.509 1.00154.38 O
-ANISOU 2784 OE2 GLU L 161 19090 21491 18076 -593 -3277 -3003 O
-ATOM 2785 N SER L 162 -32.668 -11.007 -60.422 1.00 85.50 N
-ANISOU 2785 N SER L 162 12378 12020 8089 -358 -3013 -1614 N
-ATOM 2786 CA SER L 162 -31.440 -11.198 -61.182 1.00 87.30 C
-ANISOU 2786 CA SER L 162 12958 12119 8094 -392 -2885 -1385 C
-ATOM 2787 C SER L 162 -30.952 -12.617 -60.939 1.00 92.15 C
-ANISOU 2787 C SER L 162 13410 12871 8730 -556 -2747 -1273 C
-ATOM 2788 O SER L 162 -30.924 -13.074 -59.793 1.00 92.71 O
-ANISOU 2788 O SER L 162 13189 13137 8900 -727 -2607 -1264 O
-ATOM 2789 CB SER L 162 -30.370 -10.179 -60.776 1.00 90.08 C
-ANISOU 2789 CB SER L 162 13455 12437 8335 -526 -2635 -1279 C
-ATOM 2790 OG SER L 162 -29.337 -10.111 -61.744 1.00 96.66 O
-ANISOU 2790 OG SER L 162 14659 13102 8965 -539 -2495 -1129 O
-ATOM 2791 N VAL L 163 -30.578 -13.308 -62.014 1.00 91.56 N
-ANISOU 2791 N VAL L 163 13594 12665 8530 -479 -2779 -1188 N
-ATOM 2792 CA VAL L 163 -30.159 -14.703 -61.960 1.00 81.38 C
-ANISOU 2792 CA VAL L 163 12245 11430 7245 -566 -2662 -1091 C
-ATOM 2793 C VAL L 163 -28.740 -14.807 -62.500 1.00 79.54 C
-ANISOU 2793 C VAL L 163 12238 11147 6835 -552 -2449 -905 C
-ATOM 2794 O VAL L 163 -28.371 -14.095 -63.440 1.00 78.58 O
-ANISOU 2794 O VAL L 163 12440 10858 6557 -472 -2432 -882 O
-ATOM 2795 CB VAL L 163 -31.119 -15.607 -62.763 1.00 84.89 C
-ANISOU 2795 CB VAL L 163 12757 11765 7733 -498 -2881 -1234 C
-ATOM 2796 CG1 VAL L 163 -30.781 -17.076 -62.562 1.00 76.45 C
-ANISOU 2796 CG1 VAL L 163 11675 10695 6680 -612 -2718 -1147 C
-ATOM 2797 CG2 VAL L 163 -32.562 -15.332 -62.365 1.00 94.22 C
-ANISOU 2797 CG2 VAL L 163 13634 13033 9132 -506 -3099 -1505 C
-ATOM 2798 N THR L 164 -27.942 -15.685 -61.896 1.00 81.66 N
-ANISOU 2798 N THR L 164 12356 11555 7118 -614 -2268 -785 N
-ATOM 2799 CA THR L 164 -26.608 -15.962 -62.405 1.00 84.17 C
-ANISOU 2799 CA THR L 164 12787 11875 7320 -566 -2060 -663 C
-ATOM 2800 C THR L 164 -26.677 -16.978 -63.542 1.00 85.08 C
-ANISOU 2800 C THR L 164 13199 11782 7345 -438 -2077 -647 C
-ATOM 2801 O THR L 164 -27.712 -17.598 -63.800 1.00 97.46 O
-ANISOU 2801 O THR L 164 14846 13232 8952 -421 -2262 -734 O
-ATOM 2802 CB THR L 164 -25.695 -16.497 -61.300 1.00 81.79 C
-ANISOU 2802 CB THR L 164 12190 11829 7058 -585 -1922 -569 C
-ATOM 2803 OG1 THR L 164 -26.237 -17.718 -60.775 1.00 73.60 O
-ANISOU 2803 OG1 THR L 164 11137 10770 6059 -544 -1978 -524 O
-ATOM 2804 CG2 THR L 164 -25.554 -15.484 -60.179 1.00 79.97 C
-ANISOU 2804 CG2 THR L 164 11693 11818 6876 -728 -1916 -617 C
-ATOM 2805 N GLU L 165 -25.550 -17.154 -64.222 1.00 77.05 N
-ANISOU 2805 N GLU L 165 12328 10732 6215 -371 -1859 -574 N
-ATOM 2806 CA GLU L 165 -25.455 -18.213 -65.210 1.00 81.03 C
-ANISOU 2806 CA GLU L 165 13127 11045 6617 -240 -1822 -561 C
-ATOM 2807 C GLU L 165 -25.306 -19.565 -64.515 1.00 88.69 C
-ANISOU 2807 C GLU L 165 13954 12070 7675 -171 -1783 -493 C
-ATOM 2808 O GLU L 165 -25.033 -19.653 -63.315 1.00110.79 O
-ANISOU 2808 O GLU L 165 16450 15077 10568 -191 -1759 -428 O
-ATOM 2809 CB GLU L 165 -24.284 -17.961 -66.159 1.00 81.27 C
-ANISOU 2809 CB GLU L 165 13368 11014 6496 -189 -1530 -530 C
-ATOM 2810 N GLN L 166 -25.498 -20.631 -65.286 1.00 79.64 N
-ANISOU 2810 N GLN L 166 13102 10700 6457 -77 -1780 -512 N
-ATOM 2811 CA GLN L 166 -25.327 -21.975 -64.751 1.00 81.28 C
-ANISOU 2811 CA GLN L 166 13319 10856 6708 15 -1702 -437 C
-ATOM 2812 C GLN L 166 -23.871 -22.190 -64.358 1.00 86.76 C
-ANISOU 2812 C GLN L 166 13837 11733 7393 223 -1483 -315 C
-ATOM 2813 O GLN L 166 -22.957 -21.906 -65.138 1.00 95.82 O
-ANISOU 2813 O GLN L 166 15018 12911 8478 317 -1303 -336 O
-ATOM 2814 CB GLN L 166 -25.768 -23.011 -65.786 1.00 80.67 C
-ANISOU 2814 CB GLN L 166 13651 10458 6541 57 -1715 -519 C
-ATOM 2815 CG GLN L 166 -26.057 -24.390 -65.222 1.00 90.33 C
-ANISOU 2815 CG GLN L 166 14996 11510 7814 65 -1659 -482 C
-ATOM 2816 CD GLN L 166 -26.715 -25.309 -66.236 1.00 96.48 C
-ANISOU 2816 CD GLN L 166 16180 11954 8524 8 -1699 -635 C
-ATOM 2817 OE1 GLN L 166 -27.063 -24.887 -67.336 1.00102.10 O
-ANISOU 2817 OE1 GLN L 166 17062 12597 9135 -20 -1836 -781 O
-ATOM 2818 NE2 GLN L 166 -26.891 -26.570 -65.866 1.00105.06 N
-ANISOU 2818 NE2 GLN L 166 17481 12804 9633 -8 -1583 -613 N
-ATOM 2819 N ASP L 167 -23.655 -22.676 -63.137 1.00 82.67 N
-ANISOU 2819 N ASP L 167 13132 11351 6929 304 -1497 -211 N
-ATOM 2820 CA ASP L 167 -22.301 -22.795 -62.614 1.00 92.11 C
-ANISOU 2820 CA ASP L 167 14067 12803 8126 556 -1388 -137 C
-ATOM 2821 C ASP L 167 -21.516 -23.847 -63.389 1.00 91.45 C
-ANISOU 2821 C ASP L 167 14195 12563 7988 867 -1213 -118 C
-ATOM 2822 O ASP L 167 -22.038 -24.910 -63.733 1.00 85.93 O
-ANISOU 2822 O ASP L 167 13890 11530 7231 934 -1198 -88 O
-ATOM 2823 CB ASP L 167 -22.333 -23.144 -61.126 1.00101.02 C
-ANISOU 2823 CB ASP L 167 15057 14079 9246 635 -1504 -22 C
-ATOM 2824 CG ASP L 167 -20.960 -23.078 -60.479 1.00120.73 C
-ANISOU 2824 CG ASP L 167 17198 16937 11738 924 -1504 3 C
-ATOM 2825 OD1 ASP L 167 -20.003 -22.627 -61.143 1.00132.54 O
-ANISOU 2825 OD1 ASP L 167 18453 18609 13298 986 -1374 -106 O
-ATOM 2826 OD2 ASP L 167 -20.834 -23.474 -59.301 1.00132.43 O
-ANISOU 2826 OD2 ASP L 167 18642 18535 13141 1088 -1630 109 O
-ATOM 2827 N SER L 168 -20.245 -23.541 -63.661 1.00 95.46 N
-ANISOU 2827 N SER L 168 14426 13315 8531 1039 -1049 -174 N
-ATOM 2828 CA SER L 168 -19.413 -24.429 -64.463 1.00104.07 C
-ANISOU 2828 CA SER L 168 15662 14290 9591 1359 -832 -201 C
-ATOM 2829 C SER L 168 -19.086 -25.735 -63.748 1.00110.76 C
-ANISOU 2829 C SER L 168 16609 15064 10410 1777 -892 -78 C
-ATOM 2830 O SER L 168 -18.730 -26.716 -64.410 1.00112.62 O
-ANISOU 2830 O SER L 168 17132 15061 10598 2063 -734 -83 O
-ATOM 2831 CB SER L 168 -18.119 -23.715 -64.857 1.00115.14 C
-ANISOU 2831 CB SER L 168 16647 16022 11080 1404 -592 -347 C
-ATOM 2832 OG SER L 168 -17.280 -24.558 -65.626 1.00128.70 O
-ANISOU 2832 OG SER L 168 18455 17657 12789 1735 -336 -411 O
-ATOM 2833 N LYS L 169 -19.203 -25.775 -62.420 1.00108.30 N
-ANISOU 2833 N LYS L 169 16143 14916 10091 1843 -1106 36 N
-ATOM 2834 CA LYS L 169 -18.835 -26.953 -61.642 1.00103.63 C
-ANISOU 2834 CA LYS L 169 15733 14235 9407 2299 -1182 184 C
-ATOM 2835 C LYS L 169 -20.037 -27.845 -61.341 1.00103.21 C
-ANISOU 2835 C LYS L 169 16279 13704 9232 2167 -1206 329 C
-ATOM 2836 O LYS L 169 -20.072 -29.005 -61.762 1.00 96.52 O
-ANISOU 2836 O LYS L 169 15904 12461 8308 2389 -1082 382 O
-ATOM 2837 CB LYS L 169 -18.142 -26.524 -60.341 1.00104.53 C
-ANISOU 2837 CB LYS L 169 15395 14809 9514 2498 -1405 214 C
-ATOM 2838 N ASP L 170 -21.028 -27.324 -60.619 1.00 98.10 N
-ANISOU 2838 N ASP L 170 15623 13074 8576 1784 -1322 363 N
-ATOM 2839 CA ASP L 170 -22.167 -28.122 -60.185 1.00106.26 C
-ANISOU 2839 CA ASP L 170 17153 13698 9523 1587 -1286 456 C
-ATOM 2840 C ASP L 170 -23.443 -27.844 -60.969 1.00 96.30 C
-ANISOU 2840 C ASP L 170 16002 12221 8365 1081 -1246 294 C
-ATOM 2841 O ASP L 170 -24.484 -28.423 -60.643 1.00 93.99 O
-ANISOU 2841 O ASP L 170 16027 11627 8056 816 -1187 294 O
-ATOM 2842 CB ASP L 170 -22.417 -27.915 -58.683 1.00125.41 C
-ANISOU 2842 CB ASP L 170 19533 16277 11841 1544 -1403 588 C
-ATOM 2843 CG ASP L 170 -22.737 -26.475 -58.332 1.00133.98 C
-ANISOU 2843 CG ASP L 170 20120 17752 13035 1198 -1528 473 C
-ATOM 2844 OD1 ASP L 170 -22.656 -25.608 -59.224 1.00134.77 O
-ANISOU 2844 OD1 ASP L 170 19920 18003 13283 1035 -1533 315 O
-ATOM 2845 OD2 ASP L 170 -23.062 -26.208 -57.155 1.00141.62 O1-
-ANISOU 2845 OD2 ASP L 170 21061 18841 13909 1100 -1600 543 O1-
-ATOM 2846 N SER L 171 -23.395 -26.973 -61.980 1.00100.47 N
-ANISOU 2846 N SER L 171 16289 12897 8988 943 -1276 136 N
-ATOM 2847 CA SER L 171 -24.507 -26.767 -62.916 1.00 94.21 C
-ANISOU 2847 CA SER L 171 15638 11905 8252 585 -1312 -45 C
-ATOM 2848 C SER L 171 -25.775 -26.285 -62.212 1.00 91.48 C
-ANISOU 2848 C SER L 171 15156 11601 7999 195 -1428 -119 C
-ATOM 2849 O SER L 171 -26.885 -26.724 -62.522 1.00 84.91 O
-ANISOU 2849 O SER L 171 14512 10527 7223 -81 -1440 -266 O
-ATOM 2850 CB SER L 171 -24.789 -28.037 -63.721 1.00 92.09 C
-ANISOU 2850 CB SER L 171 15880 11191 7920 622 -1191 -99 C
-ATOM 2851 OG SER L 171 -23.627 -28.475 -64.402 1.00 94.32 O
-ANISOU 2851 OG SER L 171 16285 11430 8122 1009 -1049 -58 O
-ATOM 2852 N THR L 172 -25.617 -25.360 -61.273 1.00 92.80 N
-ANISOU 2852 N THR L 172 14964 12097 8198 159 -1506 -64 N
-ATOM 2853 CA THR L 172 -26.721 -24.834 -60.484 1.00 87.57 C
-ANISOU 2853 CA THR L 172 14135 11513 7626 -170 -1573 -144 C
-ATOM 2854 C THR L 172 -26.921 -23.353 -60.788 1.00 88.69 C
-ANISOU 2854 C THR L 172 13924 11915 7860 -292 -1728 -274 C
-ATOM 2855 O THR L 172 -26.181 -22.747 -61.569 1.00 88.94 O
-ANISOU 2855 O THR L 172 13891 12040 7861 -160 -1751 -282 O
-ATOM 2856 CB THR L 172 -26.467 -25.060 -58.995 1.00 88.91 C
-ANISOU 2856 CB THR L 172 14299 11785 7698 -105 -1510 29 C
-ATOM 2857 OG1 THR L 172 -25.292 -24.341 -58.603 1.00 93.86 O
-ANISOU 2857 OG1 THR L 172 14635 12764 8265 146 -1597 118 O
-ATOM 2858 CG2 THR L 172 -26.265 -26.540 -58.721 1.00 85.71 C
-ANISOU 2858 CG2 THR L 172 14379 11038 7149 69 -1347 187 C
-ATOM 2859 N TYR L 173 -27.932 -22.767 -60.154 1.00 86.52 N
-ANISOU 2859 N TYR L 173 13457 11728 7690 -548 -1794 -386 N
-ATOM 2860 CA TYR L 173 -28.287 -21.367 -60.351 1.00 83.07 C
-ANISOU 2860 CA TYR L 173 12748 11477 7338 -637 -1945 -520 C
-ATOM 2861 C TYR L 173 -28.241 -20.620 -59.021 1.00 91.04 C
-ANISOU 2861 C TYR L 173 13496 12738 8358 -716 -1923 -482 C
-ATOM 2862 O TYR L 173 -27.948 -21.190 -57.967 1.00 91.31 O
-ANISOU 2862 O TYR L 173 13575 12816 8302 -693 -1815 -349 O
-ATOM 2863 CB TYR L 173 -29.670 -21.238 -60.997 1.00 76.90 C
-ANISOU 2863 CB TYR L 173 11946 10577 6694 -818 -2097 -773 C
-ATOM 2864 CG TYR L 173 -29.708 -21.692 -62.439 1.00 90.34 C
-ANISOU 2864 CG TYR L 173 13919 12069 8338 -729 -2195 -856 C
-ATOM 2865 CD1 TYR L 173 -29.063 -20.965 -63.431 1.00 91.66 C
-ANISOU 2865 CD1 TYR L 173 14208 12239 8380 -551 -2270 -826 C
-ATOM 2866 CD2 TYR L 173 -30.388 -22.846 -62.810 1.00 95.74 C
-ANISOU 2866 CD2 TYR L 173 14789 12525 9064 -856 -2180 -982 C
-ATOM 2867 CE1 TYR L 173 -29.090 -21.374 -64.745 1.00 78.59 C
-ANISOU 2867 CE1 TYR L 173 12875 10380 6608 -461 -2346 -902 C
-ATOM 2868 CE2 TYR L 173 -30.420 -23.263 -64.127 1.00 84.95 C
-ANISOU 2868 CE2 TYR L 173 13703 10967 7607 -778 -2288 -1086 C
-ATOM 2869 CZ TYR L 173 -29.768 -22.522 -65.089 1.00 84.78 C
-ANISOU 2869 CZ TYR L 173 13822 10966 7426 -560 -2381 -1037 C
-ATOM 2870 OH TYR L 173 -29.793 -22.926 -66.405 1.00 93.78 O
-ANISOU 2870 OH TYR L 173 15314 11904 8414 -473 -2476 -1140 O
-ATOM 2871 N SER L 174 -28.530 -19.322 -59.092 1.00 93.12 N
-ANISOU 2871 N SER L 174 13551 13137 8691 -783 -2032 -601 N
-ATOM 2872 CA SER L 174 -28.611 -18.454 -57.925 1.00 81.81 C
-ANISOU 2872 CA SER L 174 11888 11924 7274 -883 -2017 -623 C
-ATOM 2873 C SER L 174 -29.374 -17.201 -58.326 1.00 85.92 C
-ANISOU 2873 C SER L 174 12280 12454 7911 -944 -2150 -816 C
-ATOM 2874 O SER L 174 -29.155 -16.660 -59.412 1.00 89.60 O
-ANISOU 2874 O SER L 174 12862 12828 8353 -843 -2245 -843 O
-ATOM 2875 CB SER L 174 -27.223 -18.088 -57.388 1.00 73.66 C
-ANISOU 2875 CB SER L 174 10765 11111 6110 -769 -1975 -489 C
-ATOM 2876 OG SER L 174 -26.607 -19.203 -56.771 1.00 75.03 O
-ANISOU 2876 OG SER L 174 11048 11307 6156 -631 -1907 -321 O
-ATOM 2877 N LEU L 175 -30.266 -16.750 -57.449 1.00 85.70 N
-ANISOU 2877 N LEU L 175 12063 12515 7985 -1083 -2138 -951 N
-ATOM 2878 CA LEU L 175 -31.159 -15.637 -57.740 1.00 84.85 C
-ANISOU 2878 CA LEU L 175 11826 12403 8011 -1076 -2281 -1166 C
-ATOM 2879 C LEU L 175 -31.133 -14.646 -56.586 1.00 82.05 C
-ANISOU 2879 C LEU L 175 11307 12216 7653 -1158 -2198 -1212 C
-ATOM 2880 O LEU L 175 -31.095 -15.046 -55.421 1.00 82.04 O
-ANISOU 2880 O LEU L 175 11236 12334 7600 -1287 -2038 -1168 O
-ATOM 2881 CB LEU L 175 -32.592 -16.138 -57.982 1.00 80.15 C
-ANISOU 2881 CB LEU L 175 11093 11743 7616 -1151 -2362 -1406 C
-ATOM 2882 CG LEU L 175 -33.684 -15.138 -58.365 1.00 81.12 C
-ANISOU 2882 CG LEU L 175 11028 11882 7910 -1049 -2583 -1688 C
-ATOM 2883 CD1 LEU L 175 -34.654 -15.796 -59.315 1.00 87.70 C
-ANISOU 2883 CD1 LEU L 175 11799 12637 8884 -1022 -2792 -1913 C
-ATOM 2884 CD2 LEU L 175 -34.423 -14.635 -57.135 1.00 91.20 C
-ANISOU 2884 CD2 LEU L 175 11997 13319 9334 -1182 -2441 -1860 C
-ATOM 2885 N SER L 176 -31.164 -13.354 -56.913 1.00 89.83 N
-ANISOU 2885 N SER L 176 12304 13172 8656 -1075 -2296 -1304 N
-ATOM 2886 CA SER L 176 -31.159 -12.291 -55.910 1.00 93.19 C
-ANISOU 2886 CA SER L 176 12621 13712 9077 -1151 -2216 -1387 C
-ATOM 2887 C SER L 176 -32.254 -11.293 -56.256 1.00100.03 C
-ANISOU 2887 C SER L 176 13440 14473 10093 -1020 -2356 -1620 C
-ATOM 2888 O SER L 176 -32.184 -10.624 -57.292 1.00100.58 O
-ANISOU 2888 O SER L 176 13731 14359 10127 -838 -2509 -1624 O
-ATOM 2889 CB SER L 176 -29.797 -11.597 -55.839 1.00 91.72 C
-ANISOU 2889 CB SER L 176 12545 13573 8730 -1191 -2149 -1270 C
-ATOM 2890 OG SER L 176 -29.647 -10.656 -56.889 1.00108.54 O
-ANISOU 2890 OG SER L 176 14898 15498 10845 -1090 -2217 -1299 O
-ATOM 2891 N SER L 177 -33.260 -11.192 -55.392 1.00102.04 N
-ANISOU 2891 N SER L 177 13442 14833 10497 -1083 -2289 -1820 N
-ATOM 2892 CA SER L 177 -34.337 -10.228 -55.559 1.00105.23 C
-ANISOU 2892 CA SER L 177 13728 15181 11075 -899 -2423 -2088 C
-ATOM 2893 C SER L 177 -34.108 -9.039 -54.635 1.00 99.48 C
-ANISOU 2893 C SER L 177 13035 14475 10288 -937 -2284 -2149 C
-ATOM 2894 O SER L 177 -33.751 -9.210 -53.466 1.00 99.44 O
-ANISOU 2894 O SER L 177 12956 14630 10196 -1166 -2058 -2112 O
-ATOM 2895 CB SER L 177 -35.696 -10.865 -55.265 1.00106.53 C
-ANISOU 2895 CB SER L 177 13510 15467 11500 -947 -2406 -2359 C
-ATOM 2896 OG SER L 177 -36.745 -9.930 -55.451 1.00114.23 O
-ANISOU 2896 OG SER L 177 14298 16431 12675 -694 -2575 -2664 O
-ATOM 2897 N THR L 178 -34.311 -7.834 -55.165 1.00 99.96 N
-ANISOU 2897 N THR L 178 13275 14346 10361 -698 -2424 -2247 N
-ATOM 2898 CA THR L 178 -34.096 -6.600 -54.415 1.00 96.18 C
-ANISOU 2898 CA THR L 178 12912 13810 9822 -726 -2288 -2330 C
-ATOM 2899 C THR L 178 -35.416 -5.848 -54.314 1.00 95.10 C
-ANISOU 2899 C THR L 178 12621 13618 9896 -439 -2384 -2640 C
-ATOM 2900 O THR L 178 -35.895 -5.282 -55.304 1.00 91.03 O
-ANISOU 2900 O THR L 178 12279 12887 9420 -74 -2648 -2711 O
-ATOM 2901 CB THR L 178 -33.022 -5.731 -55.069 1.00 98.91 C
-ANISOU 2901 CB THR L 178 13708 13906 9968 -718 -2290 -2175 C
-ATOM 2902 OG1 THR L 178 -31.821 -6.494 -55.245 1.00103.13 O
-ANISOU 2902 OG1 THR L 178 14285 14541 10358 -947 -2206 -1940 O
-ATOM 2903 CG2 THR L 178 -32.720 -4.523 -54.195 1.00 86.30 C
-ANISOU 2903 CG2 THR L 178 12246 12241 8304 -837 -2107 -2288 C
-ATOM 2904 N LEU L 179 -36.001 -5.851 -53.120 1.00 93.67 N
-ANISOU 2904 N LEU L 179 12134 13629 9826 -572 -2170 -2836 N
-ATOM 2905 CA LEU L 179 -37.199 -5.076 -52.817 1.00 99.91 C
-ANISOU 2905 CA LEU L 179 12713 14408 10839 -310 -2186 -3182 C
-ATOM 2906 C LEU L 179 -36.767 -3.704 -52.312 1.00104.41 C
-ANISOU 2906 C LEU L 179 13621 14781 11270 -268 -2065 -3219 C
-ATOM 2907 O LEU L 179 -36.177 -3.591 -51.233 1.00110.37 O
-ANISOU 2907 O LEU L 179 14420 15638 11876 -590 -1792 -3189 O
-ATOM 2908 CB LEU L 179 -38.053 -5.801 -51.780 1.00 99.81 C
-ANISOU 2908 CB LEU L 179 12220 14691 11014 -524 -1923 -3405 C
-ATOM 2909 CG LEU L 179 -39.276 -5.063 -51.238 1.00101.59 C
-ANISOU 2909 CG LEU L 179 12123 14976 11501 -306 -1832 -3822 C
-ATOM 2910 CD1 LEU L 179 -40.308 -4.869 -52.331 1.00109.58 C
-ANISOU 2910 CD1 LEU L 179 12887 15951 12796 169 -2217 -4071 C
-ATOM 2911 CD2 LEU L 179 -39.873 -5.816 -50.063 1.00 95.99 C
-ANISOU 2911 CD2 LEU L 179 11030 14541 10900 -656 -1422 -4005 C
-ATOM 2912 N THR L 180 -37.056 -2.664 -53.088 1.00102.22 N
-ANISOU 2912 N THR L 180 13634 14196 11010 137 -2277 -3294 N
-ATOM 2913 CA THR L 180 -36.635 -1.305 -52.774 1.00109.42 C
-ANISOU 2913 CA THR L 180 14985 14812 11778 184 -2152 -3329 C
-ATOM 2914 C THR L 180 -37.833 -0.476 -52.329 1.00124.31 C
-ANISOU 2914 C THR L 180 16716 16644 13874 563 -2150 -3692 C
-ATOM 2915 O THR L 180 -38.843 -0.402 -53.038 1.00132.17 O
-ANISOU 2915 O THR L 180 17549 17602 15067 1051 -2446 -3865 O
-ATOM 2916 CB THR L 180 -35.952 -0.652 -53.980 1.00106.44 C
-ANISOU 2916 CB THR L 180 15227 14018 11197 356 -2318 -3116 C
-ATOM 2917 OG1 THR L 180 -34.667 -1.253 -54.187 1.00101.80 O
-ANISOU 2917 OG1 THR L 180 14768 13494 10416 -61 -2208 -2827 O
-ATOM 2918 CG2 THR L 180 -35.776 0.843 -53.760 1.00109.50 C
-ANISOU 2918 CG2 THR L 180 16135 14002 11469 467 -2183 -3209 C
-ATOM 2919 N LEU L 181 -37.715 0.141 -51.152 1.00121.06 N
-ANISOU 2919 N LEU L 181 16340 16246 13413 363 -1833 -3839 N
-ATOM 2920 CA LEU L 181 -38.735 1.021 -50.598 1.00118.77 C
-ANISOU 2920 CA LEU L 181 15944 15881 13302 703 -1749 -4204 C
-ATOM 2921 C LEU L 181 -38.082 2.300 -50.093 1.00130.29 C
-ANISOU 2921 C LEU L 181 17973 16988 14542 613 -1538 -4227 C
-ATOM 2922 O LEU L 181 -36.861 2.379 -49.926 1.00134.82 O
-ANISOU 2922 O LEU L 181 18881 17491 14855 175 -1406 -4013 O
-ATOM 2923 CB LEU L 181 -39.503 0.349 -49.452 1.00117.10 C
-ANISOU 2923 CB LEU L 181 15121 16090 13283 501 -1468 -4465 C
-ATOM 2924 CG LEU L 181 -40.341 -0.889 -49.772 1.00131.68 C
-ANISOU 2924 CG LEU L 181 16347 18281 15404 520 -1574 -4554 C
-ATOM 2925 CD1 LEU L 181 -40.944 -1.458 -48.496 1.00126.57 C
-ANISOU 2925 CD1 LEU L 181 15238 17975 14876 198 -1146 -4798 C
-ATOM 2926 CD2 LEU L 181 -41.426 -0.557 -50.785 1.00149.47 C
-ANISOU 2926 CD2 LEU L 181 18378 20462 17952 1156 -1966 -4800 C
-ATOM 2927 N SER L 182 -38.912 3.309 -49.846 1.00127.37 N
-ANISOU 2927 N SER L 182 17692 16406 14299 1036 -1501 -4531 N
-ATOM 2928 CA SER L 182 -38.436 4.525 -49.208 1.00126.74 C
-ANISOU 2928 CA SER L 182 18144 15980 14033 930 -1242 -4627 C
-ATOM 2929 C SER L 182 -38.428 4.346 -47.693 1.00116.88 C
-ANISOU 2929 C SER L 182 16606 15054 12747 506 -857 -4828 C
-ATOM 2930 O SER L 182 -39.134 3.498 -47.139 1.00115.65 O
-ANISOU 2930 O SER L 182 15861 15314 12764 453 -758 -4967 O
-ATOM 2931 CB SER L 182 -39.311 5.718 -49.594 1.00116.45 C
-ANISOU 2931 CB SER L 182 17157 14243 12846 1625 -1360 -4866 C
-ATOM 2932 OG SER L 182 -40.640 5.550 -49.130 1.00119.59 O
-ANISOU 2932 OG SER L 182 16930 14930 13580 2008 -1356 -5239 O
-ATOM 2933 N LYS L 183 -37.607 5.156 -47.018 1.00117.67 N
-ANISOU 2933 N LYS L 183 17172 14944 12592 170 -616 -4861 N
-ATOM 2934 CA LYS L 183 -37.535 5.069 -45.562 1.00115.52 C
-ANISOU 2934 CA LYS L 183 16741 14953 12200 -221 -276 -5061 C
-ATOM 2935 C LYS L 183 -38.888 5.344 -44.920 1.00120.31 C
-ANISOU 2935 C LYS L 183 17032 15634 13046 150 -82 -5454 C
-ATOM 2936 O LYS L 183 -39.197 4.783 -43.864 1.00123.82 O
-ANISOU 2936 O LYS L 183 17138 16445 13465 -108 196 -5603 O
-ATOM 2937 CB LYS L 183 -36.484 6.038 -45.021 1.00117.00 C
-ANISOU 2937 CB LYS L 183 17503 14869 12081 -607 -95 -5107 C
-ATOM 2938 N ALA L 184 -39.708 6.189 -45.549 1.00127.11 N
-ANISOU 2938 N ALA L 184 18017 16152 14129 780 -212 -5637 N
-ATOM 2939 CA ALA L 184 -41.028 6.497 -45.008 1.00131.57 C
-ANISOU 2939 CA ALA L 184 18206 16806 14979 1209 -37 -6070 C
-ATOM 2940 C ALA L 184 -41.917 5.259 -44.994 1.00133.72 C
-ANISOU 2940 C ALA L 184 17646 17608 15554 1234 -51 -6162 C
-ATOM 2941 O ALA L 184 -42.434 4.858 -43.945 1.00132.07 O
-ANISOU 2941 O ALA L 184 17044 17728 15408 1007 332 -6412 O
-ATOM 2942 CB ALA L 184 -41.671 7.625 -45.817 1.00130.51 C
-ANISOU 2942 CB ALA L 184 18393 16184 15012 1983 -267 -6228 C
-ATOM 2943 N ASP L 185 -42.100 4.633 -46.159 1.00139.18 N
-ANISOU 2943 N ASP L 185 18098 18367 16416 1470 -458 -5979 N
-ATOM 2944 CA ASP L 185 -42.907 3.423 -46.244 1.00142.30 C
-ANISOU 2944 CA ASP L 185 17718 19239 17112 1431 -479 -6088 C
-ATOM 2945 C ASP L 185 -42.262 2.232 -45.546 1.00137.16 C
-ANISOU 2945 C ASP L 185 16935 18927 16252 704 -215 -5856 C
-ATOM 2946 O ASP L 185 -42.949 1.235 -45.298 1.00144.59 O
-ANISOU 2946 O ASP L 185 17298 20235 17406 544 -58 -5993 O
-ATOM 2947 CB ASP L 185 -43.177 3.077 -47.709 1.00145.43 C
-ANISOU 2947 CB ASP L 185 17974 19595 17686 1851 -1025 -5957 C
-ATOM 2948 N TYR L 186 -40.971 2.308 -45.217 1.00124.37 N
-ANISOU 2948 N TYR L 186 15844 17189 14224 270 -159 -5536 N
-ATOM 2949 CA TYR L 186 -40.308 1.187 -44.559 1.00117.68 C
-ANISOU 2949 CA TYR L 186 14930 16650 13133 -321 24 -5303 C
-ATOM 2950 C TYR L 186 -40.565 1.183 -43.057 1.00125.99 C
-ANISOU 2950 C TYR L 186 15948 17891 14033 -627 522 -5540 C
-ATOM 2951 O TYR L 186 -40.855 0.129 -42.479 1.00130.00 O
-ANISOU 2951 O TYR L 186 16174 18701 14518 -929 774 -5534 O
-ATOM 2952 CB TYR L 186 -38.805 1.224 -44.840 1.00106.36 C
-ANISOU 2952 CB TYR L 186 13991 15079 11342 -619 -166 -4911 C
-ATOM 2953 CG TYR L 186 -38.029 0.112 -44.168 1.00112.98 C
-ANISOU 2953 CG TYR L 186 14806 16226 11894 -1127 -53 -4667 C
-ATOM 2954 CD1 TYR L 186 -38.146 -1.204 -44.600 1.00108.09 C
-ANISOU 2954 CD1 TYR L 186 13880 15823 11365 -1215 -144 -4466 C
-ATOM 2955 CD2 TYR L 186 -37.180 0.378 -43.099 1.00103.54 C
-ANISOU 2955 CD2 TYR L 186 13932 15092 10315 -1489 121 -4654 C
-ATOM 2956 CE1 TYR L 186 -37.440 -2.224 -43.987 1.00106.36 C
-ANISOU 2956 CE1 TYR L 186 13724 15833 10855 -1603 -51 -4226 C
-ATOM 2957 CE2 TYR L 186 -36.469 -0.636 -42.480 1.00101.61 C
-ANISOU 2957 CE2 TYR L 186 13711 15129 9768 -1856 160 -4430 C
-ATOM 2958 CZ TYR L 186 -36.604 -1.934 -42.929 1.00112.24 C
-ANISOU 2958 CZ TYR L 186 14797 16645 11202 -1888 80 -4201 C
-ATOM 2959 OH TYR L 186 -35.901 -2.948 -42.320 1.00110.05 O
-ANISOU 2959 OH TYR L 186 14622 16594 10596 -2181 109 -3962 O
-ATOM 2960 N GLU L 187 -40.467 2.345 -42.412 1.00126.74 N
-ANISOU 2960 N GLU L 187 16393 17774 13989 -565 698 -5754 N
-ATOM 2961 CA GLU L 187 -40.630 2.459 -40.968 1.00127.62 C
-ANISOU 2961 CA GLU L 187 16586 18026 13877 -853 1174 -5991 C
-ATOM 2962 C GLU L 187 -42.088 2.398 -40.522 1.00139.48 C
-ANISOU 2962 C GLU L 187 17580 19689 15725 -636 1551 -6429 C
-ATOM 2963 O GLU L 187 -42.383 2.747 -39.373 1.00148.24 O
-ANISOU 2963 O GLU L 187 18797 20847 16681 -779 2002 -6708 O
-ATOM 2964 CB GLU L 187 -39.987 3.758 -40.472 1.00120.40 C
-ANISOU 2964 CB GLU L 187 16254 16804 12687 -884 1230 -6107 C
-ATOM 2965 N LYS L 188 -43.002 1.969 -41.393 1.00139.09 N
-ANISOU 2965 N LYS L 188 16965 19744 16139 -306 1388 -6536 N
-ATOM 2966 CA LYS L 188 -44.408 1.833 -41.044 1.00146.11 C
-ANISOU 2966 CA LYS L 188 17225 20855 17435 -123 1742 -7016 C
-ATOM 2967 C LYS L 188 -44.852 0.387 -40.880 1.00153.49 C
-ANISOU 2967 C LYS L 188 17677 22153 18487 -522 1987 -6995 C
-ATOM 2968 O LYS L 188 -45.964 0.151 -40.397 1.00164.75 O
-ANISOU 2968 O LYS L 188 18570 23805 20220 -539 2423 -7425 O
-ATOM 2969 CB LYS L 188 -45.287 2.510 -42.106 1.00139.83 C
-ANISOU 2969 CB LYS L 188 16055 19940 17132 607 1373 -7291 C
-ATOM 2970 N HIS L 189 -44.020 -0.580 -41.261 1.00144.72 N
-ANISOU 2970 N HIS L 189 16750 21088 17151 -854 1762 -6536 N
-ATOM 2971 CA HIS L 189 -44.374 -1.989 -41.216 1.00143.17 C
-ANISOU 2971 CA HIS L 189 16205 21149 17044 -1233 1974 -6477 C
-ATOM 2972 C HIS L 189 -43.365 -2.752 -40.368 1.00138.89 C
-ANISOU 2972 C HIS L 189 16212 20630 15928 -1775 2185 -6080 C
-ATOM 2973 O HIS L 189 -42.197 -2.365 -40.267 1.00138.28 O
-ANISOU 2973 O HIS L 189 16682 20413 15447 -1816 1929 -5763 O
-ATOM 2974 CB HIS L 189 -44.435 -2.576 -42.627 1.00151.27 C
-ANISOU 2974 CB HIS L 189 16914 22191 18369 -1034 1453 -6318 C
-ATOM 2975 CG HIS L 189 -45.412 -1.880 -43.520 1.00165.85 C
-ANISOU 2975 CG HIS L 189 18251 24036 20731 -427 1140 -6702 C
-ATOM 2976 ND1 HIS L 189 -46.735 -2.255 -43.612 1.00179.29 N
-ANISOU 2976 ND1 HIS L 189 19165 26014 22944 -338 1322 -7193 N
-ATOM 2977 CD2 HIS L 189 -45.262 -0.822 -44.352 1.00170.34 C
-ANISOU 2977 CD2 HIS L 189 19007 24352 21363 146 650 -6686 C
-ATOM 2978 CE1 HIS L 189 -47.356 -1.463 -44.468 1.00187.00 C
-ANISOU 2978 CE1 HIS L 189 19824 26948 24279 326 886 -7470 C
-ATOM 2979 NE2 HIS L 189 -46.485 -0.585 -44.931 1.00180.70 N
-ANISOU 2979 NE2 HIS L 189 19670 25797 23191 644 480 -7143 N
-ATOM 2980 N LYS L 190 -43.826 -3.848 -39.764 1.00137.57 N
-ANISOU 2980 N LYS L 190 15906 20637 15726 -2186 2655 -6121 N
-ATOM 2981 CA LYS L 190 -43.028 -4.569 -38.776 1.00136.22 C
-ANISOU 2981 CA LYS L 190 16326 20474 14957 -2642 2921 -5791 C
-ATOM 2982 C LYS L 190 -42.256 -5.733 -39.387 1.00134.25 C
-ANISOU 2982 C LYS L 190 16251 20209 14550 -2807 2608 -5312 C
-ATOM 2983 O LYS L 190 -41.020 -5.724 -39.399 1.00124.41 O
-ANISOU 2983 O LYS L 190 15477 18894 12897 -2809 2255 -4923 O
-ATOM 2984 CB LYS L 190 -43.924 -5.073 -37.641 1.00135.05 C
-ANISOU 2984 CB LYS L 190 16118 20444 14750 -3014 3710 -6085 C
-ATOM 2985 N VAL L 191 -42.970 -6.741 -39.888 1.00138.15 N
-ANISOU 2985 N VAL L 191 16346 20772 15374 -2953 2745 -5376 N
-ATOM 2986 CA VAL L 191 -42.362 -7.975 -40.378 1.00130.81 C
-ANISOU 2986 CA VAL L 191 15615 19793 14293 -3143 2557 -4960 C
-ATOM 2987 C VAL L 191 -42.183 -7.894 -41.887 1.00128.39 C
-ANISOU 2987 C VAL L 191 14994 19447 14341 -2806 1927 -4864 C
-ATOM 2988 O VAL L 191 -43.067 -7.413 -42.608 1.00128.27 O
-ANISOU 2988 O VAL L 191 14420 19489 14829 -2536 1787 -5218 O
-ATOM 2989 CB VAL L 191 -43.212 -9.201 -39.992 1.00128.43 C
-ANISOU 2989 CB VAL L 191 15178 19529 14091 -3584 3146 -5090 C
-ATOM 2990 N TYR L 192 -41.035 -8.373 -42.367 1.00124.78 N
-ANISOU 2990 N TYR L 192 14910 18898 13602 -2791 1539 -4401 N
-ATOM 2991 CA TYR L 192 -40.729 -8.430 -43.791 1.00113.16 C
-ANISOU 2991 CA TYR L 192 13266 17361 12369 -2518 986 -4254 C
-ATOM 2992 C TYR L 192 -40.342 -9.857 -44.148 1.00108.41 C
-ANISOU 2992 C TYR L 192 12821 16715 11654 -2745 966 -3939 C
-ATOM 2993 O TYR L 192 -39.433 -10.428 -43.537 1.00113.82 O
-ANISOU 2993 O TYR L 192 14000 17359 11886 -2913 1036 -3592 O
-ATOM 2994 CB TYR L 192 -39.605 -7.452 -44.157 1.00107.27 C
-ANISOU 2994 CB TYR L 192 12834 16513 11411 -2246 542 -4029 C
-ATOM 2995 CG TYR L 192 -40.018 -5.997 -44.081 1.00112.72 C
-ANISOU 2995 CG TYR L 192 13414 17152 12262 -1961 504 -4343 C
-ATOM 2996 CD1 TYR L 192 -40.080 -5.336 -42.862 1.00121.07 C
-ANISOU 2996 CD1 TYR L 192 14656 18241 13106 -2071 849 -4518 C
-ATOM 2997 CD2 TYR L 192 -40.344 -5.285 -45.228 1.00111.92 C
-ANISOU 2997 CD2 TYR L 192 13101 16938 12486 -1551 124 -4465 C
-ATOM 2998 CE1 TYR L 192 -40.460 -4.009 -42.786 1.00125.92 C
-ANISOU 2998 CE1 TYR L 192 15220 18761 13863 -1791 839 -4818 C
-ATOM 2999 CE2 TYR L 192 -40.724 -3.956 -45.161 1.00118.27 C
-ANISOU 2999 CE2 TYR L 192 13893 17631 13412 -1233 91 -4740 C
-ATOM 3000 CZ TYR L 192 -40.781 -3.323 -43.938 1.00123.45 C
-ANISOU 3000 CZ TYR L 192 14711 18306 13887 -1359 462 -4921 C
-ATOM 3001 OH TYR L 192 -41.158 -2.001 -43.863 1.00125.33 O
-ANISOU 3001 OH TYR L 192 14987 18389 14243 -1026 454 -5206 O
-ATOM 3002 N ALA L 193 -41.031 -10.429 -45.133 1.00102.07 N
-ANISOU 3002 N ALA L 193 11617 15917 11248 -2720 845 -4080 N
-ATOM 3003 CA ALA L 193 -40.932 -11.847 -45.441 1.00121.12 C
-ANISOU 3003 CA ALA L 193 14145 18255 13619 -2986 929 -3882 C
-ATOM 3004 C ALA L 193 -40.743 -12.066 -46.934 1.00129.80 C
-ANISOU 3004 C ALA L 193 15082 19297 14941 -2740 403 -3796 C
-ATOM 3005 O ALA L 193 -41.252 -11.309 -47.767 1.00132.48 O
-ANISOU 3005 O ALA L 193 15041 19689 15607 -2422 71 -4046 O
-ATOM 3006 CB ALA L 193 -42.177 -12.611 -44.973 1.00107.00 C
-ANISOU 3006 CB ALA L 193 12039 16524 12093 -3387 1494 -4240 C
-ATOM 3007 N CYS L 194 -40.020 -13.135 -47.255 1.00133.23 N
-ANISOU 3007 N CYS L 194 15859 19602 15162 -2862 336 -3443 N
-ATOM 3008 CA CYS L 194 -39.717 -13.529 -48.623 1.00135.27 C
-ANISOU 3008 CA CYS L 194 16077 19774 15544 -2677 -102 -3320 C
-ATOM 3009 C CYS L 194 -40.188 -14.963 -48.817 1.00133.44 C
-ANISOU 3009 C CYS L 194 15837 19450 15416 -3018 138 -3354 C
-ATOM 3010 O CYS L 194 -39.726 -15.869 -48.112 1.00130.28 O
-ANISOU 3010 O CYS L 194 15878 18918 14703 -3273 458 -3089 O
-ATOM 3011 CB CYS L 194 -38.216 -13.396 -48.898 1.00141.07 C
-ANISOU 3011 CB CYS L 194 17271 20418 15910 -2469 -414 -2865 C
-ATOM 3012 SG CYS L 194 -37.648 -14.069 -50.472 1.00150.31 S
-ANISOU 3012 SG CYS L 194 18537 21448 17128 -2287 -838 -2654 S
-ATOM 3013 N GLU L 195 -41.116 -15.165 -49.753 1.00134.89 N
-ANISOU 3013 N GLU L 195 15551 19687 16016 -3013 -22 -3700 N
-ATOM 3014 CA GLU L 195 -41.671 -16.485 -50.031 1.00138.22 C
-ANISOU 3014 CA GLU L 195 15910 20013 16595 -3393 207 -3827 C
-ATOM 3015 C GLU L 195 -41.078 -17.047 -51.319 1.00133.21 C
-ANISOU 3015 C GLU L 195 15464 19233 15915 -3213 -237 -3617 C
-ATOM 3016 O GLU L 195 -41.006 -16.346 -52.336 1.00135.04 O
-ANISOU 3016 O GLU L 195 15521 19531 16257 -2822 -754 -3674 O
-ATOM 3017 CB GLU L 195 -43.196 -16.436 -50.130 1.00145.35 C
-ANISOU 3017 CB GLU L 195 16082 21121 18024 -3592 371 -4462 C
-ATOM 3018 CG GLU L 195 -43.839 -17.818 -50.150 1.00154.14 C
-ANISOU 3018 CG GLU L 195 17135 22125 19307 -4147 777 -4663 C
-ATOM 3019 CD GLU L 195 -45.346 -17.772 -50.314 1.00162.00 C
-ANISOU 3019 CD GLU L 195 17280 23387 20885 -4377 920 -5380 C
-ATOM 3020 OE1 GLU L 195 -45.842 -16.875 -51.025 1.00165.49 O
-ANISOU 3020 OE1 GLU L 195 17162 24083 21635 -3952 417 -5704 O
-ATOM 3021 OE2 GLU L 195 -46.033 -18.644 -49.738 1.00163.82 O
-ANISOU 3021 OE2 GLU L 195 17413 23568 21263 -4976 1543 -5639 O
-ATOM 3022 N VAL L 196 -40.677 -18.318 -51.270 1.00125.10 N
-ANISOU 3022 N VAL L 196 14858 17974 14701 -3487 -8 -3379 N
-ATOM 3023 CA VAL L 196 -39.963 -18.988 -52.352 1.00114.45 C
-ANISOU 3023 CA VAL L 196 13808 16441 13237 -3334 -337 -3132 C
-ATOM 3024 C VAL L 196 -40.690 -20.284 -52.691 1.00111.70 C
-ANISOU 3024 C VAL L 196 13426 15931 13085 -3759 -91 -3362 C
-ATOM 3025 O VAL L 196 -40.879 -21.143 -51.820 1.00106.97 O
-ANISOU 3025 O VAL L 196 13102 15157 12387 -4177 455 -3322 O
-ATOM 3026 CB VAL L 196 -38.498 -19.277 -51.976 1.00105.75 C
-ANISOU 3026 CB VAL L 196 13352 15172 11657 -3166 -332 -2568 C
-ATOM 3027 CG1 VAL L 196 -37.898 -20.316 -52.912 1.00108.54 C
-ANISOU 3027 CG1 VAL L 196 14048 15285 11907 -3111 -485 -2357 C
-ATOM 3028 CG2 VAL L 196 -37.678 -17.997 -52.002 1.00 92.66 C
-ANISOU 3028 CG2 VAL L 196 11684 13672 9851 -2760 -670 -2393 C
-ATOM 3029 N THR L 197 -41.089 -20.424 -53.954 1.00116.15 N
-ANISOU 3029 N THR L 197 13714 16525 13892 -3666 -484 -3612 N
-ATOM 3030 CA THR L 197 -41.689 -21.642 -54.483 1.00120.51 C
-ANISOU 3030 CA THR L 197 14245 16915 14629 -4061 -339 -3864 C
-ATOM 3031 C THR L 197 -40.754 -22.227 -55.532 1.00108.57 C
-ANISOU 3031 C THR L 197 13210 15164 12877 -3823 -670 -3546 C
-ATOM 3032 O THR L 197 -40.286 -21.507 -56.421 1.00106.54 O
-ANISOU 3032 O THR L 197 12924 15003 12554 -3363 -1190 -3451 O
-ATOM 3033 CB THR L 197 -43.068 -21.364 -55.093 1.00128.96 C
-ANISOU 3033 CB THR L 197 14520 18271 16210 -4175 -546 -4539 C
-ATOM 3034 OG1 THR L 197 -43.959 -20.888 -54.077 1.00135.94 O
-ANISOU 3034 OG1 THR L 197 14921 19381 17349 -4417 -156 -4879 O
-ATOM 3035 CG2 THR L 197 -43.646 -22.628 -55.710 1.00134.19 C
-ANISOU 3035 CG2 THR L 197 15147 18772 17065 -4630 -429 -4852 C
-ATOM 3036 N HIS L 198 -40.483 -23.527 -55.426 1.00103.17 N
-ANISOU 3036 N HIS L 198 13019 14136 12046 -4131 -330 -3387 N
-ATOM 3037 CA HIS L 198 -39.532 -24.184 -56.309 1.00100.90 C
-ANISOU 3037 CA HIS L 198 13243 13585 11509 -3900 -556 -3074 C
-ATOM 3038 C HIS L 198 -39.905 -25.652 -56.448 1.00109.73 C
-ANISOU 3038 C HIS L 198 14679 14341 12671 -4373 -196 -3204 C
-ATOM 3039 O HIS L 198 -40.527 -26.236 -55.557 1.00109.30 O
-ANISOU 3039 O HIS L 198 14681 14153 12696 -4869 353 -3342 O
-ATOM 3040 CB HIS L 198 -38.098 -24.041 -55.786 1.00102.06 C
-ANISOU 3040 CB HIS L 198 13925 13629 11225 -3531 -536 -2478 C
-ATOM 3041 CG HIS L 198 -37.052 -24.502 -56.751 1.00100.05 C
-ANISOU 3041 CG HIS L 198 14087 13179 10747 -3202 -797 -2190 C
-ATOM 3042 ND1 HIS L 198 -36.265 -25.609 -56.521 1.00 94.97 N
-ANISOU 3042 ND1 HIS L 198 14069 12188 9829 -3189 -546 -1857 N
-ATOM 3043 CD2 HIS L 198 -36.665 -24.009 -57.952 1.00102.08 C
-ANISOU 3043 CD2 HIS L 198 14262 13523 10999 -2855 -1257 -2196 C
-ATOM 3044 CE1 HIS L 198 -35.437 -25.778 -57.537 1.00 93.38 C
-ANISOU 3044 CE1 HIS L 198 14082 11898 9502 -2851 -831 -1696 C
-ATOM 3045 NE2 HIS L 198 -35.660 -24.820 -58.419 1.00 91.00 N
-ANISOU 3045 NE2 HIS L 198 13377 11852 9347 -2672 -1241 -1893 N
-ATOM 3046 N GLN L 199 -39.512 -26.246 -57.578 1.00124.78 N
-ANISOU 3046 N GLN L 199 16851 16056 14505 -4238 -464 -3168 N
-ATOM 3047 CA GLN L 199 -39.844 -27.639 -57.859 1.00141.45 C
-ANISOU 3047 CA GLN L 199 19313 17778 16655 -4680 -155 -3324 C
-ATOM 3048 C GLN L 199 -39.088 -28.621 -56.974 1.00148.76 C
-ANISOU 3048 C GLN L 199 21043 18249 17232 -4767 366 -2866 C
-ATOM 3049 O GLN L 199 -39.350 -29.826 -57.055 1.00159.44 O
-ANISOU 3049 O GLN L 199 22816 19184 18582 -5164 725 -2961 O
-ATOM 3050 CB GLN L 199 -39.572 -27.960 -59.332 1.00137.45 C
-ANISOU 3050 CB GLN L 199 18928 17179 16116 -4462 -603 -3409 C
-ATOM 3051 N GLY L 200 -38.169 -28.144 -56.138 1.00133.61 N
-ANISOU 3051 N GLY L 200 19377 16385 15004 -4396 400 -2395 N
-ATOM 3052 CA GLY L 200 -37.410 -29.013 -55.262 1.00123.38 C
-ANISOU 3052 CA GLY L 200 18869 14687 13320 -4357 804 -1947 C
-ATOM 3053 C GLY L 200 -37.700 -28.783 -53.793 1.00118.80 C
-ANISOU 3053 C GLY L 200 18371 14145 12622 -4577 1237 -1857 C
-ATOM 3054 O GLY L 200 -36.949 -29.239 -52.926 1.00110.35 O
-ANISOU 3054 O GLY L 200 17964 12821 11141 -4402 1471 -1428 O
-ATOM 3055 N LEU L 201 -38.787 -28.072 -53.500 1.00115.80 N
-ANISOU 3055 N LEU L 201 17335 14085 12578 -4923 1334 -2276 N
-ATOM 3056 CA LEU L 201 -39.217 -27.803 -52.135 1.00120.43 C
-ANISOU 3056 CA LEU L 201 17951 14726 13081 -5196 1806 -2275 C
-ATOM 3057 C LEU L 201 -40.596 -28.411 -51.917 1.00129.97 C
-ANISOU 3057 C LEU L 201 18959 15797 14625 -5968 2378 -2784 C
-ATOM 3058 O LEU L 201 -41.491 -28.242 -52.751 1.00138.27 O
-ANISOU 3058 O LEU L 201 19318 17071 16148 -6206 2197 -3314 O
-ATOM 3059 CB LEU L 201 -39.248 -26.297 -51.849 1.00120.26 C
-ANISOU 3059 CB LEU L 201 17298 15232 13164 -4904 1483 -2350 C
-ATOM 3060 CG LEU L 201 -37.918 -25.539 -51.904 1.00103.72 C
-ANISOU 3060 CG LEU L 201 15336 13314 10759 -4237 994 -1909 C
-ATOM 3061 N SER L 202 -40.763 -29.120 -50.798 1.00133.31 N
-ANISOU 3061 N SER L 202 20001 15858 14794 -6361 3072 -2646 N
-ATOM 3062 CA SER L 202 -42.046 -29.752 -50.509 1.00142.25 C
-ANISOU 3062 CA SER L 202 20993 16817 16237 -7192 3752 -3145 C
-ATOM 3063 C SER L 202 -43.132 -28.724 -50.217 1.00148.53 C
-ANISOU 3063 C SER L 202 20799 18149 17486 -7446 3822 -3688 C
-ATOM 3064 O SER L 202 -44.309 -28.969 -50.508 1.00149.71 O
-ANISOU 3064 O SER L 202 20364 18391 18127 -8041 4100 -4315 O
-ATOM 3065 CB SER L 202 -41.899 -30.717 -49.333 1.00150.74 C
-ANISOU 3065 CB SER L 202 23112 17314 16847 -7532 4536 -2817 C
-ATOM 3066 OG SER L 202 -41.448 -30.037 -48.175 1.00155.95 O
-ANISOU 3066 OG SER L 202 24018 18121 17117 -7238 4619 -2472 O
-ATOM 3067 N SER L 203 -42.763 -27.580 -49.647 1.00151.61 N
-ANISOU 3067 N SER L 203 20969 18902 17736 -7003 3577 -3500 N
-ATOM 3068 CA SER L 203 -43.690 -26.507 -49.322 1.00153.78 C
-ANISOU 3068 CA SER L 203 20356 19674 18400 -7119 3618 -3974 C
-ATOM 3069 C SER L 203 -43.004 -25.172 -49.565 1.00152.85 C
-ANISOU 3069 C SER L 203 19902 19963 18211 -6379 2899 -3766 C
-ATOM 3070 O SER L 203 -41.775 -25.078 -49.463 1.00153.01 O
-ANISOU 3070 O SER L 203 20492 19869 17777 -5892 2602 -3201 O
-ATOM 3071 CB SER L 203 -44.162 -26.589 -47.861 1.00154.43 C
-ANISOU 3071 CB SER L 203 20730 19642 18303 -7580 4449 -4005 C
-ATOM 3072 N PRO L 204 -43.766 -24.131 -49.903 1.00153.24 N
-ANISOU 3072 N PRO L 204 19037 20480 18707 -6273 2613 -4234 N
-ATOM 3073 CA PRO L 204 -43.161 -22.806 -50.126 1.00147.32 C
-ANISOU 3073 CA PRO L 204 18037 20054 17885 -5602 1986 -4054 C
-ATOM 3074 C PRO L 204 -42.406 -22.321 -48.898 1.00141.74 C
-ANISOU 3074 C PRO L 204 17830 19318 16706 -5420 2196 -3627 C
-ATOM 3075 O PRO L 204 -42.982 -22.134 -47.823 1.00140.44 O
-ANISOU 3075 O PRO L 204 17622 19208 16531 -5728 2735 -3795 O
-ATOM 3076 CB PRO L 204 -44.371 -21.918 -50.438 1.00152.01 C
-ANISOU 3076 CB PRO L 204 17629 21084 19044 -5618 1835 -4707 C
-ATOM 3077 CG PRO L 204 -45.385 -22.858 -50.999 1.00158.36 C
-ANISOU 3077 CG PRO L 204 18057 21846 20267 -6155 2049 -5225 C
-ATOM 3078 CD PRO L 204 -45.199 -24.148 -50.247 1.00160.15 C
-ANISOU 3078 CD PRO L 204 19048 21602 20200 -6724 2785 -4986 C
-ATOM 3079 N VAL L 205 -41.104 -22.112 -49.068 1.00137.80 N
-ANISOU 3079 N VAL L 205 17791 18752 15814 -4925 1770 -3107 N
-ATOM 3080 CA VAL L 205 -40.219 -21.745 -47.967 1.00134.43 C
-ANISOU 3080 CA VAL L 205 17880 18308 14889 -4716 1868 -2692 C
-ATOM 3081 C VAL L 205 -40.264 -20.234 -47.781 1.00133.46 C
-ANISOU 3081 C VAL L 205 17272 18561 14877 -4411 1583 -2840 C
-ATOM 3082 O VAL L 205 -39.981 -19.477 -48.715 1.00131.06 O
-ANISOU 3082 O VAL L 205 16625 18426 14744 -4027 1022 -2870 O
-ATOM 3083 CB VAL L 205 -38.783 -22.223 -48.226 1.00128.81 C
-ANISOU 3083 CB VAL L 205 17800 17398 13744 -4323 1534 -2136 C
-ATOM 3084 CG1 VAL L 205 -37.840 -21.671 -47.169 1.00119.49 C
-ANISOU 3084 CG1 VAL L 205 17010 16309 12084 -4040 1488 -1785 C
-ATOM 3085 CG2 VAL L 205 -38.728 -23.743 -48.253 1.00137.45 C
-ANISOU 3085 CG2 VAL L 205 19509 18047 14670 -4591 1880 -1966 C
-ATOM 3086 N THR L 206 -40.608 -19.796 -46.573 1.00134.92 N
-ANISOU 3086 N THR L 206 17504 18832 14928 -4582 1999 -2929 N
-ATOM 3087 CA THR L 206 -40.707 -18.381 -46.239 1.00124.66 C
-ANISOU 3087 CA THR L 206 15819 17838 13708 -4332 1824 -3097 C
-ATOM 3088 C THR L 206 -39.619 -18.018 -45.238 1.00114.66 C
-ANISOU 3088 C THR L 206 15133 16561 11871 -4130 1804 -2692 C
-ATOM 3089 O THR L 206 -39.414 -18.735 -44.253 1.00121.03 O
-ANISOU 3089 O THR L 206 16539 17183 12265 -4346 2221 -2475 O
-ATOM 3090 CB THR L 206 -42.087 -18.052 -45.663 1.00125.87 C
-ANISOU 3090 CB THR L 206 15461 18149 14214 -4682 2328 -3635 C
-ATOM 3091 OG1 THR L 206 -43.107 -18.563 -46.531 1.00129.46 O
-ANISOU 3091 OG1 THR L 206 15354 18638 15197 -4926 2363 -4062 O
-ATOM 3092 CG2 THR L 206 -42.261 -16.548 -45.521 1.00122.11 C
-ANISOU 3092 CG2 THR L 206 14546 17963 13889 -4346 2088 -3857 C
-ATOM 3093 N LYS L 207 -38.920 -16.912 -45.493 1.00107.07 N
-ANISOU 3093 N LYS L 207 14030 15784 10866 -3722 1317 -2606 N
-ATOM 3094 CA LYS L 207 -37.896 -16.402 -44.586 1.00108.22 C
-ANISOU 3094 CA LYS L 207 14604 15993 10521 -3536 1226 -2320 C
-ATOM 3095 C LYS L 207 -38.218 -14.952 -44.257 1.00115.45 C
-ANISOU 3095 C LYS L 207 15159 17131 11574 -3421 1168 -2607 C
-ATOM 3096 O LYS L 207 -38.274 -14.108 -45.157 1.00117.18 O
-ANISOU 3096 O LYS L 207 14969 17444 12111 -3170 787 -2754 O
-ATOM 3097 CB LYS L 207 -36.495 -16.520 -45.195 1.00102.43 C
-ANISOU 3097 CB LYS L 207 14117 15241 9560 -3182 704 -1930 C
-ATOM 3098 CG LYS L 207 -35.965 -17.944 -45.272 1.00102.50 C
-ANISOU 3098 CG LYS L 207 14630 15007 9310 -3209 771 -1593 C
-ATOM 3099 CD LYS L 207 -35.925 -18.597 -43.897 1.00107.89 C
-ANISOU 3099 CD LYS L 207 15937 15555 9502 -3391 1204 -1421 C
-ATOM 3100 CE LYS L 207 -35.476 -20.052 -43.978 1.00108.53 C
-ANISOU 3100 CE LYS L 207 16614 15312 9311 -3379 1298 -1083 C
-ATOM 3101 NZ LYS L 207 -34.078 -20.182 -44.476 1.00 98.77 N1+
-ANISOU 3101 NZ LYS L 207 15528 14127 7873 -2912 756 -751 N1+
-ATOM 3102 N SER L 208 -38.420 -14.664 -42.972 1.00122.01 N
-ANISOU 3102 N SER L 208 16221 18010 12127 -3587 1557 -2680 N
-ATOM 3103 CA SER L 208 -38.892 -13.362 -42.525 1.00113.97 C
-ANISOU 3103 CA SER L 208 14901 17164 11240 -3522 1624 -3008 C
-ATOM 3104 C SER L 208 -37.991 -12.818 -41.426 1.00109.68 C
-ANISOU 3104 C SER L 208 14838 16686 10148 -3451 1596 -2828 C
-ATOM 3105 O SER L 208 -37.216 -13.549 -40.805 1.00109.11 O
-ANISOU 3105 O SER L 208 15333 16549 9576 -3488 1618 -2494 O
-ATOM 3106 CB SER L 208 -40.336 -13.437 -42.009 1.00113.69 C
-ANISOU 3106 CB SER L 208 14547 17158 11492 -3848 2233 -3447 C
-ATOM 3107 N PHE L 209 -38.111 -11.512 -41.194 1.00116.05 N
-ANISOU 3107 N PHE L 209 15435 17617 11043 -3322 1522 -3077 N
-ATOM 3108 CA PHE L 209 -37.411 -10.852 -40.103 1.00127.68 C
-ANISOU 3108 CA PHE L 209 17310 19175 12029 -3301 1522 -3022 C
-ATOM 3109 C PHE L 209 -38.261 -9.692 -39.608 1.00138.04 C
-ANISOU 3109 C PHE L 209 18367 20551 13529 -3318 1796 -3455 C
-ATOM 3110 O PHE L 209 -39.119 -9.174 -40.328 1.00141.99 O
-ANISOU 3110 O PHE L 209 18336 21053 14559 -3205 1790 -3759 O
-ATOM 3111 CB PHE L 209 -36.015 -10.364 -40.526 1.00119.40 C
-ANISOU 3111 CB PHE L 209 16376 18193 10797 -3045 927 -2781 C
-ATOM 3112 CG PHE L 209 -36.030 -9.164 -41.440 1.00113.49 C
-ANISOU 3112 CG PHE L 209 15230 17445 10445 -2834 618 -2974 C
-ATOM 3113 CD1 PHE L 209 -35.969 -7.878 -40.925 1.00111.14 C
-ANISOU 3113 CD1 PHE L 209 14956 17189 10084 -2794 623 -3209 C
-ATOM 3114 CD2 PHE L 209 -36.077 -9.323 -42.815 1.00113.94 C
-ANISOU 3114 CD2 PHE L 209 14982 17422 10888 -2669 329 -2914 C
-ATOM 3115 CE1 PHE L 209 -35.978 -6.778 -41.761 1.00108.38 C
-ANISOU 3115 CE1 PHE L 209 14366 16757 10055 -2588 372 -3364 C
-ATOM 3116 CE2 PHE L 209 -36.082 -8.224 -43.657 1.00104.86 C
-ANISOU 3116 CE2 PHE L 209 13601 16214 10027 -2448 57 -3060 C
-ATOM 3117 CZ PHE L 209 -36.033 -6.951 -43.129 1.00101.55 C
-ANISOU 3117 CZ PHE L 209 13246 15795 9544 -2404 89 -3275 C
-ATOM 3118 N ASN L 210 -38.016 -9.292 -38.364 1.00136.62 N
-ANISOU 3118 N ASN L 210 18596 20427 12888 -3421 2018 -3498 N
-ATOM 3119 CA ASN L 210 -38.659 -8.125 -37.779 1.00136.15 C
-ANISOU 3119 CA ASN L 210 18395 20411 12922 -3414 2280 -3903 C
-ATOM 3120 C ASN L 210 -37.763 -6.905 -37.948 1.00126.38 C
-ANISOU 3120 C ASN L 210 17214 19202 11603 -3186 1814 -3915 C
-ATOM 3121 O ASN L 210 -36.535 -7.014 -37.967 1.00124.87 O
-ANISOU 3121 O ASN L 210 17309 19060 11075 -3141 1412 -3626 O
-ATOM 3122 CB ASN L 210 -38.971 -8.353 -36.300 1.00146.87 C
-ANISOU 3122 CB ASN L 210 20226 21786 13794 -3691 2855 -3990 C
-ATOM 3123 CG ASN L 210 -39.886 -9.540 -36.075 1.00151.86 C
-ANISOU 3123 CG ASN L 210 20871 22337 14491 -4003 3439 -4008 C
-ATOM 3124 OD1 ASN L 210 -40.644 -9.933 -36.963 1.00145.90 O
-ANISOU 3124 OD1 ASN L 210 19581 21559 14294 -4031 3501 -4142 O
-ATOM 3125 ND2 ASN L 210 -39.825 -10.116 -34.879 1.00157.37 N
-ANISOU 3125 ND2 ASN L 210 22219 22979 14597 -4257 3882 -3893 N
-ATOM 3126 N ARG L 211 -38.397 -5.732 -38.057 1.00123.36 N
-ANISOU 3126 N ARG L 211 16551 18780 11540 -3045 1894 -4286 N
-ATOM 3127 CA ARG L 211 -37.672 -4.529 -38.458 1.00131.39 C
-ANISOU 3127 CA ARG L 211 17608 19731 12582 -2842 1486 -4326 C
-ATOM 3128 C ARG L 211 -36.588 -4.146 -37.456 1.00140.21 C
-ANISOU 3128 C ARG L 211 19234 20930 13110 -2988 1387 -4255 C
-ATOM 3129 O ARG L 211 -35.528 -3.646 -37.852 1.00143.53 O
-ANISOU 3129 O ARG L 211 19745 21345 13443 -2934 964 -4142 O
-ATOM 3130 CB ARG L 211 -38.647 -3.367 -38.651 1.00133.39 C
-ANISOU 3130 CB ARG L 211 17567 19870 13246 -2623 1644 -4751 C
-ATOM 3131 CG ARG L 211 -37.990 -2.096 -39.163 1.00133.36 C
-ANISOU 3131 CG ARG L 211 17687 19695 13288 -2417 1279 -4797 C
-ATOM 3132 CD ARG L 211 -38.980 -1.221 -39.913 1.00134.96 C
-ANISOU 3132 CD ARG L 211 17555 19718 14007 -2041 1274 -5104 C
-ATOM 3133 NE ARG L 211 -40.093 -0.801 -39.070 1.00143.24 N
-ANISOU 3133 NE ARG L 211 18460 20796 15167 -2000 1759 -5529 N
-ATOM 3134 CZ ARG L 211 -40.078 0.293 -38.317 1.00146.53 C
-ANISOU 3134 CZ ARG L 211 19160 21095 15418 -1969 1946 -5795 C
-ATOM 3135 NH1 ARG L 211 -39.009 1.080 -38.318 1.00141.01 N1+
-ANISOU 3135 NH1 ARG L 211 18896 20237 14446 -2015 1677 -5692 N1+
-ATOM 3136 NH2 ARG L 211 -41.131 0.609 -37.576 1.00155.83 N
-ANISOU 3136 NH2 ARG L 211 20177 22312 16719 -1913 2431 -6203 N
-ATOM 3137 N GLY L 212 -36.821 -4.375 -36.166 1.00140.72 N
-ANISOU 3137 N GLY L 212 19639 21078 12751 -3189 1777 -4345 N
-ATOM 3138 CA GLY L 212 -35.850 -3.981 -35.163 1.00145.23 C
-ANISOU 3138 CA GLY L 212 20703 21756 12722 -3305 1641 -4334 C
-ATOM 3139 C GLY L 212 -35.274 -5.117 -34.341 1.00150.81 C
-ANISOU 3139 C GLY L 212 21873 22606 12823 -3437 1636 -4033 C
-ATOM 3140 O GLY L 212 -34.236 -4.951 -33.693 1.00148.76 O
-ANISOU 3140 O GLY L 212 21979 22493 12049 -3466 1331 -3970 O
-ATOM 3141 N GLU L 213 -35.933 -6.272 -34.356 1.00156.37 N
-ANISOU 3141 N GLU L 213 22591 23258 13567 -3511 1961 -3868 N
-ATOM 3142 CA GLU L 213 -35.519 -7.405 -33.534 1.00158.88 C
-ANISOU 3142 CA GLU L 213 23483 23620 13263 -3607 2037 -3564 C
-ATOM 3143 C GLU L 213 -34.137 -7.926 -33.924 1.00155.54 C
-ANISOU 3143 C GLU L 213 23178 23318 12601 -3425 1385 -3196 C
-ATOM 3144 O GLU L 213 -33.670 -7.709 -35.042 1.00153.74 O
-ANISOU 3144 O GLU L 213 22514 23106 12793 -3283 981 -3130 O
-ATOM 3145 CB GLU L 213 -36.547 -8.534 -33.630 1.00159.74 C
-ANISOU 3145 CB GLU L 213 23577 23573 13542 -3768 2572 -3479 C
-TER 3146 GLU L 213
-ATOM 3147 N LYS M 40 -39.784 -32.677-149.001 1.00154.19 N
-ANISOU 3147 N LYS M 40 23076 19100 16407 2456 -2915 -1740 N
-ATOM 3148 CA LYS M 40 -41.225 -32.821-148.827 1.00153.94 C
-ANISOU 3148 CA LYS M 40 22734 19260 16498 2705 -3248 -1784 C
-ATOM 3149 C LYS M 40 -41.548 -34.024-147.946 1.00157.98 C
-ANISOU 3149 C LYS M 40 22673 20084 17271 2659 -3070 -1823 C
-ATOM 3150 O LYS M 40 -42.180 -34.981-148.395 1.00159.27 O
-ANISOU 3150 O LYS M 40 22709 20361 17444 2543 -3154 -1845 O
-ATOM 3151 CB LYS M 40 -41.917 -32.959-150.184 1.00147.27 C
-ANISOU 3151 CB LYS M 40 22201 18303 15451 2658 -3564 -1784 C
-ATOM 3152 N TYR M 41 -41.114 -33.967-146.687 1.00155.11 N
-ANISOU 3152 N TYR M 41 22007 19837 17089 2723 -2840 -1828 N
-ATOM 3153 CA TYR M 41 -41.270 -35.065-145.740 1.00146.53 C
-ANISOU 3153 CA TYR M 41 20461 18999 16215 2644 -2649 -1854 C
-ATOM 3154 C TYR M 41 -42.037 -34.567-144.524 1.00152.32 C
-ANISOU 3154 C TYR M 41 20774 19985 17116 2896 -2732 -1902 C
-ATOM 3155 O TYR M 41 -41.602 -33.622-143.857 1.00155.84 O
-ANISOU 3155 O TYR M 41 21256 20366 17589 3067 -2678 -1895 O
-ATOM 3156 CB TYR M 41 -39.907 -35.627-145.325 1.00134.03 C
-ANISOU 3156 CB TYR M 41 18922 17326 14676 2467 -2268 -1831 C
-ATOM 3157 CG TYR M 41 -39.202 -36.416-146.410 1.00134.87 C
-ANISOU 3157 CG TYR M 41 19339 17271 14634 2229 -2144 -1832 C
-ATOM 3158 CD1 TYR M 41 -38.723 -35.790-147.556 1.00137.01 C
-ANISOU 3158 CD1 TYR M 41 20054 17330 14673 2150 -2183 -1816 C
-ATOM 3159 CD2 TYR M 41 -39.012 -37.786-146.287 1.00134.42 C
-ANISOU 3159 CD2 TYR M 41 19174 17263 14637 2078 -1994 -1858 C
-ATOM 3160 CE1 TYR M 41 -38.081 -36.507-148.550 1.00135.27 C
-ANISOU 3160 CE1 TYR M 41 20105 16996 14296 1936 -2047 -1842 C
-ATOM 3161 CE2 TYR M 41 -38.369 -38.512-147.276 1.00131.51 C
-ANISOU 3161 CE2 TYR M 41 19100 16749 14118 1908 -1887 -1887 C
-ATOM 3162 CZ TYR M 41 -37.907 -37.868-148.404 1.00129.85 C
-ANISOU 3162 CZ TYR M 41 19272 16374 13690 1842 -1899 -1887 C
-ATOM 3163 OH TYR M 41 -37.267 -38.588-149.387 1.00120.89 O
-ANISOU 3163 OH TYR M 41 18418 15128 12387 1675 -1770 -1939 O
-ATOM 3164 N GLN M 42 -43.173 -35.204-144.236 1.00150.74 N
-ANISOU 3164 N GLN M 42 20180 20091 17005 2893 -2854 -1963 N
-ATOM 3165 CA GLN M 42 -44.001 -34.855-143.081 1.00143.99 C
-ANISOU 3165 CA GLN M 42 18858 19562 16290 3104 -2907 -2044 C
-ATOM 3166 C GLN M 42 -43.496 -35.637-141.871 1.00127.77 C
-ANISOU 3166 C GLN M 42 16553 17612 14380 2928 -2575 -2020 C
-ATOM 3167 O GLN M 42 -43.769 -36.831-141.723 1.00132.99 O
-ANISOU 3167 O GLN M 42 17048 18412 15070 2659 -2487 -2018 O
-ATOM 3168 CB GLN M 42 -45.475 -35.128-143.375 1.00151.99 C
-ANISOU 3168 CB GLN M 42 19531 20921 17296 3149 -3193 -2149 C
-ATOM 3169 CG GLN M 42 -45.786 -36.523-143.922 1.00155.27 C
-ANISOU 3169 CG GLN M 42 19898 21422 17675 2766 -3166 -2128 C
-ATOM 3170 CD GLN M 42 -46.503 -36.491-145.261 1.00157.28 C
-ANISOU 3170 CD GLN M 42 20317 21658 17785 2774 -3507 -2157 C
-ATOM 3171 OE1 GLN M 42 -46.155 -35.714-146.150 1.00157.57 O
-ANISOU 3171 OE1 GLN M 42 20777 21396 17695 2931 -3666 -2123 O
-ATOM 3172 NE2 GLN M 42 -47.512 -37.342-145.410 1.00156.53 N
-ANISOU 3172 NE2 GLN M 42 19911 21881 17682 2569 -3629 -2220 N
-ATOM 3173 N LEU M 43 -42.752 -34.962-140.999 1.00110.41 N
-ANISOU 3173 N LEU M 43 14376 15324 12249 3066 -2412 -1999 N
-ATOM 3174 CA LEU M 43 -42.116 -35.607-139.863 1.00 95.62 C
-ANISOU 3174 CA LEU M 43 12344 13492 10495 2925 -2117 -1969 C
-ATOM 3175 C LEU M 43 -42.407 -34.848-138.578 1.00 91.94 C
-ANISOU 3175 C LEU M 43 11594 13210 10128 3151 -2085 -2020 C
-ATOM 3176 O LEU M 43 -42.557 -33.623-138.594 1.00 94.68 O
-ANISOU 3176 O LEU M 43 12021 13511 10442 3445 -2235 -2055 O
-ATOM 3177 CB LEU M 43 -40.597 -35.701-140.064 1.00 75.48 C
-ANISOU 3177 CB LEU M 43 10134 10628 7916 2820 -1898 -1895 C
-ATOM 3178 CG LEU M 43 -40.123 -36.577-141.224 1.00 78.60 C
-ANISOU 3178 CG LEU M 43 10810 10850 8206 2597 -1865 -1869 C
-ATOM 3179 CD1 LEU M 43 -38.603 -36.597-141.295 1.00 73.78 C
-ANISOU 3179 CD1 LEU M 43 10441 10024 7568 2533 -1625 -1847 C
-ATOM 3180 CD2 LEU M 43 -40.678 -37.987-141.093 1.00 75.97 C
-ANISOU 3180 CD2 LEU M 43 10319 10646 7900 2377 -1848 -1879 C
-ATOM 3181 N PRO M 44 -42.498 -35.554-137.449 1.00 82.75 N
-ANISOU 3181 N PRO M 44 10147 12235 9061 3017 -1903 -2029 N
-ATOM 3182 CA PRO M 44 -42.702 -34.878-136.157 1.00 84.77 C
-ANISOU 3182 CA PRO M 44 10149 12664 9395 3210 -1836 -2083 C
-ATOM 3183 C PRO M 44 -41.508 -33.996-135.820 1.00 92.10 C
-ANISOU 3183 C PRO M 44 11355 13301 10338 3356 -1733 -2023 C
-ATOM 3184 O PRO M 44 -40.380 -34.479-135.688 1.00 97.64 O
-ANISOU 3184 O PRO M 44 12236 13803 11062 3189 -1543 -1947 O
-ATOM 3185 CB PRO M 44 -42.843 -36.041-135.166 1.00 76.39 C
-ANISOU 3185 CB PRO M 44 8849 11789 8386 2926 -1640 -2076 C
-ATOM 3186 CG PRO M 44 -43.206 -37.224-136.004 1.00 77.32 C
-ANISOU 3186 CG PRO M 44 9015 11927 8437 2621 -1692 -2054 C
-ATOM 3187 CD PRO M 44 -42.499 -37.020-137.308 1.00 79.74 C
-ANISOU 3187 CD PRO M 44 9710 11905 8684 2670 -1775 -1997 C
-ATOM 3188 N ASN M 45 -41.763 -32.696-135.675 1.00 94.75 N
-ANISOU 3188 N ASN M 45 11732 13624 10644 3675 -1878 -2074 N
-ATOM 3189 CA ASN M 45 -40.717 -31.709-135.450 1.00 92.19 C
-ANISOU 3189 CA ASN M 45 11725 13015 10289 3786 -1825 -2019 C
-ATOM 3190 C ASN M 45 -41.159 -30.760-134.342 1.00102.61 C
-ANISOU 3190 C ASN M 45 12888 14461 11638 4086 -1868 -2099 C
-ATOM 3191 O ASN M 45 -42.299 -30.812-133.871 1.00107.54 O
-ANISOU 3191 O ASN M 45 13144 15416 12299 4238 -1946 -2217 O
-ATOM 3192 CB ASN M 45 -40.417 -30.926-136.734 1.00 90.20 C
-ANISOU 3192 CB ASN M 45 11915 12478 9880 3846 -2013 -1984 C
-ATOM 3193 CG ASN M 45 -41.659 -30.306-137.310 1.00111.28 C
-ANISOU 3193 CG ASN M 45 14560 15249 12473 4134 -2350 -2078 C
-ATOM 3194 OD1 ASN M 45 -42.162 -29.316-136.780 1.00104.49 O
-ANISOU 3194 OD1 ASN M 45 13671 14437 11594 4471 -2505 -2160 O
-ATOM 3195 ND2 ASN M 45 -42.186 -30.886-138.382 1.00154.59 N
-ANISOU 3195 ND2 ASN M 45 20055 20775 17906 4035 -2488 -2084 N
-ATOM 3196 N PHE M 46 -40.246 -29.874-133.938 1.00104.32 N
-ANISOU 3196 N PHE M 46 13385 14433 11820 4159 -1816 -2050 N
-ATOM 3197 CA PHE M 46 -40.544 -28.848-132.942 1.00 93.85 C
-ANISOU 3197 CA PHE M 46 12017 13152 10489 4464 -1874 -2124 C
-ATOM 3198 C PHE M 46 -39.518 -27.729-133.059 1.00 96.65 C
-ANISOU 3198 C PHE M 46 12865 13133 10725 4498 -1911 -2050 C
-ATOM 3199 O PHE M 46 -38.315 -27.997-133.152 1.00 91.51 O
-ANISOU 3199 O PHE M 46 12390 12309 10072 4211 -1726 -1947 O
-ATOM 3200 CB PHE M 46 -40.537 -29.434-131.524 1.00 91.00 C
-ANISOU 3200 CB PHE M 46 11301 13019 10254 4383 -1636 -2145 C
-ATOM 3201 CG PHE M 46 -40.678 -28.401-130.436 1.00102.58 C
-ANISOU 3201 CG PHE M 46 12763 14509 11704 4672 -1658 -2219 C
-ATOM 3202 CD1 PHE M 46 -41.927 -27.911-130.086 1.00103.69 C
-ANISOU 3202 CD1 PHE M 46 12639 14935 11825 5017 -1809 -2390 C
-ATOM 3203 CD2 PHE M 46 -39.563 -27.916-129.768 1.00 97.93 C
-ANISOU 3203 CD2 PHE M 46 12423 13679 11107 4610 -1534 -2138 C
-ATOM 3204 CE1 PHE M 46 -42.061 -26.962-129.088 1.00 92.10 C
-ANISOU 3204 CE1 PHE M 46 11188 13484 10323 5318 -1830 -2480 C
-ATOM 3205 CE2 PHE M 46 -39.690 -26.966-128.774 1.00 92.04 C
-ANISOU 3205 CE2 PHE M 46 11717 12927 10326 4870 -1565 -2205 C
-ATOM 3206 CZ PHE M 46 -40.942 -26.488-128.434 1.00 92.13 C
-ANISOU 3206 CZ PHE M 46 11498 13197 10311 5236 -1710 -2377 C
-ATOM 3207 N THR M 47 -39.993 -26.485-133.048 1.00102.51 N
-ANISOU 3207 N THR M 47 13835 13766 11349 4846 -2160 -2119 N
-ATOM 3208 CA THR M 47 -39.149 -25.300-133.098 1.00107.10 C
-ANISOU 3208 CA THR M 47 14955 13972 11765 4868 -2237 -2056 C
-ATOM 3209 C THR M 47 -39.205 -24.585-131.752 1.00106.00 C
-ANISOU 3209 C THR M 47 14767 13862 11646 5106 -2214 -2118 C
-ATOM 3210 O THR M 47 -40.196 -24.683-131.021 1.00122.85 O
-ANISOU 3210 O THR M 47 16514 16295 13867 5388 -2242 -2253 O
-ATOM 3211 CB THR M 47 -39.582 -24.364-134.235 1.00111.32 C
-ANISOU 3211 CB THR M 47 15963 14252 12083 5075 -2598 -2075 C
-ATOM 3212 OG1 THR M 47 -39.826 -25.142-135.413 1.00102.18 O
-ANISOU 3212 OG1 THR M 47 14757 13144 10921 4905 -2638 -2048 O
-ATOM 3213 CG2 THR M 47 -38.500 -23.336-134.550 1.00121.83 C
-ANISOU 3213 CG2 THR M 47 17956 15147 13185 4906 -2644 -1968 C
-ATOM 3214 N ALA M 48 -38.124 -23.877-131.417 1.00 90.68 N
-ANISOU 3214 N ALA M 48 13211 11636 9608 4964 -2149 -2031 N
-ATOM 3215 CA ALA M 48 -37.938 -23.377-130.064 1.00105.15 C
-ANISOU 3215 CA ALA M 48 15001 13482 11469 5092 -2068 -2064 C
-ATOM 3216 C ALA M 48 -37.621 -21.894-129.956 1.00121.81 C
-ANISOU 3216 C ALA M 48 17707 15225 13350 5255 -2280 -2058 C
-ATOM 3217 O ALA M 48 -37.572 -21.383-128.835 1.00123.01 O
-ANISOU 3217 O ALA M 48 17865 15370 13502 5410 -2249 -2102 O
-ATOM 3218 CB ALA M 48 -36.823 -24.159-129.355 1.00103.61 C
-ANISOU 3218 CB ALA M 48 14610 13350 11406 4712 -1735 -1968 C
-ATOM 3219 N GLU M 49 -37.369 -21.202-131.063 1.00128.25 N
-ANISOU 3219 N GLU M 49 19072 15712 13944 5189 -2493 -2000 N
-ATOM 3220 CA GLU M 49 -37.186 -19.756-131.043 1.00128.43 C
-ANISOU 3220 CA GLU M 49 19771 15334 13693 5343 -2756 -1996 C
-ATOM 3221 C GLU M 49 -35.837 -19.410-130.425 1.00119.59 C
-ANISOU 3221 C GLU M 49 18897 14038 12502 4946 -2554 -1881 C
-ATOM 3222 O GLU M 49 -35.486 -18.233-130.327 1.00117.40 O
-ANISOU 3222 O GLU M 49 19232 13403 11971 4957 -2737 -1853 O
-ATOM 3223 CB GLU M 49 -38.330 -19.056-130.295 1.00116.09 C
-ANISOU 3223 CB GLU M 49 18167 13828 12114 5963 -3000 -2176 C
-ATOM 3224 N THR M 50 -35.069 -20.425-130.025 1.00104.91 N
-ANISOU 3224 N THR M 50 16592 12422 10846 4594 -2205 -1821 N
-ATOM 3225 CA THR M 50 -33.676 -20.299-129.608 1.00 91.27 C
-ANISOU 3225 CA THR M 50 14999 10607 9070 4159 -1997 -1723 C
-ATOM 3226 C THR M 50 -32.947 -21.579-129.988 1.00 79.83 C
-ANISOU 3226 C THR M 50 13128 9408 7794 3789 -1703 -1678 C
-ATOM 3227 O THR M 50 -33.573 -22.642-130.070 1.00 73.57 O
-ANISOU 3227 O THR M 50 11872 8872 7209 3909 -1624 -1720 O
-ATOM 3228 CB THR M 50 -33.535 -20.049-128.096 1.00 98.76 C
-ANISOU 3228 CB THR M 50 15808 11612 10103 4286 -1914 -1756 C
-ATOM 3229 OG1 THR M 50 -34.401 -20.934-127.371 1.00106.45 O
-ANISOU 3229 OG1 THR M 50 16189 12924 11333 4565 -1811 -1845 O
-ATOM 3230 CG2 THR M 50 -33.853 -18.602-127.743 1.00 98.54 C
-ANISOU 3230 CG2 THR M 50 16359 11251 9828 4561 -2197 -1791 C
-ATOM 3231 N PRO M 51 -31.637 -21.510-130.246 1.00 84.86 N
-ANISOU 3231 N PRO M 51 13922 9990 8329 3336 -1547 -1609 N
-ATOM 3232 CA PRO M 51 -30.897 -22.720-130.624 1.00 86.41 C
-ANISOU 3232 CA PRO M 51 13718 10439 8676 3043 -1282 -1604 C
-ATOM 3233 C PRO M 51 -30.919 -23.765-129.520 1.00 85.83 C
-ANISOU 3233 C PRO M 51 13083 10636 8894 3164 -1106 -1643 C
-ATOM 3234 O PRO M 51 -30.931 -23.446-128.329 1.00 85.88 O
-ANISOU 3234 O PRO M 51 13034 10643 8955 3293 -1104 -1652 O
-ATOM 3235 CB PRO M 51 -29.475 -22.204-130.874 1.00 88.80 C
-ANISOU 3235 CB PRO M 51 14287 10674 8780 2568 -1164 -1564 C
-ATOM 3236 CG PRO M 51 -29.643 -20.745-131.148 1.00 93.51 C
-ANISOU 3236 CG PRO M 51 15564 10907 9056 2544 -1411 -1516 C
-ATOM 3237 CD PRO M 51 -30.786 -20.309-130.288 1.00 94.10 C
-ANISOU 3237 CD PRO M 51 15664 10880 9209 3056 -1620 -1551 C
-ATOM 3238 N ILE M 52 -30.919 -25.030-129.934 1.00 77.18 N
-ANISOU 3238 N ILE M 52 11623 9744 7958 3111 -970 -1665 N
-ATOM 3239 CA ILE M 52 -30.954 -26.168-129.022 1.00 74.01 C
-ANISOU 3239 CA ILE M 52 10762 9562 7797 3192 -826 -1695 C
-ATOM 3240 C ILE M 52 -29.545 -26.722-128.883 1.00 65.80 C
-ANISOU 3240 C ILE M 52 9574 8628 6799 2918 -635 -1708 C
-ATOM 3241 O ILE M 52 -28.878 -26.999-129.888 1.00 78.52 O
-ANISOU 3241 O ILE M 52 11219 10278 8339 2698 -555 -1727 O
-ATOM 3242 CB ILE M 52 -31.918 -27.256-129.522 1.00 70.56 C
-ANISOU 3242 CB ILE M 52 10065 9262 7483 3317 -835 -1722 C
-ATOM 3243 CG1 ILE M 52 -33.330 -26.693-129.681 1.00 76.23 C
-ANISOU 3243 CG1 ILE M 52 10859 9947 8156 3609 -1042 -1746 C
-ATOM 3244 CG2 ILE M 52 -31.924 -28.438-128.574 1.00 67.49 C
-ANISOU 3244 CG2 ILE M 52 9301 9052 7289 3344 -704 -1743 C
-ATOM 3245 CD1 ILE M 52 -34.340 -27.727-130.106 1.00 71.38 C
-ANISOU 3245 CD1 ILE M 52 9958 9514 7649 3693 -1061 -1782 C
-ATOM 3246 N GLN M 53 -29.094 -26.893-127.640 1.00 64.89 N
-ANISOU 3246 N GLN M 53 9286 8581 6789 2946 -567 -1717 N
-ATOM 3247 CA GLN M 53 -27.771 -27.451-127.395 1.00 69.74 C
-ANISOU 3247 CA GLN M 53 9712 9331 7456 2752 -423 -1760 C
-ATOM 3248 C GLN M 53 -27.849 -28.957-127.177 1.00 81.45 C
-ANISOU 3248 C GLN M 53 10865 10955 9125 2858 -352 -1804 C
-ATOM 3249 O GLN M 53 -27.705 -29.731-128.129 1.00113.79 O
-ANISOU 3249 O GLN M 53 14884 15120 13232 2803 -300 -1846 O
-ATOM 3250 CB GLN M 53 -27.109 -26.765-126.201 1.00 67.11 C
-ANISOU 3250 CB GLN M 53 9424 8973 7104 2704 -425 -1750 C
-ATOM 3251 CG GLN M 53 -26.625 -25.356-126.500 1.00 72.45 C
-ANISOU 3251 CG GLN M 53 10475 9506 7546 2484 -480 -1716 C
-ATOM 3252 CD GLN M 53 -27.752 -24.349-126.582 1.00 84.02 C
-ANISOU 3252 CD GLN M 53 12303 10730 8890 2671 -658 -1661 C
-ATOM 3253 OE1 GLN M 53 -28.408 -24.047-125.583 1.00 86.67 O
-ANISOU 3253 OE1 GLN M 53 12656 11001 9275 2916 -735 -1652 O
-ATOM 3254 NE2 GLN M 53 -27.991 -23.828-127.778 1.00 91.31 N
-ANISOU 3254 NE2 GLN M 53 13531 11524 9637 2578 -737 -1639 N
-ATOM 3255 N ASN M 54 -28.074 -29.384-125.941 1.00 62.29 N
-ANISOU 3255 N ASN M 54 8298 8551 6817 2996 -359 -1796 N
-ATOM 3256 CA AASN M 54 -28.174 -30.794-125.602 0.50 65.99 C
-ANISOU 3256 CA AASN M 54 8555 9098 7421 3077 -327 -1826 C
-ATOM 3257 CA BASN M 54 -28.175 -30.798-125.616 0.50 66.00 C
-ANISOU 3257 CA BASN M 54 8557 9100 7422 3076 -327 -1826 C
-ATOM 3258 C ASN M 54 -29.636 -31.225-125.534 1.00 68.41 C
-ANISOU 3258 C ASN M 54 8831 9399 7764 3201 -375 -1790 C
-ATOM 3259 O ASN M 54 -30.551 -30.401-125.460 1.00 61.55 O
-ANISOU 3259 O ASN M 54 8040 8500 6844 3290 -436 -1762 O
-ATOM 3260 CB AASN M 54 -27.481 -31.078-124.267 0.50 66.53 C
-ANISOU 3260 CB AASN M 54 8531 9188 7558 3110 -320 -1842 C
-ATOM 3261 CB BASN M 54 -27.449 -31.106-124.302 0.50 66.62 C
-ANISOU 3261 CB BASN M 54 8540 9203 7571 3107 -318 -1845 C
-ATOM 3262 CG AASN M 54 -26.043 -30.606-124.247 0.50 61.93 C
-ANISOU 3262 CG AASN M 54 7921 8674 6935 2977 -285 -1901 C
-ATOM 3263 CG BASN M 54 -27.156 -32.587-124.132 0.50 71.78 C
-ANISOU 3263 CG BASN M 54 9060 9896 8316 3168 -316 -1896 C
-ATOM 3264 OD1AASN M 54 -25.147 -31.273-124.766 0.50 62.51 O
-ANISOU 3264 OD1AASN M 54 7853 8869 7030 2935 -239 -1995 O
-ATOM 3265 OD1BASN M 54 -27.020 -33.322-125.111 0.50 62.68 O
-ANISOU 3265 OD1BASN M 54 7869 8780 7168 3156 -295 -1948 O
-ATOM 3266 ND2AASN M 54 -25.812 -29.448-123.640 0.50 62.30 N
-ANISOU 3266 ND2AASN M 54 8097 8668 6908 2908 -311 -1863 N
-ATOM 3267 ND2BASN M 54 -27.058 -33.033-122.884 0.50 77.57 N
-ANISOU 3267 ND2BASN M 54 9776 10598 9099 3238 -356 -1886 N
-ATOM 3268 N VAL M 55 -29.845 -32.539-125.555 1.00 74.35 N
-ANISOU 3268 N VAL M 55 9472 10191 8585 3206 -359 -1807 N
-ATOM 3269 CA VAL M 55 -31.186 -33.114-125.527 1.00 76.74 C
-ANISOU 3269 CA VAL M 55 9718 10539 8902 3241 -390 -1784 C
-ATOM 3270 C VAL M 55 -31.140 -34.410-124.726 1.00 76.14 C
-ANISOU 3270 C VAL M 55 9598 10460 8872 3207 -377 -1785 C
-ATOM 3271 O VAL M 55 -30.166 -35.168-124.800 1.00 75.56 O
-ANISOU 3271 O VAL M 55 9553 10333 8824 3197 -376 -1822 O
-ATOM 3272 CB VAL M 55 -31.720 -33.343-126.959 1.00 67.60 C
-ANISOU 3272 CB VAL M 55 8583 9394 7706 3204 -423 -1793 C
-ATOM 3273 CG1 VAL M 55 -30.717 -34.135-127.779 1.00 61.40 C
-ANISOU 3273 CG1 VAL M 55 7829 8575 6924 3128 -382 -1838 C
-ATOM 3274 CG2 VAL M 55 -33.068 -34.045-126.934 1.00 61.93 C
-ANISOU 3274 CG2 VAL M 55 7767 8770 6994 3195 -461 -1784 C
-ATOM 3275 N ILE M 56 -32.197 -34.654-123.948 1.00 67.11 N
-ANISOU 3275 N ILE M 56 8403 9383 7713 3189 -375 -1761 N
-ATOM 3276 CA ILE M 56 -32.322 -35.842-123.111 1.00 71.30 C
-ANISOU 3276 CA ILE M 56 8973 9887 8230 3095 -374 -1746 C
-ATOM 3277 C ILE M 56 -33.681 -36.484-123.365 1.00 71.12 C
-ANISOU 3277 C ILE M 56 8886 9986 8150 2961 -372 -1738 C
-ATOM 3278 O ILE M 56 -34.675 -35.785-123.593 1.00 71.95 O
-ANISOU 3278 O ILE M 56 8844 10257 8238 2995 -362 -1757 O
-ATOM 3279 CB ILE M 56 -32.150 -35.498-121.613 1.00 74.78 C
-ANISOU 3279 CB ILE M 56 9440 10317 8658 3116 -350 -1728 C
-ATOM 3280 CG1 ILE M 56 -30.738 -34.980-121.333 1.00 86.72 C
-ANISOU 3280 CG1 ILE M 56 11005 11728 10218 3211 -373 -1743 C
-ATOM 3281 CG2 ILE M 56 -32.433 -36.706-120.735 1.00 66.69 C
-ANISOU 3281 CG2 ILE M 56 8525 9247 7568 2973 -361 -1703 C
-ATOM 3282 CD1 ILE M 56 -29.649 -35.999-121.591 1.00 92.25 C
-ANISOU 3282 CD1 ILE M 56 11774 12328 10949 3229 -433 -1784 C
-ATOM 3283 N LEU M 57 -33.719 -37.816-123.338 1.00 78.16 N
-ANISOU 3283 N LEU M 57 9902 10800 8993 2812 -403 -1724 N
-ATOM 3284 CA LEU M 57 -34.958 -38.585-123.405 1.00 89.52 C
-ANISOU 3284 CA LEU M 57 11314 12361 10340 2591 -399 -1712 C
-ATOM 3285 C LEU M 57 -35.076 -39.422-122.139 1.00104.56 C
-ANISOU 3285 C LEU M 57 13378 14210 12139 2402 -387 -1678 C
-ATOM 3286 O LEU M 57 -34.168 -40.196-121.819 1.00115.76 O
-ANISOU 3286 O LEU M 57 15057 15389 13538 2415 -462 -1660 O
-ATOM 3287 CB LEU M 57 -34.986 -39.481-124.643 1.00 81.21 C
-ANISOU 3287 CB LEU M 57 10367 11226 9264 2509 -469 -1717 C
-ATOM 3288 CG LEU M 57 -36.112 -40.515-124.709 1.00 78.09 C
-ANISOU 3288 CG LEU M 57 10016 10917 8740 2207 -489 -1699 C
-ATOM 3289 CD1 LEU M 57 -37.469 -39.833-124.786 1.00 86.68 C
-ANISOU 3289 CD1 LEU M 57 10781 12346 9808 2137 -439 -1733 C
-ATOM 3290 CD2 LEU M 57 -35.908 -41.451-125.889 1.00 84.89 C
-ANISOU 3290 CD2 LEU M 57 11068 11620 9565 2148 -580 -1703 C
-ATOM 3291 N HIS M 58 -36.193 -39.272-121.425 1.00102.35 N
-ANISOU 3291 N HIS M 58 12956 14164 11770 2233 -303 -1686 N
-ATOM 3292 CA HIS M 58 -36.382 -39.966-120.156 1.00105.41 C
-ANISOU 3292 CA HIS M 58 13519 14519 12011 1995 -268 -1652 C
-ATOM 3293 C HIS M 58 -37.865 -40.021-119.822 1.00113.52 C
-ANISOU 3293 C HIS M 58 14325 15904 12902 1714 -154 -1692 C
-ATOM 3294 O HIS M 58 -38.539 -38.986-119.833 1.00117.21 O
-ANISOU 3294 O HIS M 58 14451 16666 13418 1853 -75 -1769 O
-ATOM 3295 CB HIS M 58 -35.611 -39.266-119.029 1.00106.28 C
-ANISOU 3295 CB HIS M 58 13683 14538 12160 2167 -243 -1643 C
-ATOM 3296 CG HIS M 58 -36.004 -39.715-117.655 1.00105.80 C
-ANISOU 3296 CG HIS M 58 13773 14503 11925 1917 -182 -1618 C
-ATOM 3297 ND1 HIS M 58 -37.032 -39.130-116.946 1.00103.41 N
-ANISOU 3297 ND1 HIS M 58 13236 14520 11535 1807 -27 -1670 N
-ATOM 3298 CD2 HIS M 58 -35.499 -40.683-116.853 1.00 95.40 C
-ANISOU 3298 CD2 HIS M 58 12843 12928 10477 1758 -263 -1558 C
-ATOM 3299 CE1 HIS M 58 -37.148 -39.724-115.771 1.00 96.03 C
-ANISOU 3299 CE1 HIS M 58 12532 13539 10415 1542 15 -1635 C
-ATOM 3300 NE2 HIS M 58 -36.229 -40.669-115.690 1.00 85.74 N
-ANISOU 3300 NE2 HIS M 58 11638 11862 9078 1504 -142 -1557 N
-ATOM 3301 N GLU M 59 -38.358 -41.222-119.519 1.00111.71 N
-ANISOU 3301 N GLU M 59 14305 15659 12481 1318 -157 -1655 N
-ATOM 3302 CA GLU M 59 -39.725 -41.432-119.038 1.00117.61 C
-ANISOU 3302 CA GLU M 59 14850 16791 13044 943 -24 -1706 C
-ATOM 3303 C GLU M 59 -40.756 -40.832-119.993 1.00114.11 C
-ANISOU 3303 C GLU M 59 13941 16744 12671 1012 8 -1808 C
-ATOM 3304 O GLU M 59 -41.663 -40.099-119.592 1.00124.77 O
-ANISOU 3304 O GLU M 59 14903 18509 13994 1033 129 -1921 O
-ATOM 3305 CB GLU M 59 -39.897 -40.873-117.624 1.00117.32 C
-ANISOU 3305 CB GLU M 59 14742 16910 12923 913 121 -1739 C
-ATOM 3306 N HIS M 60 -40.598 -41.146-121.279 1.00104.33 N
-ANISOU 3306 N HIS M 60 12751 15375 11513 1077 -118 -1785 N
-ATOM 3307 CA HIS M 60 -41.522 -40.739-122.336 1.00106.06 C
-ANISOU 3307 CA HIS M 60 12604 15909 11783 1130 -146 -1870 C
-ATOM 3308 C HIS M 60 -41.636 -39.222-122.466 1.00 95.90 C
-ANISOU 3308 C HIS M 60 10979 14806 10653 1578 -134 -1964 C
-ATOM 3309 O HIS M 60 -42.618 -38.715-123.019 1.00 98.43 O
-ANISOU 3309 O HIS M 60 10939 15475 10983 1659 -158 -2075 O
-ATOM 3310 CB HIS M 60 -42.908 -41.361-122.129 1.00121.63 C
-ANISOU 3310 CB HIS M 60 14350 18312 13554 669 -67 -1941 C
-ATOM 3311 CG HIS M 60 -42.899 -42.858-122.115 1.00134.48 C
-ANISOU 3311 CG HIS M 60 16383 19734 14979 173 -109 -1844 C
-ATOM 3312 ND1 HIS M 60 -42.191 -43.589-121.185 1.00134.32 N
-ANISOU 3312 ND1 HIS M 60 16832 19371 14833 -9 -105 -1744 N
-ATOM 3313 CD2 HIS M 60 -43.504 -43.762-122.922 1.00142.54 C
-ANISOU 3313 CD2 HIS M 60 17471 20811 15878 -176 -188 -1833 C
-ATOM 3314 CE1 HIS M 60 -42.362 -44.878-121.417 1.00138.87 C
-ANISOU 3314 CE1 HIS M 60 17781 19777 15206 -439 -186 -1675 C
-ATOM 3315 NE2 HIS M 60 -43.155 -45.010-122.466 1.00145.13 N
-ANISOU 3315 NE2 HIS M 60 18336 20810 15997 -565 -228 -1725 N
-ATOM 3316 N HIS M 61 -40.647 -38.485-121.968 1.00 80.16 N
-ANISOU 3316 N HIS M 61 9120 12574 8762 1876 -125 -1929 N
-ATOM 3317 CA HIS M 61 -40.573 -37.043-122.141 1.00 87.98 C
-ANISOU 3317 CA HIS M 61 9929 13626 9872 2297 -151 -1998 C
-ATOM 3318 C HIS M 61 -39.217 -36.678-122.728 1.00 88.58 C
-ANISOU 3318 C HIS M 61 10277 13302 10078 2532 -240 -1913 C
-ATOM 3319 O HIS M 61 -38.206 -37.328-122.445 1.00 80.93 O
-ANISOU 3319 O HIS M 61 9584 12047 9117 2448 -242 -1828 O
-ATOM 3320 CB HIS M 61 -40.798 -36.298-120.814 1.00102.16 C
-ANISOU 3320 CB HIS M 61 11599 15593 11624 2398 -31 -2067 C
-ATOM 3321 CG HIS M 61 -42.229 -36.267-120.372 1.00120.26 C
-ANISOU 3321 CG HIS M 61 13502 18399 13792 2266 72 -2217 C
-ATOM 3322 ND1 HIS M 61 -42.860 -37.355-119.809 1.00127.17 N
-ANISOU 3322 ND1 HIS M 61 14340 19485 14494 1796 189 -2220 N
-ATOM 3323 CD2 HIS M 61 -43.153 -35.277-120.415 1.00126.84 C
-ANISOU 3323 CD2 HIS M 61 13962 19604 14627 2544 69 -2391 C
-ATOM 3324 CE1 HIS M 61 -44.111 -37.037-119.524 1.00134.28 C
-ANISOU 3324 CE1 HIS M 61 14803 20920 15299 1755 284 -2399 C
-ATOM 3325 NE2 HIS M 61 -44.314 -35.782-119.882 1.00132.73 N
-ANISOU 3325 NE2 HIS M 61 14379 20836 15216 2245 204 -2517 N
-ATOM 3326 N ILE M 62 -39.203 -35.635-123.555 1.00 86.31 N
-ANISOU 3326 N ILE M 62 9916 13009 9867 2823 -326 -1951 N
-ATOM 3327 CA ILE M 62 -37.995 -35.177-124.235 1.00 81.89 C
-ANISOU 3327 CA ILE M 62 9588 12134 9392 2991 -394 -1890 C
-ATOM 3328 C ILE M 62 -37.606 -33.823-123.656 1.00 81.72 C
-ANISOU 3328 C ILE M 62 9595 12060 9395 3254 -393 -1913 C
-ATOM 3329 O ILE M 62 -38.376 -32.858-123.743 1.00 84.85 O
-ANISOU 3329 O ILE M 62 9858 12611 9768 3466 -447 -1995 O
-ATOM 3330 CB ILE M 62 -38.198 -35.089-125.754 1.00 88.14 C
-ANISOU 3330 CB ILE M 62 10389 12900 10199 3044 -509 -1897 C
-ATOM 3331 CG1 ILE M 62 -38.615 -36.452-126.315 1.00 84.53 C
-ANISOU 3331 CG1 ILE M 62 9938 12483 9698 2766 -522 -1877 C
-ATOM 3332 CG2 ILE M 62 -36.928 -34.589-126.429 1.00 91.97 C
-ANISOU 3332 CG2 ILE M 62 11114 13101 10730 3158 -544 -1848 C
-ATOM 3333 CD1 ILE M 62 -38.973 -36.428-127.785 1.00 83.56 C
-ANISOU 3333 CD1 ILE M 62 9817 12363 9568 2794 -643 -1892 C
-ATOM 3334 N PHE M 63 -36.410 -33.750-123.074 1.00 82.44 N
-ANISOU 3334 N PHE M 63 9876 11929 9520 3255 -355 -1853 N
-ATOM 3335 CA PHE M 63 -35.921 -32.541-122.420 1.00 81.32 C
-ANISOU 3335 CA PHE M 63 9814 11705 9378 3445 -355 -1861 C
-ATOM 3336 C PHE M 63 -34.911 -31.847-123.325 1.00 80.71 C
-ANISOU 3336 C PHE M 63 9927 11414 9327 3521 -427 -1827 C
-ATOM 3337 O PHE M 63 -33.877 -32.430-123.671 1.00 83.21 O
-ANISOU 3337 O PHE M 63 10338 11596 9681 3407 -409 -1785 O
-ATOM 3338 CB PHE M 63 -35.289 -32.868-121.066 1.00 80.24 C
-ANISOU 3338 CB PHE M 63 9756 11497 9236 3358 -275 -1827 C
-ATOM 3339 CG PHE M 63 -36.254 -33.448-120.070 1.00 89.73 C
-ANISOU 3339 CG PHE M 63 10823 12909 10363 3230 -184 -1862 C
-ATOM 3340 CD1 PHE M 63 -36.254 -34.805-119.794 1.00 87.77 C
-ANISOU 3340 CD1 PHE M 63 10633 12643 10075 2964 -148 -1817 C
-ATOM 3341 CD2 PHE M 63 -37.167 -32.637-119.416 1.00101.69 C
-ANISOU 3341 CD2 PHE M 63 12179 14644 11814 3364 -137 -1954 C
-ATOM 3342 CE1 PHE M 63 -37.141 -35.343-118.879 1.00 94.89 C
-ANISOU 3342 CE1 PHE M 63 11450 13745 10857 2762 -51 -1846 C
-ATOM 3343 CE2 PHE M 63 -38.059 -33.169-118.501 1.00108.13 C
-ANISOU 3343 CE2 PHE M 63 12842 15715 12529 3199 -18 -2008 C
-ATOM 3344 CZ PHE M 63 -38.044 -34.524-118.233 1.00105.36 C
-ANISOU 3344 CZ PHE M 63 12563 15347 12121 2861 33 -1945 C
-ATOM 3345 N LEU M 64 -35.211 -30.606-123.699 1.00 69.87 N
-ANISOU 3345 N LEU M 64 8624 10018 7905 3712 -514 -1860 N
-ATOM 3346 CA LEU M 64 -34.358 -29.805-124.565 1.00 73.07 C
-ANISOU 3346 CA LEU M 64 9268 10222 8273 3728 -585 -1826 C
-ATOM 3347 C LEU M 64 -33.669 -28.727-123.744 1.00 74.17 C
-ANISOU 3347 C LEU M 64 9591 10227 8363 3793 -592 -1814 C
-ATOM 3348 O LEU M 64 -34.335 -27.949-123.050 1.00 83.10 O
-ANISOU 3348 O LEU M 64 10739 11394 9443 3987 -636 -1863 O
-ATOM 3349 CB LEU M 64 -35.162 -29.156-125.696 1.00 73.68 C
-ANISOU 3349 CB LEU M 64 9415 10300 8280 3869 -731 -1862 C
-ATOM 3350 CG LEU M 64 -36.002 -30.051-126.607 1.00 78.69 C
-ANISOU 3350 CG LEU M 64 9878 11078 8941 3818 -764 -1884 C
-ATOM 3351 CD1 LEU M 64 -36.693 -29.216-127.677 1.00 86.85 C
-ANISOU 3351 CD1 LEU M 64 11035 12077 9886 3997 -955 -1923 C
-ATOM 3352 CD2 LEU M 64 -35.148 -31.135-127.236 1.00 64.27 C
-ANISOU 3352 CD2 LEU M 64 8082 9177 7160 3577 -681 -1828 C
-ATOM 3353 N GLY M 65 -32.341 -28.683-123.829 1.00 65.07 N
-ANISOU 3353 N GLY M 65 8567 8944 7212 3633 -552 -1768 N
-ATOM 3354 CA GLY M 65 -31.568 -27.618-123.223 1.00 63.07 C
-ANISOU 3354 CA GLY M 65 8522 8556 6884 3626 -575 -1751 C
-ATOM 3355 C GLY M 65 -31.188 -26.562-124.240 1.00 64.06 C
-ANISOU 3355 C GLY M 65 8946 8523 6872 3571 -668 -1733 C
-ATOM 3356 O GLY M 65 -30.180 -26.699-124.939 1.00 69.69 O
-ANISOU 3356 O GLY M 65 9712 9208 7557 3348 -619 -1714 O
-ATOM 3357 N ALA M 66 -31.990 -25.507-124.336 1.00 65.56 N
-ANISOU 3357 N ALA M 66 9351 8611 6946 3773 -809 -1753 N
-ATOM 3358 CA ALA M 66 -31.819 -24.479-125.350 1.00 73.74 C
-ANISOU 3358 CA ALA M 66 10772 9443 7802 3731 -947 -1731 C
-ATOM 3359 C ALA M 66 -31.368 -23.167-124.723 1.00 82.05 C
-ANISOU 3359 C ALA M 66 12205 10280 8690 3735 -1038 -1714 C
-ATOM 3360 O ALA M 66 -31.484 -22.954-123.511 1.00 78.31 O
-ANISOU 3360 O ALA M 66 11683 9823 8248 3865 -1021 -1737 O
-ATOM 3361 CB ALA M 66 -33.121 -24.259-126.128 1.00 75.06 C
-ANISOU 3361 CB ALA M 66 10986 9609 7923 3996 -1114 -1780 C
-ATOM 3362 N THR M 67 -30.854 -22.279-125.577 1.00 86.19 N
-ANISOU 3362 N THR M 67 13155 10585 9007 3559 -1141 -1672 N
-ATOM 3363 CA THR M 67 -30.423 -20.961-125.129 1.00 81.51 C
-ANISOU 3363 CA THR M 67 13037 9734 8199 3508 -1263 -1647 C
-ATOM 3364 C THR M 67 -31.541 -20.281-124.355 1.00 79.98 C
-ANISOU 3364 C THR M 67 12969 9449 7971 3960 -1429 -1716 C
-ATOM 3365 O THR M 67 -32.593 -19.968-124.922 1.00 76.52 O
-ANISOU 3365 O THR M 67 12647 8953 7474 4274 -1609 -1773 O
-ATOM 3366 CB THR M 67 -30.003 -20.080-126.305 1.00 86.65 C
-ANISOU 3366 CB THR M 67 14219 10129 8573 3262 -1394 -1594 C
-ATOM 3367 OG1 THR M 67 -28.914 -20.692-127.008 1.00 87.14 O
-ANISOU 3367 OG1 THR M 67 14128 10337 8644 2824 -1205 -1562 O
-ATOM 3368 CG2 THR M 67 -29.567 -18.711-125.799 1.00 76.10 C
-ANISOU 3368 CG2 THR M 67 13451 8488 6974 3171 -1541 -1562 C
-ATOM 3369 N ASN M 68 -31.330 -20.093-123.053 1.00 89.74 N
-ANISOU 3369 N ASN M 68 14156 10701 9241 4016 -1374 -1731 N
-ATOM 3370 CA ASN M 68 -32.222 -19.379-122.146 1.00 84.92 C
-ANISOU 3370 CA ASN M 68 13676 10020 8569 4429 -1501 -1820 C
-ATOM 3371 C ASN M 68 -33.504 -20.138-121.824 1.00 82.98 C
-ANISOU 3371 C ASN M 68 12949 10079 8499 4789 -1448 -1934 C
-ATOM 3372 O ASN M 68 -34.387 -19.576-121.164 1.00 82.15 O
-ANISOU 3372 O ASN M 68 12887 9989 8336 5179 -1545 -2052 O
-ATOM 3373 CB ASN M 68 -32.578 -17.988-122.686 1.00 84.31 C
-ANISOU 3373 CB ASN M 68 14242 9585 8207 4625 -1800 -1843 C
-ATOM 3374 CG ASN M 68 -31.378 -17.066-122.751 1.00 87.92 C
-ANISOU 3374 CG ASN M 68 15260 9722 8423 4233 -1863 -1739 C
-ATOM 3375 OD1 ASN M 68 -30.441 -17.191-121.959 1.00 80.08 O
-ANISOU 3375 OD1 ASN M 68 14179 8781 7468 3946 -1716 -1689 O
-ATOM 3376 ND2 ASN M 68 -31.399 -16.131-123.695 1.00 95.65 N
-ANISOU 3376 ND2 ASN M 68 16842 10372 9128 4195 -2099 -1709 N
-ATOM 3377 N TYR M 69 -33.637 -21.396-122.244 1.00 82.94 N
-ANISOU 3377 N TYR M 69 12492 10336 8687 4660 -1294 -1918 N
-ATOM 3378 CA TYR M 69 -34.856 -22.135-121.935 1.00 81.03 C
-ANISOU 3378 CA TYR M 69 11802 10410 8577 4915 -1236 -2026 C
-ATOM 3379 C TYR M 69 -34.558 -23.622-121.821 1.00 80.41 C
-ANISOU 3379 C TYR M 69 11292 10567 8693 4636 -1012 -1972 C
-ATOM 3380 O TYR M 69 -33.546 -24.117-122.323 1.00 77.74 O
-ANISOU 3380 O TYR M 69 10976 10160 8400 4326 -938 -1875 O
-ATOM 3381 CB TYR M 69 -35.946 -21.900-122.989 1.00 81.58 C
-ANISOU 3381 CB TYR M 69 11878 10522 8597 5196 -1426 -2112 C
-ATOM 3382 CG TYR M 69 -36.672 -20.580-122.856 1.00 88.37 C
-ANISOU 3382 CG TYR M 69 13076 11227 9273 5642 -1682 -2235 C
-ATOM 3383 CD1 TYR M 69 -36.366 -19.508-123.685 1.00 89.22 C
-ANISOU 3383 CD1 TYR M 69 13775 10954 9170 5685 -1934 -2194 C
-ATOM 3384 CD2 TYR M 69 -37.665 -20.406-121.900 1.00 94.18 C
-ANISOU 3384 CD2 TYR M 69 13571 12196 10016 6022 -1679 -2409 C
-ATOM 3385 CE1 TYR M 69 -37.028 -18.299-123.566 1.00 98.63 C
-ANISOU 3385 CE1 TYR M 69 15357 11953 10167 6139 -2218 -2318 C
-ATOM 3386 CE2 TYR M 69 -38.333 -19.200-121.774 1.00104.84 C
-ANISOU 3386 CE2 TYR M 69 15236 13411 11188 6503 -1936 -2558 C
-ATOM 3387 CZ TYR M 69 -38.011 -18.150-122.609 1.00107.91 C
-ANISOU 3387 CZ TYR M 69 16259 13371 11371 6583 -2224 -2510 C
-ATOM 3388 OH TYR M 69 -38.675 -16.948-122.484 1.00114.01 O
-ANISOU 3388 OH TYR M 69 17378 14011 11931 6938 -2507 -2608 O
-ATOM 3389 N ILE M 70 -35.459 -24.330-121.144 1.00 79.10 N
-ANISOU 3389 N ILE M 70 10750 10689 8616 4750 -909 -2054 N
-ATOM 3390 CA ILE M 70 -35.450 -25.788-121.081 1.00 81.62 C
-ANISOU 3390 CA ILE M 70 10716 11218 9080 4512 -739 -2017 C
-ATOM 3391 C ILE M 70 -36.862 -26.257-121.395 1.00 99.82 C
-ANISOU 3391 C ILE M 70 12695 13825 11408 4664 -751 -2128 C
-ATOM 3392 O ILE M 70 -37.787 -26.026-120.607 1.00108.98 O
-ANISOU 3392 O ILE M 70 13675 15204 12528 4868 -725 -2254 O
-ATOM 3393 CB ILE M 70 -34.990 -26.319-119.718 1.00 68.62 C
-ANISOU 3393 CB ILE M 70 8976 9621 7474 4371 -582 -1990 C
-ATOM 3394 CG1 ILE M 70 -33.530 -25.943-119.467 1.00 66.49 C
-ANISOU 3394 CG1 ILE M 70 8973 9098 7191 4198 -588 -1892 C
-ATOM 3395 CG2 ILE M 70 -35.178 -27.824-119.649 1.00 65.88 C
-ANISOU 3395 CG2 ILE M 70 8342 9462 7228 4153 -451 -1964 C
-ATOM 3396 CD1 ILE M 70 -32.995 -26.447-118.157 1.00 64.84 C
-ANISOU 3396 CD1 ILE M 70 8711 8909 7015 4075 -479 -1864 C
-ATOM 3397 N TYR M 71 -37.034 -26.911-122.540 1.00101.00 N
-ANISOU 3397 N TYR M 71 12751 14017 11607 4553 -784 -2098 N
-ATOM 3398 CA TYR M 71 -38.351 -27.329-122.995 1.00 94.30 C
-ANISOU 3398 CA TYR M 71 11593 13467 10769 4665 -826 -2205 C
-ATOM 3399 C TYR M 71 -38.584 -28.796-122.660 1.00100.45 C
-ANISOU 3399 C TYR M 71 12067 14475 11625 4366 -650 -2182 C
-ATOM 3400 O TYR M 71 -37.644 -29.587-122.563 1.00107.50 O
-ANISOU 3400 O TYR M 71 13049 15223 12574 4097 -553 -2066 O
-ATOM 3401 CB TYR M 71 -38.506 -27.115-124.501 1.00 89.99 C
-ANISOU 3401 CB TYR M 71 11178 12817 10199 4723 -1006 -2192 C
-ATOM 3402 CG TYR M 71 -38.213 -25.706-124.959 1.00 91.50 C
-ANISOU 3402 CG TYR M 71 11789 12712 10265 4958 -1212 -2194 C
-ATOM 3403 CD1 TYR M 71 -36.920 -25.321-125.288 1.00 83.10 C
-ANISOU 3403 CD1 TYR M 71 11104 11318 9153 4757 -1208 -2065 C
-ATOM 3404 CD2 TYR M 71 -39.224 -24.759-125.060 1.00 99.27 C
-ANISOU 3404 CD2 TYR M 71 12810 13756 11151 5373 -1424 -2340 C
-ATOM 3405 CE1 TYR M 71 -36.643 -24.039-125.712 1.00 79.97 C
-ANISOU 3405 CE1 TYR M 71 11166 10626 8592 4894 -1402 -2056 C
-ATOM 3406 CE2 TYR M 71 -38.954 -23.470-125.480 1.00100.79 C
-ANISOU 3406 CE2 TYR M 71 13495 13614 11188 5586 -1653 -2337 C
-ATOM 3407 CZ TYR M 71 -37.661 -23.118-125.804 1.00 89.96 C
-ANISOU 3407 CZ TYR M 71 12549 11883 9747 5310 -1637 -2181 C
-ATOM 3408 OH TYR M 71 -37.380 -21.838-126.222 1.00 93.24 O
-ANISOU 3408 OH TYR M 71 13527 11942 9960 5445 -1868 -2166 O
-ATOM 3409 N VAL M 72 -39.853 -29.153-122.476 1.00 92.70 N
-ANISOU 3409 N VAL M 72 10738 13863 10623 4414 -625 -2308 N
-ATOM 3410 CA VAL M 72 -40.259 -30.526-122.195 1.00 87.98 C
-ANISOU 3410 CA VAL M 72 9888 13499 10042 4081 -476 -2295 C
-ATOM 3411 C VAL M 72 -41.361 -30.884-123.180 1.00 90.90 C
-ANISOU 3411 C VAL M 72 9993 14142 10402 4086 -570 -2382 C
-ATOM 3412 O VAL M 72 -42.464 -30.323-123.115 1.00 92.56 O
-ANISOU 3412 O VAL M 72 9931 14676 10563 4335 -635 -2558 O
-ATOM 3413 CB VAL M 72 -40.738 -30.718-120.750 1.00 88.10 C
-ANISOU 3413 CB VAL M 72 9712 13770 9991 4007 -303 -2373 C
-ATOM 3414 CG1 VAL M 72 -41.080 -32.181-120.498 1.00 85.15 C
-ANISOU 3414 CG1 VAL M 72 9186 13580 9586 3579 -164 -2336 C
-ATOM 3415 CG2 VAL M 72 -39.686 -30.234-119.765 1.00 91.89 C
-ANISOU 3415 CG2 VAL M 72 10472 13973 10469 4040 -245 -2296 C
-ATOM 3416 N LEU M 73 -41.067 -31.818-124.082 1.00 91.46 N
-ANISOU 3416 N LEU M 73 10135 14103 10512 3832 -589 -2281 N
-ATOM 3417 CA LEU M 73 -41.984 -32.249-125.125 1.00 89.66 C
-ANISOU 3417 CA LEU M 73 9708 14087 10271 3786 -696 -2339 C
-ATOM 3418 C LEU M 73 -42.477 -33.663-124.845 1.00 95.49 C
-ANISOU 3418 C LEU M 73 10257 15055 10971 3365 -566 -2326 C
-ATOM 3419 O LEU M 73 -41.789 -34.465-124.204 1.00 83.39 O
-ANISOU 3419 O LEU M 73 8892 13360 9432 3094 -434 -2220 O
-ATOM 3420 CB LEU M 73 -41.309 -32.218-126.499 1.00 94.09 C
-ANISOU 3420 CB LEU M 73 10557 14326 10867 3796 -835 -2238 C
-ATOM 3421 CG LEU M 73 -40.319 -31.091-126.796 1.00 98.59 C
-ANISOU 3421 CG LEU M 73 11484 14536 11440 4022 -921 -2179 C
-ATOM 3422 CD1 LEU M 73 -39.629 -31.338-128.127 1.00 92.40 C
-ANISOU 3422 CD1 LEU M 73 10961 13491 10658 3908 -996 -2082 C
-ATOM 3423 CD2 LEU M 73 -41.017 -29.744-126.799 1.00111.86 C
-ANISOU 3423 CD2 LEU M 73 13152 16291 13061 4432 -1094 -2306 C
-ATOM 3424 N ASN M 74 -43.676 -33.964-125.339 1.00107.39 N
-ANISOU 3424 N ASN M 74 11439 16934 12429 3303 -628 -2441 N
-ATOM 3425 CA ASN M 74 -44.191 -35.325-125.299 1.00106.82 C
-ANISOU 3425 CA ASN M 74 11240 17065 12283 2836 -537 -2422 C
-ATOM 3426 C ASN M 74 -43.490 -36.154-126.368 1.00108.01 C
-ANISOU 3426 C ASN M 74 11713 16861 12464 2644 -616 -2271 C
-ATOM 3427 O ASN M 74 -43.391 -35.731-127.523 1.00117.01 O
-ANISOU 3427 O ASN M 74 12941 17868 13651 2839 -780 -2264 O
-ATOM 3428 CB ASN M 74 -45.704 -35.338-125.516 1.00 99.29 C
-ANISOU 3428 CB ASN M 74 9794 16678 11254 2809 -586 -2615 C
-ATOM 3429 N GLU M 75 -42.995 -37.331-125.977 1.00 97.20 N
-ANISOU 3429 N GLU M 75 10563 15324 11046 2274 -512 -2161 N
-ATOM 3430 CA GLU M 75 -42.221 -38.155-126.902 1.00 86.75 C
-ANISOU 3430 CA GLU M 75 9581 13641 9738 2138 -582 -2041 C
-ATOM 3431 C GLU M 75 -43.041 -38.562-128.121 1.00 94.37 C
-ANISOU 3431 C GLU M 75 10438 14758 10659 2018 -716 -2077 C
-ATOM 3432 O GLU M 75 -42.516 -38.620-129.238 1.00 93.56 O
-ANISOU 3432 O GLU M 75 10556 14398 10596 2100 -823 -2023 O
-ATOM 3433 CB GLU M 75 -41.698 -39.396-126.180 1.00 90.28 C
-ANISOU 3433 CB GLU M 75 10304 13896 10102 1793 -489 -1946 C
-ATOM 3434 CG GLU M 75 -40.984 -40.387-127.082 1.00 95.11 C
-ANISOU 3434 CG GLU M 75 11277 14162 10700 1669 -573 -1858 C
-ATOM 3435 CD GLU M 75 -40.882 -41.769-126.463 1.00111.93 C
-ANISOU 3435 CD GLU M 75 13695 16151 12683 1286 -544 -1794 C
-ATOM 3436 OE1 GLU M 75 -41.553 -42.011-125.437 1.00119.81 O
-ANISOU 3436 OE1 GLU M 75 14586 17373 13563 1025 -450 -1812 O
-ATOM 3437 OE2 GLU M 75 -40.139 -42.615-127.007 1.00112.19 O1-
-ANISOU 3437 OE2 GLU M 75 14089 15847 12691 1243 -622 -1736 O1-
-ATOM 3438 N GLU M 76 -44.332 -38.839-127.928 1.00112.02 N
-ANISOU 3438 N GLU M 76 12322 17441 12800 1804 -709 -2182 N
-ATOM 3439 CA GLU M 76 -45.141 -39.401-129.006 1.00103.65 C
-ANISOU 3439 CA GLU M 76 11158 16549 11675 1608 -844 -2215 C
-ATOM 3440 C GLU M 76 -45.271 -38.434-130.177 1.00103.24 C
-ANISOU 3440 C GLU M 76 11043 16474 11708 2002 -1042 -2267 C
-ATOM 3441 O GLU M 76 -45.137 -38.836-131.338 1.00110.74 O
-ANISOU 3441 O GLU M 76 12190 17240 12645 1937 -1171 -2214 O
-ATOM 3442 CB GLU M 76 -46.522 -39.791-128.478 1.00105.44 C
-ANISOU 3442 CB GLU M 76 10947 17349 11767 1282 -787 -2348 C
-ATOM 3443 N ASP M 77 -45.525 -37.154-129.896 1.00108.72 N
-ANISOU 3443 N ASP M 77 11519 17324 12466 2416 -1086 -2374 N
-ATOM 3444 CA ASP M 77 -45.814 -36.190-130.948 1.00114.77 C
-ANISOU 3444 CA ASP M 77 12258 18081 13268 2796 -1320 -2442 C
-ATOM 3445 C ASP M 77 -44.922 -34.956-130.929 1.00106.43 C
-ANISOU 3445 C ASP M 77 11471 16686 12282 3214 -1362 -2405 C
-ATOM 3446 O ASP M 77 -45.109 -34.073-131.774 1.00101.19 O
-ANISOU 3446 O ASP M 77 10882 15953 11612 3533 -1579 -2452 O
-ATOM 3447 CB ASP M 77 -47.282 -35.743-130.869 1.00127.23 C
-ANISOU 3447 CB ASP M 77 13303 20235 14804 2946 -1438 -2663 C
-ATOM 3448 N LEU M 78 -43.964 -34.868-130.005 1.00106.96 N
-ANISOU 3448 N LEU M 78 11719 16530 12390 3200 -1182 -2322 N
-ATOM 3449 CA LEU M 78 -43.091 -33.698-129.875 1.00104.30 C
-ANISOU 3449 CA LEU M 78 11643 15892 12095 3528 -1208 -2286 C
-ATOM 3450 C LEU M 78 -43.900 -32.413-129.713 1.00111.19 C
-ANISOU 3450 C LEU M 78 12332 16970 12944 3959 -1365 -2445 C
-ATOM 3451 O LEU M 78 -43.574 -31.370-130.283 1.00113.78 O
-ANISOU 3451 O LEU M 78 12930 17051 13251 4260 -1535 -2439 O
-ATOM 3452 CB LEU M 78 -42.120 -33.590-131.053 1.00101.77 C
-ANISOU 3452 CB LEU M 78 11732 15164 11774 3530 -1290 -2170 C
-ATOM 3453 CG LEU M 78 -40.798 -34.349-130.910 1.00 93.33 C
-ANISOU 3453 CG LEU M 78 10929 13794 10738 3288 -1117 -2038 C
-ATOM 3454 CD1 LEU M 78 -41.000 -35.854-131.013 1.00 97.23 C
-ANISOU 3454 CD1 LEU M 78 11375 14354 11214 2937 -1047 -2004 C
-ATOM 3455 CD2 LEU M 78 -39.783 -33.866-131.933 1.00 93.10 C
-ANISOU 3455 CD2 LEU M 78 11260 13429 10686 3350 -1171 -1969 C
-ATOM 3456 N GLN M 79 -44.973 -32.494-128.932 1.00118.16 N
-ANISOU 3456 N GLN M 79 12775 18317 13805 3985 -1318 -2602 N
-ATOM 3457 CA GLN M 79 -45.730 -31.315-128.539 1.00118.78 C
-ANISOU 3457 CA GLN M 79 12640 18637 13853 4446 -1444 -2797 C
-ATOM 3458 C GLN M 79 -45.153 -30.761-127.243 1.00115.74 C
-ANISOU 3458 C GLN M 79 12345 18152 13476 4555 -1274 -2790 C
-ATOM 3459 O GLN M 79 -44.818 -31.520-126.329 1.00109.97 O
-ANISOU 3459 O GLN M 79 11562 17464 12756 4228 -1029 -2721 O
-ATOM 3460 CB GLN M 79 -47.211 -31.653-128.357 1.00111.81 C
-ANISOU 3460 CB GLN M 79 11166 18393 12924 4435 -1466 -3020 C
-ATOM 3461 CG GLN M 79 -47.903 -32.117-129.625 1.00106.48 C
-ANISOU 3461 CG GLN M 79 10363 17865 12228 4351 -1674 -3054 C
-ATOM 3462 N LYS M 80 -45.031 -29.436-127.171 1.00112.44 N
-ANISOU 3462 N LYS M 80 12121 17571 13032 5010 -1429 -2857 N
-ATOM 3463 CA LYS M 80 -44.462 -28.801-125.987 1.00108.29 C
-ANISOU 3463 CA LYS M 80 11734 16915 12496 5133 -1298 -2851 C
-ATOM 3464 C LYS M 80 -45.399 -28.975-124.797 1.00106.38 C
-ANISOU 3464 C LYS M 80 11011 17190 12218 5154 -1133 -3043 C
-ATOM 3465 O LYS M 80 -46.575 -28.600-124.858 1.00 93.78 O
-ANISOU 3465 O LYS M 80 9038 16022 10573 5450 -1249 -3281 O
-ATOM 3466 CB LYS M 80 -44.192 -27.320-126.245 1.00107.00 C
-ANISOU 3466 CB LYS M 80 11949 16436 12270 5604 -1537 -2889 C
-ATOM 3467 CG LYS M 80 -43.595 -26.593-125.041 1.00100.55 C
-ANISOU 3467 CG LYS M 80 11325 15459 11423 5732 -1426 -2885 C
-ATOM 3468 CD LYS M 80 -43.239 -25.151-125.366 1.00 95.25 C
-ANISOU 3468 CD LYS M 80 11142 14398 10648 6135 -1686 -2897 C
-ATOM 3469 CE LYS M 80 -44.465 -24.365-125.802 1.00105.43 C
-ANISOU 3469 CE LYS M 80 12325 15891 11844 6594 -1977 -3114 C
-ATOM 3470 N VAL M 81 -44.876 -29.544-123.716 1.00103.22 N
-ANISOU 3470 N VAL M 81 10624 16772 11825 4843 -867 -2956 N
-ATOM 3471 CA VAL M 81 -45.641 -29.804-122.504 1.00109.47 C
-ANISOU 3471 CA VAL M 81 11016 18033 12545 4758 -659 -3115 C
-ATOM 3472 C VAL M 81 -45.241 -28.852-121.382 1.00115.33 C
-ANISOU 3472 C VAL M 81 11924 18651 13246 5032 -593 -3162 C
-ATOM 3473 O VAL M 81 -46.098 -28.291-120.699 1.00123.76 O
-ANISOU 3473 O VAL M 81 12687 20106 14231 5312 -561 -3399 O
-ATOM 3474 CB VAL M 81 -45.491 -31.277-122.062 1.00114.52 C
-ANISOU 3474 CB VAL M 81 11581 18764 13167 4142 -419 -2989 C
-ATOM 3475 CG1 VAL M 81 -46.149 -31.497-120.706 1.00127.01 C
-ANISOU 3475 CG1 VAL M 81 12841 20786 14629 3987 -177 -3135 C
-ATOM 3476 CG2 VAL M 81 -46.086 -32.208-123.108 1.00104.25 C
-ANISOU 3476 CG2 VAL M 81 10092 17650 11870 3867 -491 -2980 C
-ATOM 3477 N ALA M 82 -43.941 -28.653-121.180 1.00114.72 N
-ANISOU 3477 N ALA M 82 12316 18059 13212 4959 -573 -2957 N
-ATOM 3478 CA ALA M 82 -43.481 -27.807-120.090 1.00118.43 C
-ANISOU 3478 CA ALA M 82 12987 18378 13632 5160 -514 -2981 C
-ATOM 3479 C ALA M 82 -42.364 -26.893-120.573 1.00125.73 C
-ANISOU 3479 C ALA M 82 14440 18750 14583 5342 -691 -2840 C
-ATOM 3480 O ALA M 82 -41.717 -27.149-121.589 1.00133.78 O
-ANISOU 3480 O ALA M 82 15678 19488 15665 5194 -783 -2687 O
-ATOM 3481 CB ALA M 82 -43.005 -28.640-118.892 1.00119.37 C
-ANISOU 3481 CB ALA M 82 13113 18511 13730 4755 -246 -2884 C
-ATOM 3482 N GLU M 83 -42.154 -25.811-119.828 1.00123.00 N
-ANISOU 3482 N GLU M 83 14311 18264 14161 5642 -731 -2905 N
-ATOM 3483 CA GLU M 83 -41.072 -24.876-120.089 1.00120.40 C
-ANISOU 3483 CA GLU M 83 14520 17420 13807 5748 -881 -2776 C
-ATOM 3484 C GLU M 83 -40.402 -24.514-118.772 1.00121.32 C
-ANISOU 3484 C GLU M 83 14829 17393 13874 5706 -752 -2741 C
-ATOM 3485 O GLU M 83 -40.941 -24.755-117.690 1.00132.53 O
-ANISOU 3485 O GLU M 83 15991 19110 15254 5710 -582 -2855 O
-ATOM 3486 CB GLU M 83 -41.565 -23.594-120.777 1.00127.83 C
-ANISOU 3486 CB GLU M 83 15701 18224 14642 6164 -1186 -2871 C
-ATOM 3487 CG GLU M 83 -42.236 -23.798-122.120 1.00144.18 C
-ANISOU 3487 CG GLU M 83 17644 20402 16736 6261 -1369 -2917 C
-ATOM 3488 CD GLU M 83 -42.720 -22.493-122.725 1.00162.11 C
-ANISOU 3488 CD GLU M 83 20241 22493 18859 6621 -1705 -2992 C
-ATOM 3489 OE1 GLU M 83 -42.453 -21.426-122.134 1.00162.36 O
-ANISOU 3489 OE1 GLU M 83 20637 22288 18766 6785 -1795 -2996 O
-ATOM 3490 OE2 GLU M 83 -43.370 -22.534-123.790 1.00172.40 O1-
-ANISOU 3490 OE2 GLU M 83 21468 23883 20152 6750 -1898 -3054 O1-
-ATOM 3491 N TYR M 84 -39.212 -23.931-118.879 1.00110.44 N
-ANISOU 3491 N TYR M 84 13912 15571 12478 5634 -833 -2589 N
-ATOM 3492 CA TYR M 84 -38.551 -23.333-117.726 1.00103.55 C
-ANISOU 3492 CA TYR M 84 13300 14511 11533 5644 -779 -2564 C
-ATOM 3493 C TYR M 84 -37.553 -22.306-118.231 1.00 94.34 C
-ANISOU 3493 C TYR M 84 12675 12882 10289 5665 -969 -2454 C
-ATOM 3494 O TYR M 84 -36.699 -22.626-119.064 1.00 86.49 O
-ANISOU 3494 O TYR M 84 11812 11699 9351 5383 -988 -2301 O
-ATOM 3495 CB TYR M 84 -37.849 -24.378-116.858 1.00105.10 C
-ANISOU 3495 CB TYR M 84 13382 14744 11808 5239 -550 -2441 C
-ATOM 3496 CG TYR M 84 -37.064 -23.762-115.722 1.00114.36 C
-ANISOU 3496 CG TYR M 84 14850 15697 12903 5225 -522 -2401 C
-ATOM 3497 CD1 TYR M 84 -37.710 -23.195-114.633 1.00124.44 C
-ANISOU 3497 CD1 TYR M 84 16106 17114 14061 5471 -471 -2554 C
-ATOM 3498 CD2 TYR M 84 -35.678 -23.743-115.740 1.00117.01 C
-ANISOU 3498 CD2 TYR M 84 15470 15716 13271 4965 -547 -2230 C
-ATOM 3499 CE1 TYR M 84 -36.994 -22.627-113.592 1.00129.36 C
-ANISOU 3499 CE1 TYR M 84 17034 17519 14598 5449 -458 -2516 C
-ATOM 3500 CE2 TYR M 84 -34.955 -23.179-114.704 1.00111.88 C
-ANISOU 3500 CE2 TYR M 84 15087 14879 12543 4930 -541 -2196 C
-ATOM 3501 CZ TYR M 84 -35.616 -22.623-113.635 1.00118.25 C
-ANISOU 3501 CZ TYR M 84 15917 15781 13230 5168 -503 -2328 C
-ATOM 3502 OH TYR M 84 -34.895 -22.062-112.608 1.00122.80 O
-ANISOU 3502 OH TYR M 84 16789 16154 13715 5124 -509 -2291 O
-ATOM 3503 N LYS M 85 -37.663 -21.082-117.725 1.00 99.91 N
-ANISOU 3503 N LYS M 85 13710 13415 10838 5980 -1105 -2544 N
-ATOM 3504 CA LYS M 85 -36.873 -19.963-118.229 1.00 95.18 C
-ANISOU 3504 CA LYS M 85 13703 12362 10098 5999 -1322 -2458 C
-ATOM 3505 C LYS M 85 -35.585 -19.866-117.421 1.00 94.68 C
-ANISOU 3505 C LYS M 85 13880 12076 10016 5663 -1223 -2315 C
-ATOM 3506 O LYS M 85 -35.580 -19.365-116.294 1.00 97.67 O
-ANISOU 3506 O LYS M 85 14388 12415 10308 5787 -1199 -2374 O
-ATOM 3507 CB LYS M 85 -37.676 -18.668-118.167 1.00 81.88 C
-ANISOU 3507 CB LYS M 85 12311 10578 8221 6420 -1572 -2587 C
-ATOM 3508 N THR M 86 -34.493 -20.371-117.991 1.00 93.57 N
-ANISOU 3508 N THR M 86 13777 11823 9953 5244 -1167 -2146 N
-ATOM 3509 CA THR M 86 -33.143 -20.005-117.566 1.00 91.82 C
-ANISOU 3509 CA THR M 86 13861 11355 9670 4927 -1155 -2022 C
-ATOM 3510 C THR M 86 -32.649 -18.802-118.343 1.00100.54 C
-ANISOU 3510 C THR M 86 15537 12098 10565 4882 -1374 -1973 C
-ATOM 3511 O THR M 86 -31.474 -18.735-118.712 1.00107.98 O
-ANISOU 3511 O THR M 86 16655 12904 11470 4485 -1359 -1854 O
-ATOM 3512 CB THR M 86 -32.188 -21.181-117.745 1.00 95.81 C
-ANISOU 3512 CB THR M 86 14075 11981 10349 4519 -985 -1907 C
-ATOM 3513 OG1 THR M 86 -31.810 -21.283-119.122 1.00102.58 O
-ANISOU 3513 OG1 THR M 86 14995 12774 11207 4342 -1036 -1845 O
-ATOM 3514 CG2 THR M 86 -32.846 -22.476-117.326 1.00107.42 C
-ANISOU 3514 CG2 THR M 86 15051 13771 11992 4549 -813 -1947 C
-ATOM 3515 N GLY M 87 -33.548 -17.852-118.609 1.00 97.35 N
-ANISOU 3515 N GLY M 87 15437 11551 10000 5282 -1590 -2080 N
-ATOM 3516 CA GLY M 87 -33.348 -16.805-119.584 1.00 79.91 C
-ANISOU 3516 CA GLY M 87 13819 8981 7563 5279 -1845 -2043 C
-ATOM 3517 C GLY M 87 -32.180 -15.881-119.312 1.00 94.18 C
-ANISOU 3517 C GLY M 87 16196 10434 9154 4950 -1924 -1936 C
-ATOM 3518 O GLY M 87 -31.324 -16.149-118.463 1.00118.42 O
-ANISOU 3518 O GLY M 87 19147 13563 12285 4661 -1767 -1873 O
-ATOM 3519 N PRO M 88 -32.129 -14.763-120.034 1.00 83.28 N
-ANISOU 3519 N PRO M 88 15480 8669 7491 4971 -2192 -1916 N
-ATOM 3520 CA PRO M 88 -31.020 -13.820-119.849 1.00 90.68 C
-ANISOU 3520 CA PRO M 88 17032 9256 8167 4578 -2284 -1810 C
-ATOM 3521 C PRO M 88 -30.959 -13.348-118.406 1.00 88.50 C
-ANISOU 3521 C PRO M 88 16878 8910 7839 4728 -2283 -1861 C
-ATOM 3522 O PRO M 88 -31.961 -12.924-117.828 1.00 94.75 O
-ANISOU 3522 O PRO M 88 17750 9663 8585 5273 -2402 -2008 O
-ATOM 3523 CB PRO M 88 -31.358 -12.676-120.811 1.00 96.87 C
-ANISOU 3523 CB PRO M 88 18581 9608 8618 4708 -2628 -1813 C
-ATOM 3524 CG PRO M 88 -32.833 -12.767-121.001 1.00 89.52 C
-ANISOU 3524 CG PRO M 88 17459 8784 7771 5386 -2768 -1982 C
-ATOM 3525 CD PRO M 88 -33.171 -14.229-120.925 1.00 85.94 C
-ANISOU 3525 CD PRO M 88 16097 8858 7699 5395 -2464 -2009 C
-ATOM 3526 N VAL M 89 -29.776 -13.447-117.818 1.00 84.14 N
-ANISOU 3526 N VAL M 89 16308 8372 7289 4251 -2148 -1759 N
-ATOM 3527 CA VAL M 89 -29.615 -13.257-116.387 1.00 93.71 C
-ANISOU 3527 CA VAL M 89 17524 9583 8500 4329 -2099 -1793 C
-ATOM 3528 C VAL M 89 -28.560 -12.185-116.158 1.00108.45 C
-ANISOU 3528 C VAL M 89 20059 11089 10060 3918 -2244 -1700 C
-ATOM 3529 O VAL M 89 -27.681 -11.959-116.997 1.00102.83 O
-ANISOU 3529 O VAL M 89 19582 10276 9212 3416 -2271 -1592 O
-ATOM 3530 CB VAL M 89 -29.235 -14.587-115.695 1.00 88.99 C
-ANISOU 3530 CB VAL M 89 16187 9401 8223 4164 -1801 -1772 C
-ATOM 3531 CG1 VAL M 89 -27.925 -15.094-116.240 1.00 79.08 C
-ANISOU 3531 CG1 VAL M 89 14758 8258 7031 3575 -1684 -1649 C
-ATOM 3532 CG2 VAL M 89 -29.210 -14.449-114.170 1.00116.50 C
-ANISOU 3532 CG2 VAL M 89 19674 12890 11699 4285 -1755 -1818 C
-ATOM 3533 N LEU M 90 -28.667 -11.509-115.017 1.00112.81 N
-ANISOU 3533 N LEU M 90 20930 11457 10475 4108 -2333 -1753 N
-ATOM 3534 CA LEU M 90 -27.762 -10.429-114.660 1.00107.71 C
-ANISOU 3534 CA LEU M 90 20976 10442 9506 3736 -2496 -1676 C
-ATOM 3535 C LEU M 90 -26.641 -10.960-113.778 1.00 99.02 C
-ANISOU 3535 C LEU M 90 19524 9568 8533 3282 -2305 -1602 C
-ATOM 3536 O LEU M 90 -26.899 -11.606-112.757 1.00105.03 O
-ANISOU 3536 O LEU M 90 19846 10560 9502 3507 -2158 -1659 O
-ATOM 3537 CB LEU M 90 -28.531 -9.325-113.943 1.00113.77 C
-ANISOU 3537 CB LEU M 90 22372 10839 10015 4237 -2742 -1791 C
-ATOM 3538 CG LEU M 90 -29.802 -8.916-114.686 1.00114.99 C
-ANISOU 3538 CG LEU M 90 22765 10842 10085 4846 -2953 -1920 C
-ATOM 3539 CD1 LEU M 90 -30.755 -8.179-113.765 1.00114.62 C
-ANISOU 3539 CD1 LEU M 90 22978 10658 9915 5474 -3112 -2065 C
-ATOM 3540 CD2 LEU M 90 -29.449 -8.064-115.894 1.00112.01 C
-ANISOU 3540 CD2 LEU M 90 23126 10047 9385 4566 -3218 -1824 C
-ATOM 3541 N GLU M 91 -25.402 -10.687-114.175 1.00 90.75 N
-ANISOU 3541 N GLU M 91 18671 8471 7338 2633 -2315 -1488 N
-ATOM 3542 CA GLU M 91 -24.227 -11.157-113.457 1.00 94.64 C
-ANISOU 3542 CA GLU M 91 18813 9211 7934 2177 -2172 -1436 C
-ATOM 3543 C GLU M 91 -23.628 -10.031-112.624 1.00100.80 C
-ANISOU 3543 C GLU M 91 20248 9661 8390 1918 -2352 -1402 C
-ATOM 3544 O GLU M 91 -23.529 -8.888-113.080 1.00107.11 O
-ANISOU 3544 O GLU M 91 21816 10060 8820 1729 -2571 -1362 O
-ATOM 3545 CB GLU M 91 -23.176 -11.713-114.423 1.00 92.95 C
-ANISOU 3545 CB GLU M 91 18245 9283 7787 1604 -2035 -1373 C
-ATOM 3546 CG GLU M 91 -23.554 -13.044-115.069 1.00103.85 C
-ANISOU 3546 CG GLU M 91 18890 11044 9526 1807 -1827 -1408 C
-ATOM 3547 CD GLU M 91 -22.444 -13.608-115.944 1.00118.44 C
-ANISOU 3547 CD GLU M 91 20369 13205 11427 1271 -1682 -1380 C
-ATOM 3548 OE1 GLU M 91 -21.464 -12.881-116.208 1.00129.80 O
-ANISOU 3548 OE1 GLU M 91 22141 14578 12598 713 -1738 -1337 O
-ATOM 3549 OE2 GLU M 91 -22.547 -14.783-116.359 1.00114.55 O1-
-ANISOU 3549 OE2 GLU M 91 19257 13041 11227 1393 -1510 -1416 O1-
-ATOM 3550 N HIS M 92 -23.233 -10.365-111.395 1.00 96.88 N
-ANISOU 3550 N HIS M 92 19493 9308 8008 1899 -2280 -1415 N
-ATOM 3551 CA HIS M 92 -22.609 -9.433-110.479 1.00 92.51 C
-ANISOU 3551 CA HIS M 92 19488 8487 7175 1635 -2438 -1385 C
-ATOM 3552 C HIS M 92 -21.646 -10.237-109.620 1.00 97.30 C
-ANISOU 3552 C HIS M 92 19525 9455 7991 1343 -2299 -1369 C
-ATOM 3553 O HIS M 92 -21.974 -11.369-109.236 1.00104.39 O
-ANISOU 3553 O HIS M 92 19775 10665 9223 1641 -2127 -1414 O
-ATOM 3554 CB HIS M 92 -23.638 -8.715-109.599 1.00 97.58 C
-ANISOU 3554 CB HIS M 92 20633 8778 7666 2208 -2584 -1468 C
-ATOM 3555 CG HIS M 92 -23.104 -7.500-108.907 1.00 97.60 C
-ANISOU 3555 CG HIS M 92 21430 8372 7283 1945 -2811 -1434 C
-ATOM 3556 ND1 HIS M 92 -22.308 -7.572-107.785 1.00 97.55 N
-ANISOU 3556 ND1 HIS M 92 21340 8449 7276 1663 -2790 -1408 N
-ATOM 3557 CD2 HIS M 92 -23.259 -6.181-109.173 1.00101.63 C
-ANISOU 3557 CD2 HIS M 92 22884 8360 7372 1920 -3091 -1423 C
-ATOM 3558 CE1 HIS M 92 -21.990 -6.351-107.394 1.00101.29 C
-ANISOU 3558 CE1 HIS M 92 22649 8486 7349 1450 -3031 -1379 C
-ATOM 3559 NE2 HIS M 92 -22.555 -5.489-108.219 1.00103.88 N
-ANISOU 3559 NE2 HIS M 92 23636 8426 7408 1600 -3219 -1387 N
-ATOM 3560 N PRO M 93 -20.458 -9.702-109.321 1.00 92.92 N
-ANISOU 3560 N PRO M 93 19202 8872 7231 753 -2389 -1314 N
-ATOM 3561 CA PRO M 93 -19.507 -10.476-108.506 1.00101.88 C
-ANISOU 3561 CA PRO M 93 19772 10372 8563 509 -2299 -1321 C
-ATOM 3562 C PRO M 93 -20.003 -10.736-107.094 1.00113.18 C
-ANISOU 3562 C PRO M 93 21163 11743 10098 932 -2305 -1360 C
-ATOM 3563 O PRO M 93 -19.745 -11.811-106.539 1.00121.55 O
-ANISOU 3563 O PRO M 93 21616 13128 11439 1012 -2189 -1386 O
-ATOM 3564 CB PRO M 93 -18.246 -9.600-108.517 1.00 95.20 C
-ANISOU 3564 CB PRO M 93 19301 9472 7398 -222 -2436 -1269 C
-ATOM 3565 CG PRO M 93 -18.392 -8.734-109.713 1.00 97.61 C
-ANISOU 3565 CG PRO M 93 20166 9513 7407 -467 -2515 -1223 C
-ATOM 3566 CD PRO M 93 -19.857 -8.462-109.834 1.00 96.90 C
-ANISOU 3566 CD PRO M 93 20448 9060 7310 222 -2577 -1247 C
-ATOM 3567 N ASP M 94 -20.710 -9.782-106.495 1.00108.93 N
-ANISOU 3567 N ASP M 94 21287 10786 9314 1212 -2445 -1377 N
-ATOM 3568 CA ASP M 94 -21.215 -9.948-105.139 1.00 91.75 C
-ANISOU 3568 CA ASP M 94 19122 8552 7186 1597 -2434 -1431 C
-ATOM 3569 C ASP M 94 -22.473 -10.805-105.073 1.00 94.92 C
-ANISOU 3569 C ASP M 94 19103 9114 7849 2218 -2253 -1515 C
-ATOM 3570 O ASP M 94 -23.033 -10.963-103.984 1.00 88.88 O
-ANISOU 3570 O ASP M 94 18344 8327 7100 2550 -2210 -1577 O
-ATOM 3571 CB ASP M 94 -21.489 -8.577-104.512 1.00105.45 C
-ANISOU 3571 CB ASP M 94 21745 9791 8531 1680 -2651 -1446 C
-ATOM 3572 CG ASP M 94 -20.277 -7.665-104.556 1.00116.48 C
-ANISOU 3572 CG ASP M 94 23638 11002 9615 999 -2845 -1358 C
-ATOM 3573 OD1 ASP M 94 -19.152 -8.188-104.711 1.00113.26 O
-ANISOU 3573 OD1 ASP M 94 22775 10933 9325 482 -2792 -1308 O
-ATOM 3574 OD2 ASP M 94 -20.447 -6.431-104.424 1.00117.92 O1-
-ANISOU 3574 OD2 ASP M 94 24673 10715 9418 980 -3061 -1353 O1-
-ATOM 3575 N CYS M 95 -22.925 -11.363-106.195 1.00 89.77 N
-ANISOU 3575 N CYS M 95 18092 8639 7377 2346 -2142 -1524 N
-ATOM 3576 CA CYS M 95 -24.126 -12.186-106.240 1.00 85.32 C
-ANISOU 3576 CA CYS M 95 17110 8263 7043 2871 -1974 -1607 C
-ATOM 3577 C CYS M 95 -23.755 -13.616-106.596 1.00 91.25 C
-ANISOU 3577 C CYS M 95 17106 9429 8134 2737 -1792 -1576 C
-ATOM 3578 O CYS M 95 -23.021 -13.853-107.562 1.00 99.16 O
-ANISOU 3578 O CYS M 95 17910 10564 9203 2400 -1783 -1522 O
-ATOM 3579 CB CYS M 95 -25.135 -11.634-107.243 1.00 86.38 C
-ANISOU 3579 CB CYS M 95 17499 8235 7086 3209 -2032 -1664 C
-ATOM 3580 SG CYS M 95 -26.014 -10.183-106.648 1.00 96.30 S
-ANISOU 3580 SG CYS M 95 19581 9030 7977 3655 -2244 -1775 S
-ATOM 3581 N PHE M 96 -24.268 -14.560-105.815 1.00 80.46 N
-ANISOU 3581 N PHE M 96 15359 8260 6952 2995 -1650 -1620 N
-ATOM 3582 CA PHE M 96 -23.973 -15.981-105.943 1.00 77.86 C
-ANISOU 3582 CA PHE M 96 14399 8270 6916 2916 -1510 -1598 C
-ATOM 3583 C PHE M 96 -25.264 -16.724-106.263 1.00 81.13 C
-ANISOU 3583 C PHE M 96 14496 8845 7483 3306 -1345 -1664 C
-ATOM 3584 O PHE M 96 -26.350 -16.147-106.121 1.00 89.01 O
-ANISOU 3584 O PHE M 96 15718 9737 8364 3656 -1335 -1748 O
-ATOM 3585 CB PHE M 96 -23.336 -16.507-104.655 1.00 90.94 C
-ANISOU 3585 CB PHE M 96 15953 9993 8609 2797 -1524 -1581 C
-ATOM 3586 CG PHE M 96 -22.000 -15.903-104.350 1.00 87.80 C
-ANISOU 3586 CG PHE M 96 15768 9511 8080 2381 -1694 -1529 C
-ATOM 3587 CD1 PHE M 96 -20.838 -16.516-104.781 1.00 78.75 C
-ANISOU 3587 CD1 PHE M 96 14241 8608 7073 2050 -1722 -1505 C
-ATOM 3588 CD2 PHE M 96 -21.905 -14.723-103.631 1.00 81.60 C
-ANISOU 3588 CD2 PHE M 96 15555 8429 7018 2321 -1832 -1525 C
-ATOM 3589 CE1 PHE M 96 -19.606 -15.967-104.504 1.00 80.70 C
-ANISOU 3589 CE1 PHE M 96 14617 8853 7191 1639 -1876 -1484 C
-ATOM 3590 CE2 PHE M 96 -20.675 -14.168-103.354 1.00 83.39 C
-ANISOU 3590 CE2 PHE M 96 15976 8602 7106 1882 -1994 -1479 C
-ATOM 3591 CZ PHE M 96 -19.523 -14.793-103.790 1.00 82.98 C
-ANISOU 3591 CZ PHE M 96 15483 8846 7201 1526 -2012 -1461 C
-ATOM 3592 N PRO M 97 -25.196 -17.985-106.703 1.00 74.24 N
-ANISOU 3592 N PRO M 97 13113 8240 6854 3264 -1227 -1647 N
-ATOM 3593 CA PRO M 97 -26.420 -18.706-107.078 1.00 73.13 C
-ANISOU 3593 CA PRO M 97 12676 8270 6840 3566 -1076 -1706 C
-ATOM 3594 C PRO M 97 -27.481 -18.692-105.984 1.00 73.99 C
-ANISOU 3594 C PRO M 97 12850 8398 6864 3863 -984 -1794 C
-ATOM 3595 O PRO M 97 -27.177 -18.623-104.792 1.00 84.93 O
-ANISOU 3595 O PRO M 97 14395 9715 8160 3808 -999 -1790 O
-ATOM 3596 CB PRO M 97 -25.917 -20.127-107.347 1.00 71.06 C
-ANISOU 3596 CB PRO M 97 11945 8243 6812 3405 -998 -1662 C
-ATOM 3597 CG PRO M 97 -24.518 -19.932-107.819 1.00 71.20 C
-ANISOU 3597 CG PRO M 97 11966 8247 6840 3067 -1110 -1606 C
-ATOM 3598 CD PRO M 97 -23.982 -18.736-107.081 1.00 73.17 C
-ANISOU 3598 CD PRO M 97 12660 8271 6869 2936 -1246 -1591 C
-ATOM 3599 N CYS M 98 -28.740 -18.740-106.417 1.00 74.32 N
-ANISOU 3599 N CYS M 98 12756 8562 6919 4173 -889 -1891 N
-ATOM 3600 CA CYS M 98 -29.938 -18.807-105.581 1.00 90.99 C
-ANISOU 3600 CA CYS M 98 14811 10810 8950 4472 -756 -2023 C
-ATOM 3601 C CYS M 98 -30.136 -17.585-104.690 1.00 86.50 C
-ANISOU 3601 C CYS M 98 14706 10030 8131 4674 -836 -2110 C
-ATOM 3602 O CYS M 98 -31.022 -17.597-103.827 1.00 79.63 O
-ANISOU 3602 O CYS M 98 13801 9295 7162 4906 -711 -2243 O
-ATOM 3603 CB CYS M 98 -29.954 -20.064-104.709 1.00108.40 C
-ANISOU 3603 CB CYS M 98 16733 13214 11238 4317 -599 -1997 C
-ATOM 3604 SG CYS M 98 -30.422 -21.609-105.516 1.00133.73 S
-ANISOU 3604 SG CYS M 98 19410 16727 14672 4225 -452 -1972 S
-ATOM 3605 N GLN M 99 -29.357 -16.528-104.872 1.00 88.38 N
-ANISOU 3605 N GLN M 99 15394 9949 8236 4577 -1038 -2053 N
-ATOM 3606 CA GLN M 99 -29.484 -15.361-104.014 1.00 88.32 C
-ANISOU 3606 CA GLN M 99 15904 9690 7964 4759 -1143 -2133 C
-ATOM 3607 C GLN M 99 -30.491 -14.364-104.581 1.00 91.28 C
-ANISOU 3607 C GLN M 99 16537 9957 8187 5213 -1241 -2286 C
-ATOM 3608 O GLN M 99 -30.852 -14.402-105.760 1.00106.07 O
-ANISOU 3608 O GLN M 99 18277 11881 10146 5313 -1282 -2293 O
-ATOM 3609 CB GLN M 99 -28.128 -14.684-103.819 1.00 84.92 C
-ANISOU 3609 CB GLN M 99 15901 8949 7417 4388 -1336 -2000 C
-ATOM 3610 CG GLN M 99 -27.255 -15.345-102.771 1.00 81.08 C
-ANISOU 3610 CG GLN M 99 15305 8520 6983 4074 -1297 -1914 C
-ATOM 3611 CD GLN M 99 -26.029 -14.524-102.435 1.00 82.28 C
-ANISOU 3611 CD GLN M 99 15895 8394 6973 3736 -1503 -1822 C
-ATOM 3612 OE1 GLN M 99 -25.656 -13.615-103.173 1.00 93.42 O
-ANISOU 3612 OE1 GLN M 99 17646 9591 8257 3618 -1659 -1788 O
-ATOM 3613 NE2 GLN M 99 -25.395 -14.842-101.316 1.00 82.23 N
-ANISOU 3613 NE2 GLN M 99 15910 8389 6946 3547 -1517 -1781 N
-ATOM 3614 N ASP M 100 -30.953 -13.469-103.705 1.00 87.18 N
-ANISOU 3614 N ASP M 100 16414 9284 7427 5519 -1296 -2423 N
-ATOM 3615 CA ASP M 100 -31.803 -12.345-104.094 1.00 97.99 C
-ANISOU 3615 CA ASP M 100 18074 10522 8637 5927 -1464 -2522 C
-ATOM 3616 C ASP M 100 -30.878 -11.190-104.462 1.00106.75 C
-ANISOU 3616 C ASP M 100 19909 11123 9527 5750 -1757 -2420 C
-ATOM 3617 O ASP M 100 -30.564 -10.312-103.655 1.00119.22 O
-ANISOU 3617 O ASP M 100 21977 12433 10890 5721 -1885 -2393 O
-ATOM 3618 CB ASP M 100 -32.760 -11.981-102.967 1.00110.04 C
-ANISOU 3618 CB ASP M 100 19532 12219 10059 6226 -1383 -2638 C
-ATOM 3619 CG ASP M 100 -33.866 -11.038-103.407 1.00123.18 C
-ANISOU 3619 CG ASP M 100 21260 13916 11625 6656 -1546 -2729 C
-ATOM 3620 OD1 ASP M 100 -33.783 -10.486-104.525 1.00132.28 O
-ANISOU 3620 OD1 ASP M 100 22659 14860 12741 6707 -1772 -2671 O
-ATOM 3621 OD2 ASP M 100 -34.818 -10.843-102.622 1.00124.09 O1-
-ANISOU 3621 OD2 ASP M 100 21198 14272 11678 6945 -1458 -2873 O1-
-ATOM 3622 N CYS M 101 -30.427 -11.209-105.716 1.00 90.74 N
-ANISOU 3622 N CYS M 101 17967 8970 7541 5579 -1863 -2354 N
-ATOM 3623 CA CYS M 101 -29.393 -10.278-106.148 1.00 98.03 C
-ANISOU 3623 CA CYS M 101 19521 9468 8257 5214 -2109 -2214 C
-ATOM 3624 C CYS M 101 -29.894 -8.839-106.163 1.00 96.30 C
-ANISOU 3624 C CYS M 101 19951 8892 7745 5510 -2383 -2231 C
-ATOM 3625 O CYS M 101 -29.113 -7.911-105.924 1.00 98.30 O
-ANISOU 3625 O CYS M 101 20855 8750 7745 5239 -2581 -2135 O
-ATOM 3626 CB CYS M 101 -28.881 -10.692-107.527 1.00113.85 C
-ANISOU 3626 CB CYS M 101 21317 11537 10405 4866 -2118 -2075 C
-ATOM 3627 SG CYS M 101 -27.397 -9.835-108.088 1.00147.97 S
-ANISOU 3627 SG CYS M 101 26249 15483 14490 4198 -2334 -1884 S
-ATOM 3628 N SER M 102 -31.190 -8.636-106.418 1.00118.61 N
-ANISOU 3628 N SER M 102 22556 11906 10606 6008 -2412 -2314 N
-ATOM 3629 CA SER M 102 -31.745 -7.288-106.501 1.00114.84 C
-ANISOU 3629 CA SER M 102 22629 11153 9850 6321 -2711 -2309 C
-ATOM 3630 C SER M 102 -31.731 -6.559-105.163 1.00105.47 C
-ANISOU 3630 C SER M 102 21782 9824 8469 6421 -2760 -2321 C
-ATOM 3631 O SER M 102 -31.849 -5.329-105.142 1.00109.57 O
-ANISOU 3631 O SER M 102 22933 10002 8695 6580 -3048 -2281 O
-ATOM 3632 CB SER M 102 -33.170 -7.346-107.055 1.00121.29 C
-ANISOU 3632 CB SER M 102 23041 12302 10743 6839 -2738 -2446 C
-ATOM 3633 OG SER M 102 -33.945 -8.314-106.368 1.00128.17 O
-ANISOU 3633 OG SER M 102 23155 13696 11848 7017 -2434 -2586 O
-ATOM 3634 N SER M 103 -31.594 -7.279-104.050 1.00103.53 N
-ANISOU 3634 N SER M 103 21171 9814 8351 6333 -2501 -2372 N
-ATOM 3635 CA SER M 103 -31.483 -6.650-102.741 1.00120.01 C
-ANISOU 3635 CA SER M 103 23596 11752 10252 6378 -2532 -2379 C
-ATOM 3636 C SER M 103 -30.049 -6.551-102.246 1.00104.61 C
-ANISOU 3636 C SER M 103 22070 9472 8204 5831 -2572 -2239 C
-ATOM 3637 O SER M 103 -29.784 -5.784-101.316 1.00107.09 O
-ANISOU 3637 O SER M 103 22845 9538 8307 5803 -2680 -2200 O
-ATOM 3638 CB SER M 103 -32.311 -7.420-101.705 1.00105.37 C
-ANISOU 3638 CB SER M 103 21132 10359 8544 6620 -2233 -2538 C
-ATOM 3639 OG SER M 103 -31.819 -8.737-101.546 1.00101.05 O
-ANISOU 3639 OG SER M 103 20105 10059 8231 6302 -1963 -2525 O
-ATOM 3640 N LYS M 104 -29.125 -7.291-102.852 1.00101.18 N
-ANISOU 3640 N LYS M 104 21488 9053 7902 5389 -2504 -2175 N
-ATOM 3641 CA LYS M 104 -27.748 -7.355-102.388 1.00106.19 C
-ANISOU 3641 CA LYS M 104 22397 9498 8453 4821 -2538 -2080 C
-ATOM 3642 C LYS M 104 -26.803 -6.423-103.133 1.00106.57 C
-ANISOU 3642 C LYS M 104 23090 9132 8270 4376 -2806 -1934 C
-ATOM 3643 O LYS M 104 -25.702 -6.163-102.635 1.00111.94 O
-ANISOU 3643 O LYS M 104 24080 9644 8810 3876 -2888 -1843 O
-ATOM 3644 CB LYS M 104 -27.211 -8.784-102.520 1.00 99.06 C
-ANISOU 3644 CB LYS M 104 20870 8953 7815 4538 -2312 -2096 C
-ATOM 3645 CG LYS M 104 -27.855 -9.796-101.600 1.00 99.46 C
-ANISOU 3645 CG LYS M 104 20347 9383 8060 4787 -2041 -2191 C
-ATOM 3646 CD LYS M 104 -27.141 -11.138-101.684 1.00100.91 C
-ANISOU 3646 CD LYS M 104 19863 9916 8564 4371 -1869 -2050 C
-ATOM 3647 CE LYS M 104 -25.736 -11.072-101.095 1.00106.52 C
-ANISOU 3647 CE LYS M 104 20745 10508 9220 3830 -1979 -1902 C
-ATOM 3648 NZ LYS M 104 -24.713 -10.562-102.053 1.00107.27 N
-ANISOU 3648 NZ LYS M 104 21053 10449 9254 3379 -2155 -1775 N
-ATOM 3649 N ALA M 105 -27.183 -5.931-104.310 1.00103.27 N
-ANISOU 3649 N ALA M 105 22875 8568 7794 4493 -2947 -1900 N
-ATOM 3650 CA ALA M 105 -26.251 -5.155-105.113 1.00105.09 C
-ANISOU 3650 CA ALA M 105 23696 8437 7798 3968 -3167 -1747 C
-ATOM 3651 C ALA M 105 -27.008 -4.202-106.026 1.00108.49 C
-ANISOU 3651 C ALA M 105 24577 8578 8068 4293 -3399 -1696 C
-ATOM 3652 O ALA M 105 -28.231 -4.271-106.169 1.00110.71 O
-ANISOU 3652 O ALA M 105 24605 9026 8432 4920 -3394 -1803 O
-ATOM 3653 CB ALA M 105 -25.332 -6.062-105.936 1.00101.84 C
-ANISOU 3653 CB ALA M 105 22936 8266 7495 3430 -3053 -1741 C
-ATOM 3654 N ASN M 106 -26.238 -3.321-106.659 1.00111.16 N
-ANISOU 3654 N ASN M 106 25570 8512 8152 3813 -3614 -1527 N
-ATOM 3655 CA ASN M 106 -26.745 -2.272-107.536 1.00131.09 C
-ANISOU 3655 CA ASN M 106 28712 10651 10444 4014 -3898 -1430 C
-ATOM 3656 C ASN M 106 -26.753 -2.792-108.971 1.00113.47 C
-ANISOU 3656 C ASN M 106 26267 8534 8311 3863 -3860 -1434 C
-ATOM 3657 O ASN M 106 -25.694 -3.030-109.561 1.00115.39 O
-ANISOU 3657 O ASN M 106 26526 8790 8529 3163 -3792 -1351 O
-ATOM 3658 CB ASN M 106 -25.872 -1.032-107.360 1.00139.70 C
-ANISOU 3658 CB ASN M 106 30674 11207 11200 3510 -4130 -1221 C
-ATOM 3659 CG ASN M 106 -26.286 0.127-108.228 1.00164.77 C
-ANISOU 3659 CG ASN M 106 34624 13903 14079 3664 -4461 -1082 C
-ATOM 3660 OD1 ASN M 106 -27.350 0.131-108.846 1.00125.04 O
-ANISOU 3660 OD1 ASN M 106 29514 8949 9047 4258 -4572 -1157 O
-ATOM 3661 ND2 ASN M 106 -25.429 1.142-108.261 1.00219.93 N
-ANISOU 3661 ND2 ASN M 106 42381 20399 20784 3101 -4637 -875 N
-ATOM 3662 N LEU M 107 -27.951 -2.980-109.531 1.00113.49 N
-ANISOU 3662 N LEU M 107 26027 8688 8408 4497 -3903 -1537 N
-ATOM 3663 CA LEU M 107 -28.124 -3.690-110.794 1.00114.62 C
-ANISOU 3663 CA LEU M 107 25827 9021 8703 4456 -3827 -1577 C
-ATOM 3664 C LEU M 107 -28.493 -2.775-111.960 1.00115.17 C
-ANISOU 3664 C LEU M 107 26532 8707 8519 4549 -4144 -1464 C
-ATOM 3665 O LEU M 107 -28.930 -3.267-113.003 1.00113.94 O
-ANISOU 3665 O LEU M 107 26120 8701 8473 4679 -4130 -1513 O
-ATOM 3666 CB LEU M 107 -29.183 -4.783-110.642 1.00108.07 C
-ANISOU 3666 CB LEU M 107 24126 8721 8215 5035 -3607 -1781 C
-ATOM 3667 CG LEU M 107 -28.765 -6.079-109.950 1.00103.31 C
-ANISOU 3667 CG LEU M 107 22790 8545 7920 4858 -3248 -1882 C
-ATOM 3668 CD1 LEU M 107 -29.787 -7.176-110.201 1.00100.60 C
-ANISOU 3668 CD1 LEU M 107 21628 8683 7912 5315 -3036 -2031 C
-ATOM 3669 CD2 LEU M 107 -27.391 -6.507-110.426 1.00101.19 C
-ANISOU 3669 CD2 LEU M 107 22563 8272 7613 4099 -3163 -1810 C
-ATOM 3670 N SER M 108 -28.325 -1.462-111.816 1.00124.83 N
-ANISOU 3670 N SER M 108 28613 9424 9393 4484 -4444 -1304 N
-ATOM 3671 CA SER M 108 -28.670 -0.543-112.894 1.00132.37 C
-ANISOU 3671 CA SER M 108 30269 9968 10059 4580 -4785 -1173 C
-ATOM 3672 C SER M 108 -27.605 -0.560-113.983 1.00136.41 C
-ANISOU 3672 C SER M 108 31061 10240 10528 3751 -4725 -1015 C
-ATOM 3673 O SER M 108 -26.408 -0.665-113.701 1.00143.24 O
-ANISOU 3673 O SER M 108 31924 11107 11393 2995 -4546 -942 O
-ATOM 3674 CB SER M 108 -28.846 0.877-112.360 1.00132.24 C
-ANISOU 3674 CB SER M 108 31077 9508 9662 4765 -5119 -1072 C
-ATOM 3675 OG SER M 108 -30.178 1.091-111.931 1.00136.36 O
-ANISOU 3675 OG SER M 108 31366 10311 10132 5602 -5257 -1293 O
-ATOM 3676 N GLY M 109 -28.052 -0.450-115.233 1.00129.95 N
-ANISOU 3676 N GLY M 109 30448 9288 9640 3865 -4880 -975 N
-ATOM 3677 CA GLY M 109 -27.141 -0.511-116.356 1.00129.20 C
-ANISOU 3677 CA GLY M 109 30555 9045 9489 3070 -4795 -849 C
-ATOM 3678 C GLY M 109 -26.557 -1.877-116.626 1.00126.93 C
-ANISOU 3678 C GLY M 109 29402 9348 9478 2653 -4411 -966 C
-ATOM 3679 O GLY M 109 -25.554 -1.982-117.336 1.00134.79 O
-ANISOU 3679 O GLY M 109 30451 10385 10377 1855 -4285 -863 O
-ATOM 3680 N GLY M 110 -27.159 -2.934-116.084 1.00133.50 N
-ANISOU 3680 N GLY M 110 29427 10675 10621 3165 -4222 -1174 N
-ATOM 3681 CA GLY M 110 -26.594 -4.268-116.222 1.00131.38 C
-ANISOU 3681 CA GLY M 110 28365 10961 10591 2819 -3880 -1279 C
-ATOM 3682 C GLY M 110 -26.847 -4.835-117.605 1.00128.38 C
-ANISOU 3682 C GLY M 110 27788 10725 10264 2780 -3845 -1296 C
-ATOM 3683 O GLY M 110 -27.961 -4.745-118.133 1.00120.56 O
-ANISOU 3683 O GLY M 110 26849 9637 9323 3396 -4012 -1355 O
-ATOM 3684 N VAL M 111 -25.811 -5.423-118.196 1.00133.03 N
-ANISOU 3684 N VAL M 111 28130 11588 10826 2058 -3639 -1248 N
-ATOM 3685 CA VAL M 111 -25.920 -6.013-119.526 1.00131.84 C
-ANISOU 3685 CA VAL M 111 27782 11607 10703 1935 -3576 -1254 C
-ATOM 3686 C VAL M 111 -26.455 -7.434-119.396 1.00116.98 C
-ANISOU 3686 C VAL M 111 24771 10304 9373 2349 -3272 -1339 C
-ATOM 3687 O VAL M 111 -25.875 -8.268-118.693 1.00123.14 O
-ANISOU 3687 O VAL M 111 24828 11508 10450 2159 -2981 -1334 O
-ATOM 3688 CB VAL M 111 -24.572 -5.987-120.261 1.00143.44 C
-ANISOU 3688 CB VAL M 111 29355 13182 11965 952 -3434 -1116 C
-ATOM 3689 CG1 VAL M 111 -24.303 -4.599-120.816 1.00153.70 C
-ANISOU 3689 CG1 VAL M 111 31577 13900 12923 550 -3665 -907 C
-ATOM 3690 CG2 VAL M 111 -23.444 -6.406-119.329 1.00150.49 C
-ANISOU 3690 CG2 VAL M 111 29713 14456 13009 460 -3170 -1090 C
-ATOM 3691 N TRP M 112 -27.572 -7.706-120.067 1.00112.37 N
-ANISOU 3691 N TRP M 112 24064 9724 8906 2911 -3363 -1419 N
-ATOM 3692 CA TRP M 112 -28.170 -9.031-120.017 1.00110.85 C
-ANISOU 3692 CA TRP M 112 22869 10055 9196 3275 -3099 -1498 C
-ATOM 3693 C TRP M 112 -27.267 -10.040-120.715 1.00104.26 C
-ANISOU 3693 C TRP M 112 21436 9622 8556 2689 -2790 -1405 C
-ATOM 3694 O TRP M 112 -26.797 -9.801-121.832 1.00112.92 O
-ANISOU 3694 O TRP M 112 22862 10603 9439 2250 -2831 -1324 O
-ATOM 3695 CB TRP M 112 -29.552 -9.023-120.669 1.00110.77 C
-ANISOU 3695 CB TRP M 112 22896 9969 9224 3958 -3298 -1614 C
-ATOM 3696 CG TRP M 112 -30.531 -8.079-120.031 1.00113.12 C
-ANISOU 3696 CG TRP M 112 23714 9930 9339 4647 -3615 -1761 C
-ATOM 3697 CD1 TRP M 112 -30.718 -6.761-120.334 1.00124.47 C
-ANISOU 3697 CD1 TRP M 112 26104 10812 10376 4761 -4007 -1717 C
-ATOM 3698 CD2 TRP M 112 -31.453 -8.381-118.975 1.00112.76 C
-ANISOU 3698 CD2 TRP M 112 23195 10129 9521 5296 -3551 -1940 C
-ATOM 3699 NE1 TRP M 112 -31.703 -6.227-119.539 1.00128.37 N
-ANISOU 3699 NE1 TRP M 112 26584 11311 10880 5429 -4182 -1782 N
-ATOM 3700 CE2 TRP M 112 -32.168 -7.201-118.695 1.00120.36 C
-ANISOU 3700 CE2 TRP M 112 24695 10806 10231 5740 -3894 -1941 C
-ATOM 3701 CE3 TRP M 112 -31.743 -9.536-118.242 1.00110.56 C
-ANISOU 3701 CE3 TRP M 112 21968 10391 9647 5445 -3216 -2006 C
-ATOM 3702 CZ2 TRP M 112 -33.154 -7.142-117.713 1.00122.09 C
-ANISOU 3702 CZ2 TRP M 112 24502 11332 10555 6299 -3893 -2063 C
-ATOM 3703 CZ3 TRP M 112 -32.722 -9.475-117.267 1.00102.17 C
-ANISOU 3703 CZ3 TRP M 112 20642 9505 8673 6038 -3223 -2166 C
-ATOM 3704 CH2 TRP M 112 -33.415 -8.287-117.012 1.00113.22 C
-ANISOU 3704 CH2 TRP M 112 22495 10718 9807 6403 -3539 -2172 C
-ATOM 3705 N LYS M 113 -27.021 -11.166-120.053 1.00 90.68 N
-ANISOU 3705 N LYS M 113 18868 8369 7218 2688 -2490 -1430 N
-ATOM 3706 CA LYS M 113 -26.176 -12.225-120.584 1.00 88.72 C
-ANISOU 3706 CA LYS M 113 17991 8535 7182 2232 -2202 -1382 C
-ATOM 3707 C LYS M 113 -27.044 -13.427-120.922 1.00 93.74 C
-ANISOU 3707 C LYS M 113 17936 9500 8182 2649 -2059 -1449 C
-ATOM 3708 O LYS M 113 -27.807 -13.902-120.074 1.00 85.39 O
-ANISOU 3708 O LYS M 113 16504 8588 7353 3115 -2011 -1528 O
-ATOM 3709 CB LYS M 113 -25.092 -12.618-119.578 1.00 96.44 C
-ANISOU 3709 CB LYS M 113 18584 9775 8284 1879 -2009 -1364 C
-ATOM 3710 CG LYS M 113 -23.693 -12.700-120.167 1.00100.84 C
-ANISOU 3710 CG LYS M 113 19068 10520 8727 1135 -1871 -1306 C
-ATOM 3711 CD LYS M 113 -23.056 -11.320-120.250 1.00109.36 C
-ANISOU 3711 CD LYS M 113 20991 11223 9339 650 -2064 -1235 C
-ATOM 3712 N ASP M 114 -26.935 -13.911-122.157 1.00104.76 N
-ANISOU 3712 N ASP M 114 19188 11014 9602 2448 -1988 -1421 N
-ATOM 3713 CA ASP M 114 -27.714 -15.065-122.583 1.00 99.61 C
-ANISOU 3713 CA ASP M 114 17926 10657 9264 2779 -1865 -1475 C
-ATOM 3714 C ASP M 114 -27.112 -16.340-122.005 1.00 90.71 C
-ANISOU 3714 C ASP M 114 16040 9960 8466 2642 -1573 -1488 C
-ATOM 3715 O ASP M 114 -25.904 -16.574-122.109 1.00 89.81 O
-ANISOU 3715 O ASP M 114 15783 10002 8337 2160 -1430 -1454 O
-ATOM 3716 CB ASP M 114 -27.779 -15.138-124.107 1.00112.80 C
-ANISOU 3716 CB ASP M 114 19755 12281 10824 2604 -1904 -1442 C
-ATOM 3717 CG ASP M 114 -28.723 -14.105-124.700 1.00129.92 C
-ANISOU 3717 CG ASP M 114 22611 14034 12720 2925 -2242 -1455 C
-ATOM 3718 OD1 ASP M 114 -29.550 -13.552-123.946 1.00128.86 O
-ANISOU 3718 OD1 ASP M 114 22671 13731 12560 3420 -2427 -1528 O
-ATOM 3719 OD2 ASP M 114 -28.643 -13.851-125.921 1.00139.40 O1-
-ANISOU 3719 OD2 ASP M 114 24170 15079 13717 2703 -2335 -1407 O1-
-ATOM 3720 N ASN M 115 -27.961 -17.159-121.392 1.00 84.71 N
-ANISOU 3720 N ASN M 115 14808 9400 7980 3066 -1499 -1553 N
-ATOM 3721 CA ASN M 115 -27.539 -18.369-120.688 1.00 79.66 C
-ANISOU 3721 CA ASN M 115 13541 9100 7626 3009 -1274 -1568 C
-ATOM 3722 C ASN M 115 -27.684 -19.556-121.633 1.00 74.87 C
-ANISOU 3722 C ASN M 115 12489 8745 7213 2987 -1139 -1580 C
-ATOM 3723 O ASN M 115 -28.746 -20.174-121.723 1.00 70.99 O
-ANISOU 3723 O ASN M 115 11743 8359 6871 3320 -1130 -1624 O
-ATOM 3724 CB ASN M 115 -28.363 -18.555-119.420 1.00 82.43 C
-ANISOU 3724 CB ASN M 115 13715 9502 8102 3412 -1268 -1628 C
-ATOM 3725 CG ASN M 115 -27.960 -19.782-118.636 1.00 79.16 C
-ANISOU 3725 CG ASN M 115 12762 9378 7939 3347 -1074 -1634 C
-ATOM 3726 OD1 ASN M 115 -26.883 -20.343-118.842 1.00 87.63 O
-ANISOU 3726 OD1 ASN M 115 13626 10589 9079 3019 -974 -1604 O
-ATOM 3727 ND2 ASN M 115 -28.826 -20.209-117.726 1.00 72.68 N
-ANISOU 3727 ND2 ASN M 115 11725 8660 7232 3663 -1030 -1688 N
-ATOM 3728 N ILE M 116 -26.598 -19.884-122.329 1.00 74.69 N
-ANISOU 3728 N ILE M 116 12363 8844 7172 2577 -1030 -1556 N
-ATOM 3729 CA ILE M 116 -26.601 -20.987-123.287 1.00 77.01 C
-ANISOU 3729 CA ILE M 116 12284 9359 7617 2533 -903 -1579 C
-ATOM 3730 C ILE M 116 -26.391 -22.299-122.543 1.00 69.61 C
-ANISOU 3730 C ILE M 116 10797 8693 6957 2626 -754 -1619 C
-ATOM 3731 O ILE M 116 -25.421 -22.449-121.790 1.00 74.30 O
-ANISOU 3731 O ILE M 116 11249 9392 7590 2457 -693 -1632 O
-ATOM 3732 CB ILE M 116 -25.519 -20.781-124.359 1.00 72.96 C
-ANISOU 3732 CB ILE M 116 11890 8894 6936 2065 -835 -1569 C
-ATOM 3733 CG1 ILE M 116 -25.760 -19.473-125.116 1.00 74.66 C
-ANISOU 3733 CG1 ILE M 116 12762 8782 6822 1934 -1011 -1514 C
-ATOM 3734 CG2 ILE M 116 -25.493 -21.957-125.319 1.00 70.74 C
-ANISOU 3734 CG2 ILE M 116 11228 8846 6803 2047 -697 -1612 C
-ATOM 3735 CD1 ILE M 116 -24.712 -19.168-126.166 1.00 82.74 C
-ANISOU 3735 CD1 ILE M 116 13972 9853 7611 1388 -931 -1503 C
-ATOM 3736 N ASN M 117 -27.295 -23.255-122.758 1.00 66.83 N
-ANISOU 3736 N ASN M 117 10166 8448 6778 2880 -717 -1642 N
-ATOM 3737 CA ASN M 117 -27.191 -24.544-122.086 1.00 67.36 C
-ANISOU 3737 CA ASN M 117 9810 8718 7068 2960 -607 -1672 C
-ATOM 3738 C ASN M 117 -25.888 -25.232-122.459 1.00 72.64 C
-ANISOU 3738 C ASN M 117 10251 9562 7788 2703 -502 -1711 C
-ATOM 3739 O ASN M 117 -25.417 -25.142-123.595 1.00 92.33 O
-ANISOU 3739 O ASN M 117 12786 12100 10196 2500 -462 -1729 O
-ATOM 3740 CB ASN M 117 -28.372 -25.446-122.449 1.00 65.03 C
-ANISOU 3740 CB ASN M 117 9307 8504 6898 3190 -591 -1689 C
-ATOM 3741 CG ASN M 117 -28.251 -26.837-121.842 1.00 68.50 C
-ANISOU 3741 CG ASN M 117 9405 9103 7518 3222 -497 -1710 C
-ATOM 3742 OD1 ASN M 117 -27.690 -27.748-122.452 1.00 72.84 O
-ANISOU 3742 OD1 ASN M 117 9782 9755 8140 3122 -436 -1737 O
-ATOM 3743 ND2 ASN M 117 -28.778 -27.003-120.633 1.00 73.83 N
-ANISOU 3743 ND2 ASN M 117 10024 9790 8240 3365 -496 -1709 N
-ATOM 3744 N MET M 118 -25.306 -25.923-121.497 1.00 70.10 N
-ANISOU 3744 N MET M 118 9694 9353 7589 2725 -466 -1742 N
-ATOM 3745 CA MET M 118 -24.032 -26.590-121.707 1.00 80.78 C
-ANISOU 3745 CA MET M 118 10789 10908 8994 2558 -398 -1821 C
-ATOM 3746 C MET M 118 -24.070 -28.068-121.369 1.00 78.06 C
-ANISOU 3746 C MET M 118 10154 10669 8835 2747 -378 -1870 C
-ATOM 3747 O MET M 118 -23.458 -28.874-122.078 1.00 85.84 O
-ANISOU 3747 O MET M 118 10935 11811 9871 2716 -327 -1957 O
-ATOM 3748 CB MET M 118 -22.951 -25.911-120.873 1.00 74.56 C
-ANISOU 3748 CB MET M 118 10036 10161 8133 2371 -429 -1840 C
-ATOM 3749 CG MET M 118 -22.757 -24.431-121.155 1.00 81.78 C
-ANISOU 3749 CG MET M 118 11314 10943 8815 2113 -468 -1791 C
-ATOM 3750 SD MET M 118 -22.020 -24.132-122.766 1.00 96.85 S
-ANISOU 3750 SD MET M 118 13254 12991 10554 1738 -371 -1842 S
-ATOM 3751 CE MET M 118 -20.606 -25.230-122.698 1.00 94.54 C
-ANISOU 3751 CE MET M 118 12415 13112 10393 1644 -263 -2009 C
-ATOM 3752 N ALA M 119 -24.768 -28.447-120.301 1.00 62.55 N
-ANISOU 3752 N ALA M 119 8203 8619 6945 2935 -423 -1826 N
-ATOM 3753 CA ALA M 119 -24.889 -29.848-119.936 1.00 61.90 C
-ANISOU 3753 CA ALA M 119 7953 8577 6989 3079 -432 -1856 C
-ATOM 3754 C ALA M 119 -26.307 -30.132-119.469 1.00 61.53 C
-ANISOU 3754 C ALA M 119 7983 8439 6958 3213 -431 -1788 C
-ATOM 3755 O ALA M 119 -26.963 -29.275-118.866 1.00 61.14 O
-ANISOU 3755 O ALA M 119 8068 8318 6845 3253 -439 -1743 O
-ATOM 3756 CB ALA M 119 -23.891 -30.237-118.841 1.00 74.21 C
-ANISOU 3756 CB ALA M 119 9431 10175 8592 3102 -503 -1903 C
-ATOM 3757 N LEU M 120 -26.766 -31.351-119.751 1.00 68.39 N
-ANISOU 3757 N LEU M 120 8765 9328 7891 3272 -422 -1799 N
-ATOM 3758 CA LEU M 120 -28.094 -31.809-119.358 1.00 71.52 C
-ANISOU 3758 CA LEU M 120 9188 9704 8282 3328 -404 -1753 C
-ATOM 3759 C LEU M 120 -27.981 -33.269-118.945 1.00 79.32 C
-ANISOU 3759 C LEU M 120 10168 10663 9307 3333 -441 -1764 C
-ATOM 3760 O LEU M 120 -27.539 -34.106-119.737 1.00 94.08 O
-ANISOU 3760 O LEU M 120 11992 12538 11214 3342 -465 -1810 O
-ATOM 3761 CB LEU M 120 -29.101 -31.635-120.500 1.00 64.06 C
-ANISOU 3761 CB LEU M 120 8214 8805 7319 3337 -372 -1746 C
-ATOM 3762 CG LEU M 120 -30.570 -31.501-120.089 1.00 63.12 C
-ANISOU 3762 CG LEU M 120 8075 8745 7163 3398 -348 -1730 C
-ATOM 3763 CD1 LEU M 120 -30.763 -30.310-119.161 1.00 62.80 C
-ANISOU 3763 CD1 LEU M 120 8124 8679 7057 3486 -353 -1729 C
-ATOM 3764 CD2 LEU M 120 -31.450 -31.373-121.319 1.00 65.31 C
-ANISOU 3764 CD2 LEU M 120 8299 9088 7427 3428 -358 -1743 C
-ATOM 3765 N VAL M 121 -28.358 -33.565-117.702 1.00 74.88 N
-ANISOU 3765 N VAL M 121 9695 10051 8706 3327 -457 -1729 N
-ATOM 3766 CA VAL M 121 -28.184 -34.885-117.107 1.00 73.89 C
-ANISOU 3766 CA VAL M 121 9677 9834 8564 3310 -532 -1728 C
-ATOM 3767 C VAL M 121 -29.446 -35.226-116.326 1.00 80.94 C
-ANISOU 3767 C VAL M 121 10658 10738 9359 3198 -473 -1674 C
-ATOM 3768 O VAL M 121 -30.136 -34.340-115.819 1.00 88.65 O
-ANISOU 3768 O VAL M 121 11593 11800 10290 3190 -387 -1661 O
-ATOM 3769 CB VAL M 121 -26.938 -34.931-116.187 1.00 77.26 C
-ANISOU 3769 CB VAL M 121 10175 10178 9002 3380 -650 -1757 C
-ATOM 3770 CG1 VAL M 121 -26.770 -36.301-115.557 1.00 92.52 C
-ANISOU 3770 CG1 VAL M 121 12305 11961 10886 3398 -781 -1758 C
-ATOM 3771 CG2 VAL M 121 -25.679 -34.543-116.954 1.00 77.93 C
-ANISOU 3771 CG2 VAL M 121 10100 10345 9163 3450 -684 -1844 C
-ATOM 3772 N VAL M 122 -29.759 -36.517-116.237 1.00 86.47 N
-ANISOU 3772 N VAL M 122 11494 11361 9999 3100 -518 -1657 N
-ATOM 3773 CA VAL M 122 -30.881 -37.003-115.440 1.00 93.72 C
-ANISOU 3773 CA VAL M 122 12519 12312 10777 2904 -453 -1614 C
-ATOM 3774 C VAL M 122 -30.354 -37.991-114.408 1.00103.25 C
-ANISOU 3774 C VAL M 122 14048 13303 11879 2838 -584 -1583 C
-ATOM 3775 O VAL M 122 -29.588 -38.900-114.745 1.00107.35 O
-ANISOU 3775 O VAL M 122 14724 13648 12415 2916 -741 -1603 O
-ATOM 3776 CB VAL M 122 -31.969 -37.649-116.317 1.00 88.22 C
-ANISOU 3776 CB VAL M 122 11753 11727 10040 2750 -393 -1612 C
-ATOM 3777 CG1 VAL M 122 -32.954 -38.421-115.458 1.00 85.00 C
-ANISOU 3777 CG1 VAL M 122 11494 11359 9444 2462 -338 -1577 C
-ATOM 3778 CG2 VAL M 122 -32.696 -36.581-117.114 1.00 89.02 C
-ANISOU 3778 CG2 VAL M 122 11563 12051 10209 2827 -288 -1647 C
-ATOM 3779 N ASP M 123 -30.764 -37.806-113.154 1.00105.10 N
-ANISOU 3779 N ASP M 123 14406 13542 11986 2714 -532 -1549 N
-ATOM 3780 CA ASP M 123 -30.352 -38.657-112.045 1.00101.53 C
-ANISOU 3780 CA ASP M 123 14328 12860 11388 2623 -669 -1509 C
-ATOM 3781 C ASP M 123 -31.526 -39.525-111.613 1.00 99.53 C
-ANISOU 3781 C ASP M 123 14277 12629 10910 2270 -587 -1462 C
-ATOM 3782 O ASP M 123 -32.637 -39.020-111.410 1.00 93.50 O
-ANISOU 3782 O ASP M 123 13321 12129 10074 2102 -378 -1474 O
-ATOM 3783 CB ASP M 123 -29.852 -37.822-110.864 1.00112.45 C
-ANISOU 3783 CB ASP M 123 15765 14212 12750 2697 -680 -1503 C
-ATOM 3784 CG ASP M 123 -29.781 -38.619-109.570 1.00137.57 C
-ANISOU 3784 CG ASP M 123 19371 17180 15721 2534 -789 -1450 C
-ATOM 3785 OD1 ASP M 123 -29.344 -39.790-109.608 1.00141.04 O
-ANISOU 3785 OD1 ASP M 123 20120 17379 16090 2525 -989 -1435 O
-ATOM 3786 OD2 ASP M 123 -30.170 -38.077-108.513 1.00151.93 O1-
-ANISOU 3786 OD2 ASP M 123 21254 19053 17418 2422 -687 -1431 O1-
-ATOM 3787 N THR M 124 -31.269 -40.826-111.466 1.00107.45 N
-ANISOU 3787 N THR M 124 15681 13368 11778 2156 -763 -1425 N
-ATOM 3788 CA THR M 124 -32.277 -41.791-111.054 1.00112.65 C
-ANISOU 3788 CA THR M 124 16633 14002 12168 1739 -715 -1370 C
-ATOM 3789 C THR M 124 -31.885 -42.567-109.803 1.00116.37 C
-ANISOU 3789 C THR M 124 17665 14152 12398 1593 -889 -1309 C
-ATOM 3790 O THR M 124 -32.711 -43.329-109.284 1.00112.16 O
-ANISOU 3790 O THR M 124 17450 13585 11579 1169 -841 -1254 O
-ATOM 3791 CB THR M 124 -32.563 -42.779-112.199 1.00115.15 C
-ANISOU 3791 CB THR M 124 17031 14251 12469 1646 -786 -1369 C
-ATOM 3792 OG1 THR M 124 -32.568 -42.067-113.441 1.00114.98 O
-ANISOU 3792 OG1 THR M 124 16548 14445 12695 1874 -698 -1428 O
-ATOM 3793 CG2 THR M 124 -33.923 -43.446-112.024 1.00121.41 C
-ANISOU 3793 CG2 THR M 124 17948 15182 12999 1133 -647 -1327 C
-ATOM 3794 N TYR M 125 -30.661 -42.393-109.301 1.00123.41 N
-ANISOU 3794 N TYR M 125 18700 14818 13371 1904 -1098 -1323 N
-ATOM 3795 CA TYR M 125 -30.235 -43.109-108.103 1.00132.25 C
-ANISOU 3795 CA TYR M 125 20395 15601 14253 1808 -1313 -1269 C
-ATOM 3796 C TYR M 125 -31.166 -42.815-106.933 1.00138.64 C
-ANISOU 3796 C TYR M 125 21323 16539 14814 1411 -1102 -1213 C
-ATOM 3797 O TYR M 125 -31.809 -43.719-106.387 1.00142.50 O
-ANISOU 3797 O TYR M 125 22260 16900 14984 996 -1108 -1148 O
-ATOM 3798 CB TYR M 125 -28.795 -42.738-107.749 1.00133.35 C
-ANISOU 3798 CB TYR M 125 20544 15572 14549 2238 -1559 -1320 C
-ATOM 3799 CG TYR M 125 -28.195 -43.666-106.723 1.00143.36 C
-ANISOU 3799 CG TYR M 125 22459 16427 15583 2236 -1886 -1284 C
-ATOM 3800 CD1 TYR M 125 -28.559 -45.006-106.683 1.00143.26 C
-ANISOU 3800 CD1 TYR M 125 23022 16110 15300 2004 -2050 -1230 C
-ATOM 3801 CD2 TYR M 125 -27.298 -43.199-105.771 1.00150.15 C
-ANISOU 3801 CD2 TYR M 125 23407 17181 16462 2444 -2052 -1300 C
-ATOM 3802 CE1 TYR M 125 -28.028 -45.862-105.744 1.00152.78 C
-ANISOU 3802 CE1 TYR M 125 24910 16886 16254 2010 -2391 -1195 C
-ATOM 3803 CE2 TYR M 125 -26.762 -44.049-104.822 1.00156.37 C
-ANISOU 3803 CE2 TYR M 125 24825 17570 17018 2463 -2391 -1271 C
-ATOM 3804 CZ TYR M 125 -27.131 -45.381-104.815 1.00161.10 C
-ANISOU 3804 CZ TYR M 125 26028 17841 17342 2257 -2567 -1218 C
-ATOM 3805 OH TYR M 125 -26.608 -46.240-103.877 1.00166.55 O
-ANISOU 3805 OH TYR M 125 27435 18081 17765 2285 -2947 -1188 O
-ATOM 3806 N TYR M 126 -31.252 -41.547-106.534 1.00137.26 N
-ANISOU 3806 N TYR M 126 20776 16623 14755 1515 -911 -1248 N
-ATOM 3807 CA TYR M 126 -32.183 -41.145-105.488 1.00136.56 C
-ANISOU 3807 CA TYR M 126 20718 16730 14438 1182 -668 -1235 C
-ATOM 3808 C TYR M 126 -33.493 -40.690-106.114 1.00121.03 C
-ANISOU 3808 C TYR M 126 18274 15220 12493 1001 -339 -1296 C
-ATOM 3809 O TYR M 126 -34.002 -41.336-107.036 1.00115.01 O
-ANISOU 3809 O TYR M 126 17438 14525 11734 862 -321 -1296 O
-ATOM 3810 CB TYR M 126 -31.577 -40.037-104.625 1.00148.38 C
-ANISOU 3810 CB TYR M 126 22133 18235 16008 1412 -664 -1257 C
-ATOM 3811 CG TYR M 126 -30.393 -40.492-103.802 1.00160.11 C
-ANISOU 3811 CG TYR M 126 24101 19312 17423 1545 -996 -1208 C
-ATOM 3812 CD1 TYR M 126 -30.399 -41.729-103.171 1.00165.93 C
-ANISOU 3812 CD1 TYR M 126 25463 19723 17862 1281 -1185 -1134 C
-ATOM 3813 CD2 TYR M 126 -29.271 -39.684-103.655 1.00161.69 C
-ANISOU 3813 CD2 TYR M 126 24156 19449 17831 1921 -1146 -1243 C
-ATOM 3814 CE1 TYR M 126 -29.321 -42.153-102.419 1.00168.84 C
-ANISOU 3814 CE1 TYR M 126 26299 19700 18152 1451 -1539 -1105 C
-ATOM 3815 CE2 TYR M 126 -28.187 -40.099-102.903 1.00164.96 C
-ANISOU 3815 CE2 TYR M 126 24970 19527 18181 2067 -1478 -1222 C
-ATOM 3816 CZ TYR M 126 -28.218 -41.334-102.287 1.00169.62 C
-ANISOU 3816 CZ TYR M 126 26177 19785 18486 1862 -1686 -1157 C
-ATOM 3817 OH TYR M 126 -27.142 -41.752-101.537 1.00171.18 O
-ANISOU 3817 OH TYR M 126 26799 19633 18610 2055 -2065 -1149 O
-ATOM 3818 N ASP M 127 -34.049 -39.587-105.622 1.00120.33 N
-ANISOU 3818 N ASP M 127 17868 15446 12406 1022 -98 -1364 N
-ATOM 3819 CA ASP M 127 -35.222 -39.001-106.254 1.00120.63 C
-ANISOU 3819 CA ASP M 127 17389 15948 12496 973 175 -1464 C
-ATOM 3820 C ASP M 127 -34.856 -38.514-107.651 1.00113.83 C
-ANISOU 3820 C ASP M 127 16165 15120 11965 1347 99 -1493 C
-ATOM 3821 O ASP M 127 -33.911 -37.736-107.815 1.00111.63 O
-ANISOU 3821 O ASP M 127 15814 14708 11894 1713 -13 -1495 O
-ATOM 3822 CB ASP M 127 -35.763 -37.852-105.403 1.00119.95 C
-ANISOU 3822 CB ASP M 127 17075 16158 12342 1026 403 -1561 C
-ATOM 3823 N ASP M 128 -35.594 -38.987-108.656 1.00108.38 N
-ANISOU 3823 N ASP M 128 15273 14610 11297 1215 158 -1516 N
-ATOM 3824 CA ASP M 128 -35.278 -38.664-110.042 1.00105.30 C
-ANISOU 3824 CA ASP M 128 14602 14228 11180 1519 79 -1537 C
-ATOM 3825 C ASP M 128 -35.321 -37.157-110.263 1.00 97.18 C
-ANISOU 3825 C ASP M 128 13192 13402 10329 1866 169 -1621 C
-ATOM 3826 O ASP M 128 -36.256 -36.480-109.828 1.00 97.26 O
-ANISOU 3826 O ASP M 128 12968 13732 10253 1838 358 -1713 O
-ATOM 3827 CB ASP M 128 -36.252 -39.371-110.987 1.00117.80 C
-ANISOU 3827 CB ASP M 128 16030 16013 12717 1276 144 -1557 C
-ATOM 3828 CG ASP M 128 -36.252 -40.884-110.808 1.00131.39 C
-ANISOU 3828 CG ASP M 128 18213 17492 14219 895 33 -1470 C
-ATOM 3829 OD1 ASP M 128 -35.880 -41.361-109.714 1.00143.07 O
-ANISOU 3829 OD1 ASP M 128 20117 18737 15505 730 -34 -1409 O
-ATOM 3830 OD2 ASP M 128 -36.626 -41.596-111.766 1.00120.64 O1-
-ANISOU 3830 OD2 ASP M 128 16838 16147 12854 756 -7 -1461 O1-
-ATOM 3831 N GLN M 129 -34.297 -36.632-110.936 1.00 90.04 N
-ANISOU 3831 N GLN M 129 12249 12317 9646 2191 27 -1604 N
-ATOM 3832 CA GLN M 129 -34.161 -35.190-111.097 1.00 81.28 C
-ANISOU 3832 CA GLN M 129 10912 11306 8665 2495 65 -1664 C
-ATOM 3833 C GLN M 129 -33.386 -34.883-112.372 1.00 88.89 C
-ANISOU 3833 C GLN M 129 11775 12159 9839 2722 -57 -1653 C
-ATOM 3834 O GLN M 129 -32.846 -35.775-113.030 1.00100.61 O
-ANISOU 3834 O GLN M 129 13350 13495 11381 2682 -166 -1613 O
-ATOM 3835 CB GLN M 129 -33.478 -34.561-109.879 1.00 83.20 C
-ANISOU 3835 CB GLN M 129 11349 11407 8856 2577 37 -1649 C
-ATOM 3836 CG GLN M 129 -32.142 -35.192-109.526 1.00 91.19 C
-ANISOU 3836 CG GLN M 129 12666 12084 9897 2585 -168 -1569 C
-ATOM 3837 CD GLN M 129 -31.688 -34.851-108.119 1.00100.26 C
-ANISOU 3837 CD GLN M 129 14057 13108 10929 2570 -199 -1549 C
-ATOM 3838 OE1 GLN M 129 -32.474 -34.382-107.295 1.00107.56 O
-ANISOU 3838 OE1 GLN M 129 14976 14187 11705 2486 -39 -1587 O
-ATOM 3839 NE2 GLN M 129 -30.414 -35.092-107.836 1.00102.05 N
-ANISOU 3839 NE2 GLN M 129 14488 13077 11210 2664 -411 -1507 N
-ATOM 3840 N LEU M 130 -33.330 -33.593-112.705 1.00 89.43 N
-ANISOU 3840 N LEU M 130 11691 12294 9994 2955 -40 -1700 N
-ATOM 3841 CA LEU M 130 -32.726 -33.104-113.941 1.00 78.06 C
-ANISOU 3841 CA LEU M 130 10164 10788 8706 3123 -125 -1700 C
-ATOM 3842 C LEU M 130 -31.701 -32.034-113.588 1.00 82.21 C
-ANISOU 3842 C LEU M 130 10792 11171 9271 3272 -195 -1692 C
-ATOM 3843 O LEU M 130 -32.065 -30.949-113.123 1.00 94.15 O
-ANISOU 3843 O LEU M 130 12311 12734 10728 3385 -153 -1731 O
-ATOM 3844 CB LEU M 130 -33.793 -32.550-114.887 1.00 68.01 C
-ANISOU 3844 CB LEU M 130 8661 9728 7452 3218 -67 -1765 C
-ATOM 3845 CG LEU M 130 -33.332 -31.883-116.186 1.00 78.72 C
-ANISOU 3845 CG LEU M 130 9979 11015 8917 3370 -151 -1766 C
-ATOM 3846 CD1 LEU M 130 -32.608 -32.869-117.085 1.00 84.08 C
-ANISOU 3846 CD1 LEU M 130 10687 11584 9678 3274 -214 -1721 C
-ATOM 3847 CD2 LEU M 130 -34.508 -31.266-116.924 1.00 81.16 C
-ANISOU 3847 CD2 LEU M 130 10108 11521 9209 3501 -132 -1842 C
-ATOM 3848 N ILE M 131 -30.426 -32.338-113.807 1.00 73.47 N
-ANISOU 3848 N ILE M 131 9766 9905 8243 3272 -308 -1660 N
-ATOM 3849 CA ILE M 131 -29.331 -31.408-113.557 1.00 76.78 C
-ANISOU 3849 CA ILE M 131 10259 10225 8690 3346 -383 -1659 C
-ATOM 3850 C ILE M 131 -28.990 -30.696-114.861 1.00 71.97 C
-ANISOU 3850 C ILE M 131 9558 9638 8148 3398 -398 -1679 C
-ATOM 3851 O ILE M 131 -28.664 -31.342-115.866 1.00 74.41 O
-ANISOU 3851 O ILE M 131 9775 9968 8531 3372 -417 -1689 O
-ATOM 3852 CB ILE M 131 -28.102 -32.135-112.992 1.00 70.51 C
-ANISOU 3852 CB ILE M 131 9562 9306 7923 3313 -510 -1647 C
-ATOM 3853 CG1 ILE M 131 -28.459 -32.848-111.686 1.00 71.19 C
-ANISOU 3853 CG1 ILE M 131 9830 9321 7899 3235 -520 -1615 C
-ATOM 3854 CG2 ILE M 131 -26.950 -31.163-112.786 1.00 64.34 C
-ANISOU 3854 CG2 ILE M 131 8804 8481 7162 3344 -588 -1662 C
-ATOM 3855 CD1 ILE M 131 -27.323 -33.667-111.107 1.00 72.99 C
-ANISOU 3855 CD1 ILE M 131 10206 9394 8134 3247 -701 -1612 C
-ATOM 3856 N SER M 132 -29.051 -29.367-114.843 1.00 68.87 N
-ANISOU 3856 N SER M 132 9242 9223 7702 3462 -398 -1687 N
-ATOM 3857 CA SER M 132 -28.716 -28.536-115.988 1.00 65.53 C
-ANISOU 3857 CA SER M 132 8836 8780 7284 3466 -428 -1695 C
-ATOM 3858 C SER M 132 -27.566 -27.611-115.624 1.00 68.28 C
-ANISOU 3858 C SER M 132 9331 9031 7580 3388 -496 -1686 C
-ATOM 3859 O SER M 132 -27.567 -26.996-114.553 1.00 78.52 O
-ANISOU 3859 O SER M 132 10778 10255 8801 3418 -519 -1678 O
-ATOM 3860 CB SER M 132 -29.916 -27.706-116.444 1.00 72.00 C
-ANISOU 3860 CB SER M 132 9695 9626 8035 3608 -413 -1720 C
-ATOM 3861 OG SER M 132 -30.180 -26.659-115.525 1.00 84.02 O
-ANISOU 3861 OG SER M 132 11394 11081 9451 3716 -435 -1739 O
-ATOM 3862 N CYS M 133 -26.589 -27.510-116.520 1.00 71.04 N
-ANISOU 3862 N CYS M 133 9638 9403 7950 3261 -520 -1699 N
-ATOM 3863 CA CYS M 133 -25.463 -26.603-116.352 1.00 74.46 C
-ANISOU 3863 CA CYS M 133 10187 9798 8308 3106 -575 -1702 C
-ATOM 3864 C CYS M 133 -25.453 -25.637-117.528 1.00 86.03 C
-ANISOU 3864 C CYS M 133 11799 11220 9667 2999 -577 -1695 C
-ATOM 3865 O CYS M 133 -25.410 -26.067-118.687 1.00107.81 O
-ANISOU 3865 O CYS M 133 14441 14061 12462 2948 -533 -1716 O
-ATOM 3866 CB CYS M 133 -24.146 -27.375-116.263 1.00 90.89 C
-ANISOU 3866 CB CYS M 133 12061 12005 10470 3001 -603 -1756 C
-ATOM 3867 SG CYS M 133 -24.131 -28.691-115.012 1.00116.23 S
-ANISOU 3867 SG CYS M 133 15183 15206 13775 3144 -659 -1764 S
-ATOM 3868 N GLY M 134 -25.514 -24.338-117.227 1.00 77.54 N
-ANISOU 3868 N GLY M 134 11036 9990 8435 2962 -642 -1667 N
-ATOM 3869 CA GLY M 134 -25.470 -23.303-118.235 1.00 68.49 C
-ANISOU 3869 CA GLY M 134 10158 8735 7128 2831 -685 -1650 C
-ATOM 3870 C GLY M 134 -24.101 -22.639-118.328 1.00 71.69 C
-ANISOU 3870 C GLY M 134 10678 9155 7405 2470 -707 -1651 C
-ATOM 3871 O GLY M 134 -23.162 -22.964-117.604 1.00 84.82 O
-ANISOU 3871 O GLY M 134 12164 10943 9122 2350 -700 -1680 O
-ATOM 3872 N SER M 135 -24.011 -21.676-119.250 1.00 68.95 N
-ANISOU 3872 N SER M 135 10653 8687 6860 2275 -750 -1626 N
-ATOM 3873 CA SER M 135 -22.753 -20.994-119.535 1.00 70.95 C
-ANISOU 3873 CA SER M 135 11039 8985 6934 1833 -752 -1632 C
-ATOM 3874 C SER M 135 -22.480 -19.828-118.595 1.00 81.76 C
-ANISOU 3874 C SER M 135 12808 10146 8112 1711 -874 -1590 C
-ATOM 3875 O SER M 135 -21.317 -19.562-118.270 1.00 89.07 O
-ANISOU 3875 O SER M 135 13694 11192 8955 1360 -870 -1611 O
-ATOM 3876 CB SER M 135 -22.746 -20.490-120.980 1.00 81.32 C
-ANISOU 3876 CB SER M 135 12595 10241 8063 1599 -742 -1616 C
-ATOM 3877 OG SER M 135 -23.842 -19.625-121.235 1.00 82.09 O
-ANISOU 3877 OG SER M 135 13170 10007 8012 1801 -884 -1556 O
-ATOM 3878 N VAL M 136 -23.522 -19.134-118.148 1.00 77.28 N
-ANISOU 3878 N VAL M 136 12613 9288 7462 1999 -989 -1549 N
-ATOM 3879 CA VAL M 136 -23.374 -17.946-117.314 1.00 75.78 C
-ANISOU 3879 CA VAL M 136 12901 8839 7053 1923 -1129 -1515 C
-ATOM 3880 C VAL M 136 -23.274 -18.336-115.846 1.00 85.32 C
-ANISOU 3880 C VAL M 136 13911 10112 8394 2082 -1118 -1533 C
-ATOM 3881 O VAL M 136 -23.339 -19.521-115.501 1.00 89.54 O
-ANISOU 3881 O VAL M 136 13975 10872 9176 2243 -1015 -1567 O
-ATOM 3882 CB VAL M 136 -24.551 -16.984-117.527 1.00 78.76 C
-ANISOU 3882 CB VAL M 136 13804 8867 7253 2226 -1285 -1498 C
-ATOM 3883 CG1 VAL M 136 -24.651 -16.575-118.985 1.00 95.76 C
-ANISOU 3883 CG1 VAL M 136 16232 10911 9243 2065 -1335 -1472 C
-ATOM 3884 CG2 VAL M 136 -25.822 -17.661-117.076 1.00 74.01 C
-ANISOU 3884 CG2 VAL M 136 12926 8333 6861 2756 -1247 -1550 C
-ATOM 3885 N ASN M 137 -23.132 -17.332-114.976 1.00 91.74 N
-ANISOU 3885 N ASN M 137 15147 10695 9016 2029 -1242 -1509 N
-ATOM 3886 CA ASN M 137 -23.128 -17.523-113.525 1.00 92.84 C
-ANISOU 3886 CA ASN M 137 15212 10836 9225 2184 -1254 -1523 C
-ATOM 3887 C ASN M 137 -22.036 -18.501-113.098 1.00 82.30 C
-ANISOU 3887 C ASN M 137 13393 9809 8070 1977 -1181 -1546 C
-ATOM 3888 O ASN M 137 -22.283 -19.469-112.375 1.00 75.43 O
-ANISOU 3888 O ASN M 137 12207 9061 7394 2208 -1127 -1569 O
-ATOM 3889 CB ASN M 137 -24.501 -17.979-113.025 1.00113.65 C
-ANISOU 3889 CB ASN M 137 17743 13450 11989 2693 -1209 -1560 C
-ATOM 3890 CG ASN M 137 -25.541 -16.879-113.100 1.00133.90 C
-ANISOU 3890 CG ASN M 137 20801 15721 14352 2982 -1328 -1583 C
-ATOM 3891 OD1 ASN M 137 -25.215 -15.695-113.008 1.00140.41 O
-ANISOU 3891 OD1 ASN M 137 22161 16270 14917 2842 -1479 -1559 O
-ATOM 3892 ND2 ASN M 137 -26.801 -17.265-113.268 1.00146.34 N
-ANISOU 3892 ND2 ASN M 137 22211 17363 16028 3393 -1280 -1646 N
-ATOM 3893 N ARG M 138 -20.815 -18.241-113.568 1.00 81.80 N
-ANISOU 3893 N ARG M 138 13286 9881 7914 1530 -1192 -1553 N
-ATOM 3894 CA ARG M 138 -19.632 -19.037-113.247 1.00 86.15 C
-ANISOU 3894 CA ARG M 138 13368 10765 8601 1332 -1162 -1615 C
-ATOM 3895 C ARG M 138 -19.763 -20.489-113.698 1.00 90.85 C
-ANISOU 3895 C ARG M 138 13428 11619 9473 1561 -1047 -1675 C
-ATOM 3896 O ARG M 138 -19.018 -21.356-113.233 1.00 96.78 O
-ANISOU 3896 O ARG M 138 13796 12606 10372 1572 -1057 -1744 O
-ATOM 3897 CB ARG M 138 -19.315 -18.975-111.747 1.00 82.68 C
-ANISOU 3897 CB ARG M 138 12983 10269 8161 1380 -1266 -1611 C
-ATOM 3898 N GLY M 139 -20.693 -20.773-114.605 1.00 90.22 N
-ANISOU 3898 N GLY M 139 13343 11486 9450 1756 -965 -1658 N
-ATOM 3899 CA GLY M 139 -20.883 -22.137-115.068 1.00 78.99 C
-ANISOU 3899 CA GLY M 139 11482 10268 8261 1959 -869 -1709 C
-ATOM 3900 C GLY M 139 -21.317 -23.095-113.982 1.00 74.61 C
-ANISOU 3900 C GLY M 139 10763 9710 7876 2270 -886 -1711 C
-ATOM 3901 O GLY M 139 -20.804 -24.219-113.906 1.00 78.98 O
-ANISOU 3901 O GLY M 139 10969 10455 8586 2333 -879 -1774 O
-ATOM 3902 N THR M 140 -22.248 -22.674-113.130 1.00 68.32 N
-ANISOU 3902 N THR M 140 10237 8696 7024 2466 -915 -1656 N
-ATOM 3903 CA THR M 140 -22.776 -23.537-112.086 1.00 67.04 C
-ANISOU 3903 CA THR M 140 9977 8523 6970 2707 -909 -1654 C
-ATOM 3904 C THR M 140 -23.997 -24.296-112.593 1.00 65.62 C
-ANISOU 3904 C THR M 140 9673 8367 6891 2942 -806 -1651 C
-ATOM 3905 O THR M 140 -24.550 -24.004-113.654 1.00 67.97 O
-ANISOU 3905 O THR M 140 9997 8657 7170 2969 -760 -1649 O
-ATOM 3906 CB THR M 140 -23.135 -22.727-110.844 1.00 67.77 C
-ANISOU 3906 CB THR M 140 10402 8421 6926 2772 -968 -1621 C
-ATOM 3907 OG1 THR M 140 -24.136 -21.758-111.177 1.00 68.22 O
-ANISOU 3907 OG1 THR M 140 10753 8314 6854 2898 -950 -1608 O
-ATOM 3908 CG2 THR M 140 -21.904 -22.019-110.311 1.00 74.62 C
-ANISOU 3908 CG2 THR M 140 11402 9268 7684 2504 -1089 -1621 C
-ATOM 3909 N CYS M 141 -24.421 -25.282-111.811 1.00 76.33 N
-ANISOU 3909 N CYS M 141 10921 9750 8331 3084 -783 -1652 N
-ATOM 3910 CA CYS M 141 -25.500 -26.172-112.203 1.00 75.57 C
-ANISOU 3910 CA CYS M 141 10681 9716 8316 3235 -687 -1655 C
-ATOM 3911 C CYS M 141 -26.657 -26.067-111.220 1.00 72.57 C
-ANISOU 3911 C CYS M 141 10426 9287 7858 3381 -629 -1651 C
-ATOM 3912 O CYS M 141 -26.509 -25.577-110.098 1.00 81.51 O
-ANISOU 3912 O CYS M 141 11747 10328 8894 3381 -666 -1644 O
-ATOM 3913 CB CYS M 141 -25.009 -27.620-112.292 1.00 87.04 C
-ANISOU 3913 CB CYS M 141 11908 11263 9899 3226 -706 -1673 C
-ATOM 3914 SG CYS M 141 -23.506 -27.814-113.282 1.00108.93 S
-ANISOU 3914 SG CYS M 141 14465 14175 12750 3090 -767 -1737 S
-ATOM 3915 N GLN M 142 -27.827 -26.517-111.674 1.00 65.43 N
-ANISOU 3915 N GLN M 142 9403 8476 6983 3492 -530 -1670 N
-ATOM 3916 CA GLN M 142 -29.045 -26.520-110.877 1.00 68.89 C
-ANISOU 3916 CA GLN M 142 9868 8969 7337 3612 -436 -1704 C
-ATOM 3917 C GLN M 142 -29.786 -27.823-111.136 1.00 82.60 C
-ANISOU 3917 C GLN M 142 11390 10855 9137 3577 -345 -1709 C
-ATOM 3918 O GLN M 142 -29.634 -28.433-112.196 1.00 83.28 O
-ANISOU 3918 O GLN M 142 11332 10984 9328 3535 -358 -1695 O
-ATOM 3919 CB GLN M 142 -29.951 -25.326-111.218 1.00 77.64 C
-ANISOU 3919 CB GLN M 142 11069 10080 8352 3811 -423 -1767 C
-ATOM 3920 CG GLN M 142 -29.211 -24.056-111.616 1.00 99.62 C
-ANISOU 3920 CG GLN M 142 14110 12675 11064 3803 -547 -1748 C
-ATOM 3921 CD GLN M 142 -30.055 -23.138-112.478 1.00124.15 C
-ANISOU 3921 CD GLN M 142 17319 15754 14098 4008 -589 -1804 C
-ATOM 3922 OE1 GLN M 142 -31.262 -23.013-112.273 1.00128.20 O
-ANISOU 3922 OE1 GLN M 142 17764 16381 14566 4249 -538 -1896 O
-ATOM 3923 NE2 GLN M 142 -29.423 -22.500-113.461 1.00132.32 N
-ANISOU 3923 NE2 GLN M 142 18521 16655 15102 3911 -690 -1765 N
-ATOM 3924 N ARG M 143 -30.593 -28.249-110.167 1.00 77.81 N
-ANISOU 3924 N ARG M 143 10790 10334 8441 3562 -249 -1733 N
-ATOM 3925 CA ARG M 143 -31.345 -29.491-110.282 1.00 79.34 C
-ANISOU 3925 CA ARG M 143 10835 10670 8640 3450 -160 -1735 C
-ATOM 3926 C ARG M 143 -32.840 -29.227-110.137 1.00 72.01 C
-ANISOU 3926 C ARG M 143 9759 9990 7613 3523 -7 -1833 C
-ATOM 3927 O ARG M 143 -33.264 -28.339-109.391 1.00 71.60 O
-ANISOU 3927 O ARG M 143 9770 9985 7448 3652 45 -1905 O
-ATOM 3928 CB ARG M 143 -30.878 -30.529-109.240 1.00 79.35 C
-ANISOU 3928 CB ARG M 143 10996 10571 8581 3270 -190 -1678 C
-ATOM 3929 CG ARG M 143 -31.089 -30.131-107.793 1.00 80.42 C
-ANISOU 3929 CG ARG M 143 11317 10686 8551 3243 -136 -1695 C
-ATOM 3930 CD ARG M 143 -30.322 -31.040-106.840 1.00 78.45 C
-ANISOU 3930 CD ARG M 143 11310 10256 8240 3084 -242 -1624 C
-ATOM 3931 NE ARG M 143 -30.568 -30.688-105.443 1.00 85.38 N
-ANISOU 3931 NE ARG M 143 12399 11111 8931 3028 -182 -1637 N
-ATOM 3932 CZ ARG M 143 -31.423 -31.325-104.650 1.00 96.48 C
-ANISOU 3932 CZ ARG M 143 13894 12614 10151 2839 -47 -1650 C
-ATOM 3933 NH1 ARG M 143 -32.110 -32.364-105.109 1.00 98.09 N1+
-ANISOU 3933 NH1 ARG M 143 14005 12937 10329 2664 28 -1644 N1+
-ATOM 3934 NH2 ARG M 143 -31.587 -30.930-103.394 1.00 98.50 N
-ANISOU 3934 NH2 ARG M 143 14354 12853 10220 2787 16 -1673 N
-ATOM 3935 N HIS M 144 -33.630 -30.006-110.877 1.00 79.58 N
-ANISOU 3935 N HIS M 144 10505 11128 8603 3447 56 -1854 N
-ATOM 3936 CA HIS M 144 -35.086 -29.915-110.894 1.00 91.70 C
-ANISOU 3936 CA HIS M 144 11803 12988 10052 3491 197 -1975 C
-ATOM 3937 C HIS M 144 -35.642 -31.276-110.497 1.00106.61 C
-ANISOU 3937 C HIS M 144 13633 15023 11849 3168 308 -1957 C
-ATOM 3938 O HIS M 144 -35.334 -32.282-111.142 1.00114.89 O
-ANISOU 3938 O HIS M 144 14705 15982 12966 3002 247 -1875 O
-ATOM 3939 CB HIS M 144 -35.610 -29.522-112.283 1.00 96.08 C
-ANISOU 3939 CB HIS M 144 12151 13652 10702 3668 145 -2028 C
-ATOM 3940 CG HIS M 144 -34.873 -28.385-112.929 1.00 92.75 C
-ANISOU 3940 CG HIS M 144 11884 13006 10350 3893 -2 -2006 C
-ATOM 3941 ND1 HIS M 144 -33.545 -28.464-113.294 1.00 93.13 N
-ANISOU 3941 ND1 HIS M 144 12108 12790 10489 3804 -108 -1892 N
-ATOM 3942 CD2 HIS M 144 -35.287 -27.149-113.296 1.00 80.71 C
-ANISOU 3942 CD2 HIS M 144 10389 11488 8789 4185 -71 -2094 C
-ATOM 3943 CE1 HIS M 144 -33.171 -27.323-113.844 1.00 78.58 C
-ANISOU 3943 CE1 HIS M 144 10400 10810 8646 3964 -212 -1899 C
-ATOM 3944 NE2 HIS M 144 -34.209 -26.507-113.858 1.00 69.65 N
-ANISOU 3944 NE2 HIS M 144 9229 9802 7434 4206 -208 -2010 N
-ATOM 3945 N VAL M 145 -36.465 -31.315-109.452 1.00110.09 N
-ANISOU 3945 N VAL M 145 14031 15690 12109 3060 470 -2041 N
-ATOM 3946 CA VAL M 145 -36.955 -32.577-108.903 1.00107.36 C
-ANISOU 3946 CA VAL M 145 13720 15463 11607 2666 583 -2016 C
-ATOM 3947 C VAL M 145 -38.320 -32.899-109.497 1.00106.70 C
-ANISOU 3947 C VAL M 145 13263 15807 11470 2557 719 -2135 C
-ATOM 3948 O VAL M 145 -39.140 -32.002-109.729 1.00110.47 O
-ANISOU 3948 O VAL M 145 13435 16587 11952 2813 786 -2297 O
-ATOM 3949 CB VAL M 145 -37.012 -32.526-107.365 1.00104.49 C
-ANISOU 3949 CB VAL M 145 13559 15113 11029 2519 698 -2036 C
-ATOM 3950 CG1 VAL M 145 -37.180 -33.924-106.793 1.00104.36 C
-ANISOU 3950 CG1 VAL M 145 13752 15076 10825 2052 752 -1959 C
-ATOM 3951 CG2 VAL M 145 -35.752 -31.874-106.817 1.00 97.15 C
-ANISOU 3951 CG2 VAL M 145 12936 13815 10163 2705 546 -1954 C
-ATOM 3952 N PHE M 146 -38.569 -34.209-109.746 1.00108.84 N
-ANISOU 3952 N PHE M 146 13577 16105 11673 2178 737 -2068 N
-ATOM 3953 CA PHE M 146 -39.782 -34.734-110.370 1.00120.92 C
-ANISOU 3953 CA PHE M 146 14775 18032 13137 1974 844 -2161 C
-ATOM 3954 C PHE M 146 -40.724 -35.299-109.321 1.00135.13 C
-ANISOU 3954 C PHE M 146 16525 20175 14643 1551 1072 -2242 C
-ATOM 3955 O PHE M 146 -40.303 -36.136-108.509 1.00146.13 O
-ANISOU 3955 O PHE M 146 18310 21343 15871 1204 1077 -2126 O
-ATOM 3956 CB PHE M 146 -39.439 -35.828-111.378 1.00125.85 C
-ANISOU 3956 CB PHE M 146 15530 18446 13842 1782 706 -2033 C
-ATOM 3957 CG PHE M 146 -38.601 -35.359-112.534 1.00128.11 C
-ANISOU 3957 CG PHE M 146 15825 18466 14386 2137 516 -1975 C
-ATOM 3958 CD1 PHE M 146 -38.838 -34.133-113.131 1.00129.73 C
-ANISOU 3958 CD1 PHE M 146 15771 18802 14720 2525 491 -2074 C
-ATOM 3959 CD2 PHE M 146 -37.578 -36.154-113.028 1.00123.25 C
-ANISOU 3959 CD2 PHE M 146 15502 17471 13856 2081 353 -1837 C
-ATOM 3960 CE1 PHE M 146 -38.068 -33.707-114.197 1.00126.19 C
-ANISOU 3960 CE1 PHE M 146 15378 18108 14461 2779 328 -2016 C
-ATOM 3961 CE2 PHE M 146 -36.806 -35.734-114.091 1.00115.97 C
-ANISOU 3961 CE2 PHE M 146 14566 16358 13141 2364 213 -1805 C
-ATOM 3962 CZ PHE M 146 -37.051 -34.509-114.677 1.00119.53 C
-ANISOU 3962 CZ PHE M 146 14778 16940 13699 2677 210 -1884 C
-ATOM 3963 N PRO M 147 -41.984 -34.880-109.298 1.00138.20 N
-ANISOU 3963 N PRO M 147 16455 21119 14936 1560 1255 -2453 N
-ATOM 3964 CA PRO M 147 -42.969 -35.518-108.418 1.00145.32 C
-ANISOU 3964 CA PRO M 147 17247 22445 15524 1067 1508 -2555 C
-ATOM 3965 C PRO M 147 -43.451 -36.850-108.984 1.00143.34 C
-ANISOU 3965 C PRO M 147 17009 22293 15161 537 1514 -2487 C
-ATOM 3966 O PRO M 147 -43.205 -37.199-110.140 1.00138.81 O
-ANISOU 3966 O PRO M 147 16439 21537 14766 611 1337 -2400 O
-ATOM 3967 CB PRO M 147 -44.113 -34.496-108.361 1.00151.60 C
-ANISOU 3967 CB PRO M 147 17460 23854 16286 1357 1675 -2851 C
-ATOM 3968 CG PRO M 147 -43.506 -33.203-108.835 1.00146.75 C
-ANISOU 3968 CG PRO M 147 16844 22982 15931 2032 1488 -2867 C
-ATOM 3969 CD PRO M 147 -42.471 -33.600-109.835 1.00137.24 C
-ANISOU 3969 CD PRO M 147 15936 21253 14954 2081 1236 -2635 C
-ATOM 3970 N HIS M 148 -44.161 -37.597-108.133 1.00144.43 N
-ANISOU 3970 N HIS M 148 17187 22727 14964 -41 1728 -2534 N
-ATOM 3971 CA HIS M 148 -44.661 -38.916-108.516 1.00140.99 C
-ANISOU 3971 CA HIS M 148 16850 22377 14343 -653 1743 -2466 C
-ATOM 3972 C HIS M 148 -45.967 -38.811-109.297 1.00143.91 C
-ANISOU 3972 C HIS M 148 16556 23420 14706 -729 1862 -2679 C
-ATOM 3973 O HIS M 148 -46.068 -39.315-110.425 1.00129.28 O
-ANISOU 3973 O HIS M 148 14644 21511 12966 -783 1715 -2620 O
-ATOM 3974 CB HIS M 148 -44.842 -39.790-107.270 1.00135.35 C
-ANISOU 3974 CB HIS M 148 16540 21668 13218 -1321 1908 -2413 C
-ATOM 3975 N ASN M 149 -46.982 -38.180-108.687 1.00161.03 N
-ANISOU 3975 N ASN M 149 18212 26250 16723 -730 2124 -2946 N
-ATOM 3976 CA ASN M 149 -48.252 -37.919-109.363 1.00178.23 C
-ANISOU 3976 CA ASN M 149 19661 29154 18902 -700 2223 -3209 C
-ATOM 3977 C ASN M 149 -48.032 -37.306-110.751 1.00182.46 C
-ANISOU 3977 C ASN M 149 19986 29530 19810 -90 1952 -3204 C
-ATOM 3978 O ASN M 149 -48.678 -37.711-111.725 1.00185.60 O
-ANISOU 3978 O ASN M 149 20079 30200 20240 -229 1888 -3257 O
-ATOM 3979 CB ASN M 149 -49.121 -37.034-108.461 1.00193.63 C
-ANISOU 3979 CB ASN M 149 21100 31775 20697 -544 2501 -3532 C
-ATOM 3980 CG ASN M 149 -50.244 -36.342-109.196 1.00216.68 C
-ANISOU 3980 CG ASN M 149 23217 35400 23711 -182 2522 -3855 C
-ATOM 3981 OD1 ASN M 149 -50.799 -36.819-110.183 1.00213.08 O
-ANISOU 3981 OD1 ASN M 149 22475 35185 23302 -347 2436 -3884 O
-ATOM 3982 ND2 ASN M 149 -50.559 -35.160-108.699 1.00244.10 N
-ANISOU 3982 ND2 ASN M 149 26348 39191 27207 367 2610 -4114 N
-ATOM 3983 N HIS M 150 -47.088 -36.374-110.880 1.00180.22 N
-ANISOU 3983 N HIS M 150 19910 28779 19786 537 1778 -3127 N
-ATOM 3984 CA HIS M 150 -46.803 -35.735-112.163 1.00178.03 C
-ANISOU 3984 CA HIS M 150 19519 28303 19822 1086 1520 -3110 C
-ATOM 3985 C HIS M 150 -45.299 -35.722-112.390 1.00169.98 C
-ANISOU 3985 C HIS M 150 19088 26498 18999 1291 1308 -2836 C
-ATOM 3986 O HIS M 150 -44.554 -35.142-111.592 1.00172.94 O
-ANISOU 3986 O HIS M 150 19731 26586 19392 1507 1314 -2787 O
-ATOM 3987 CB HIS M 150 -47.374 -34.313-112.209 1.00179.40 C
-ANISOU 3987 CB HIS M 150 19237 28841 20087 1728 1515 -3381 C
-ATOM 3988 CG HIS M 150 -47.233 -33.645-113.541 1.00176.51 C
-ANISOU 3988 CG HIS M 150 18777 28305 19984 2252 1239 -3383 C
-ATOM 3989 ND1 HIS M 150 -46.802 -32.343-113.679 1.00175.42 N
-ANISOU 3989 ND1 HIS M 150 18720 27933 19997 2904 1085 -3432 N
-ATOM 3990 CD2 HIS M 150 -47.454 -34.103-114.796 1.00182.05 C
-ANISOU 3990 CD2 HIS M 150 19368 29009 20792 2189 1078 -3335 C
-ATOM 3991 CE1 HIS M 150 -46.772 -32.025-114.961 1.00179.78 C
-ANISOU 3991 CE1 HIS M 150 19228 28351 20727 3208 844 -3413 C
-ATOM 3992 NE2 HIS M 150 -47.162 -33.075-115.660 1.00183.11 N
-ANISOU 3992 NE2 HIS M 150 19519 28921 21135 2797 838 -3356 N
-ATOM 3993 N THR M 151 -44.853 -36.355-113.478 1.00164.25 N
-ANISOU 3993 N THR M 151 18544 25456 18408 1220 1122 -2676 N
-ATOM 3994 CA THR M 151 -43.431 -36.528-113.754 1.00158.37 C
-ANISOU 3994 CA THR M 151 18312 24035 17825 1355 934 -2442 C
-ATOM 3995 C THR M 151 -42.891 -35.484-114.727 1.00146.31 C
-ANISOU 3995 C THR M 151 16733 22292 16564 1928 744 -2440 C
-ATOM 3996 O THR M 151 -41.912 -35.748-115.437 1.00126.70 O
-ANISOU 3996 O THR M 151 14545 19369 14225 2000 580 -2281 O
-ATOM 3997 CB THR M 151 -43.153 -37.933-114.291 1.00159.05 C
-ANISOU 3997 CB THR M 151 18709 23864 17858 921 845 -2275 C
-ATOM 3998 OG1 THR M 151 -43.522 -38.004-115.673 1.00158.86 O
-ANISOU 3998 OG1 THR M 151 18462 23933 17964 1019 723 -2300 O
-ATOM 3999 CG2 THR M 151 -43.957 -38.962-113.513 1.00161.84 C
-ANISOU 3999 CG2 THR M 151 19099 24501 17892 278 1023 -2298 C
-ATOM 4000 N ALA M 152 -43.507 -34.299-114.776 1.00147.82 N
-ANISOU 4000 N ALA M 152 16581 22787 16798 2336 756 -2628 N
-ATOM 4001 CA ALA M 152 -43.081 -33.252-115.697 1.00141.31 C
-ANISOU 4001 CA ALA M 152 15775 21745 16172 2849 558 -2632 C
-ATOM 4002 C ALA M 152 -43.026 -31.881-115.027 1.00147.04 C
-ANISOU 4002 C ALA M 152 16490 22485 16895 3296 561 -2752 C
-ATOM 4003 O ALA M 152 -43.027 -30.860-115.721 1.00145.92 O
-ANISOU 4003 O ALA M 152 16322 22270 16850 3737 397 -2817 O
-ATOM 4004 CB ALA M 152 -43.997 -33.207-116.923 1.00133.41 C
-ANISOU 4004 CB ALA M 152 14422 21044 15223 2959 453 -2745 C
-ATOM 4005 N ASP M 153 -42.977 -31.832-113.695 1.00147.55 N
-ANISOU 4005 N ASP M 153 16629 22610 16823 3185 728 -2784 N
-ATOM 4006 CA ASP M 153 -42.917 -30.562-112.969 1.00148.50 C
-ANISOU 4006 CA ASP M 153 16787 22724 16911 3596 735 -2904 C
-ATOM 4007 C ASP M 153 -41.455 -30.182-112.768 1.00145.89 C
-ANISOU 4007 C ASP M 153 16950 21804 16677 3688 615 -2704 C
-ATOM 4008 O ASP M 153 -40.816 -30.571-111.792 1.00145.38 O
-ANISOU 4008 O ASP M 153 17142 21552 16542 3456 697 -2599 O
-ATOM 4009 CB ASP M 153 -43.654 -30.660-111.639 1.00149.91 C
-ANISOU 4009 CB ASP M 153 16782 23310 16868 3427 989 -3065 C
-ATOM 4010 N ILE M 154 -40.919 -29.397-113.706 1.00142.07 N
-ANISOU 4010 N ILE M 154 16609 21037 16334 4014 407 -2657 N
-ATOM 4011 CA ILE M 154 -39.532 -28.942-113.614 1.00131.78 C
-ANISOU 4011 CA ILE M 154 15727 19234 15108 4079 291 -2491 C
-ATOM 4012 C ILE M 154 -39.403 -27.565-112.983 1.00131.00 C
-ANISOU 4012 C ILE M 154 15797 19034 14942 4442 242 -2582 C
-ATOM 4013 O ILE M 154 -38.274 -27.093-112.775 1.00131.99 O
-ANISOU 4013 O ILE M 154 16275 18778 15099 4464 151 -2459 O
-ATOM 4014 CB ILE M 154 -38.854 -28.932-114.999 1.00118.77 C
-ANISOU 4014 CB ILE M 154 14205 17309 13611 4123 109 -2371 C
-ATOM 4015 CG1 ILE M 154 -39.209 -27.650-115.759 1.00117.14 C
-ANISOU 4015 CG1 ILE M 154 14015 17082 13412 4546 -57 -2476 C
-ATOM 4016 CG2 ILE M 154 -39.251 -30.167-115.788 1.00116.76 C
-ANISOU 4016 CG2 ILE M 154 13758 17202 13405 3844 136 -2330 C
-ATOM 4017 N GLN M 155 -40.515 -26.903-112.670 1.00125.78 N
-ANISOU 4017 N GLN M 155 14900 18718 14175 4733 288 -2811 N
-ATOM 4018 CA GLN M 155 -40.484 -25.593-112.039 1.00123.18 C
-ANISOU 4018 CA GLN M 155 14768 18285 13747 5120 227 -2926 C
-ATOM 4019 C GLN M 155 -41.013 -25.631-110.612 1.00122.54 C
-ANISOU 4019 C GLN M 155 14573 18490 13495 5075 448 -3067 C
-ATOM 4020 O GLN M 155 -41.168 -24.580-109.986 1.00116.78 O
-ANISOU 4020 O GLN M 155 13974 17742 12653 5422 422 -3208 O
-ATOM 4021 CB GLN M 155 -41.275 -24.588-112.881 1.00128.89 C
-ANISOU 4021 CB GLN M 155 15391 19121 14460 5620 42 -3113 C
-ATOM 4022 CG GLN M 155 -40.728 -23.165-112.841 1.00137.61 C
-ANISOU 4022 CG GLN M 155 16967 19801 15518 5895 -186 -3061 C
-ATOM 4023 CD GLN M 155 -41.179 -22.323-114.024 1.00143.56 C
-ANISOU 4023 CD GLN M 155 17806 20455 16284 6160 -473 -3080 C
-ATOM 4024 OE1 GLN M 155 -42.067 -22.717-114.782 1.00145.06 O
-ANISOU 4024 OE1 GLN M 155 17649 20948 16520 6201 -506 -3168 O
-ATOM 4025 NE2 GLN M 155 -40.557 -21.160-114.193 1.00144.66 N
-ANISOU 4025 NE2 GLN M 155 18446 20167 16353 6332 -695 -3006 N
-ATOM 4026 N SER M 156 -41.282 -26.821-110.076 1.00126.76 N
-ANISOU 4026 N SER M 156 14916 19269 13978 4638 660 -3034 N
-ATOM 4027 CA SER M 156 -41.836 -26.922-108.730 1.00126.21 C
-ANISOU 4027 CA SER M 156 14744 19507 13703 4524 899 -3174 C
-ATOM 4028 C SER M 156 -40.736 -26.906-107.674 1.00129.34 C
-ANISOU 4028 C SER M 156 15594 19504 14044 4349 914 -3008 C
-ATOM 4029 O SER M 156 -40.747 -26.068-106.766 1.00139.72 O
-ANISOU 4029 O SER M 156 17058 20802 15229 4567 954 -3116 O
-ATOM 4030 CB SER M 156 -42.696 -28.185-108.608 1.00117.41 C
-ANISOU 4030 CB SER M 156 13264 18850 12496 4071 1120 -3223 C
-ATOM 4031 N GLU M 157 -39.772 -27.819-107.785 1.00113.06 N
-ANISOU 4031 N GLU M 157 13766 17120 12072 3983 861 -2761 N
-ATOM 4032 CA GLU M 157 -38.684 -27.942-106.820 1.00106.98 C
-ANISOU 4032 CA GLU M 157 13408 15983 11255 3802 838 -2603 C
-ATOM 4033 C GLU M 157 -37.361 -27.826-107.567 1.00101.76 C
-ANISOU 4033 C GLU M 157 13014 14857 10793 3844 600 -2404 C
-ATOM 4034 O GLU M 157 -36.950 -28.765-108.257 1.00 98.40 O
-ANISOU 4034 O GLU M 157 12572 14331 10484 3625 540 -2273 O
-ATOM 4035 CB GLU M 157 -38.780 -29.265-106.061 1.00102.22 C
-ANISOU 4035 CB GLU M 157 12852 15470 10517 3305 993 -2528 C
-ATOM 4036 CG GLU M 157 -37.801 -29.396-104.909 1.00 93.88 C
-ANISOU 4036 CG GLU M 157 12228 14075 9368 3139 959 -2397 C
-ATOM 4037 N VAL M 158 -36.699 -26.678-107.430 1.00 93.49 N
-ANISOU 4037 N VAL M 158 12218 13545 9760 4108 467 -2396 N
-ATOM 4038 CA VAL M 158 -35.449 -26.388-108.127 1.00 85.33 C
-ANISOU 4038 CA VAL M 158 11413 12131 8877 4127 258 -2241 C
-ATOM 4039 C VAL M 158 -34.427 -25.920-107.101 1.00 78.22 C
-ANISOU 4039 C VAL M 158 10870 10941 7907 4083 189 -2166 C
-ATOM 4040 O VAL M 158 -34.671 -24.946-106.378 1.00 94.53 O
-ANISOU 4040 O VAL M 158 13089 12993 9836 4281 204 -2264 O
-ATOM 4041 CB VAL M 158 -35.633 -25.327-109.226 1.00 77.61 C
-ANISOU 4041 CB VAL M 158 10427 11102 7959 4452 121 -2302 C
-ATOM 4042 CG1 VAL M 158 -34.290 -24.943-109.829 1.00 77.51 C
-ANISOU 4042 CG1 VAL M 158 10682 10724 8046 4395 -64 -2152 C
-ATOM 4043 CG2 VAL M 158 -36.570 -25.838-110.303 1.00 78.48 C
-ANISOU 4043 CG2 VAL M 158 10186 11485 8145 4489 152 -2368 C
-ATOM 4044 N HIS M 159 -33.282 -26.602-107.047 1.00 70.69 N
-ANISOU 4044 N HIS M 159 10054 9766 7040 3848 95 -2010 N
-ATOM 4045 CA HIS M 159 -32.203 -26.263-106.124 1.00 91.43 C
-ANISOU 4045 CA HIS M 159 12992 12132 9614 3779 -6 -1935 C
-ATOM 4046 C HIS M 159 -30.914 -26.089-106.912 1.00 95.96 C
-ANISOU 4046 C HIS M 159 13640 12484 10335 3736 -194 -1831 C
-ATOM 4047 O HIS M 159 -30.458 -27.030-107.567 1.00111.98 O
-ANISOU 4047 O HIS M 159 15539 14514 12495 3607 -235 -1765 O
-ATOM 4048 CB HIS M 159 -32.013 -27.347-105.054 1.00 98.46 C
-ANISOU 4048 CB HIS M 159 13983 13007 10421 3522 42 -1876 C
-ATOM 4049 CG HIS M 159 -33.246 -27.652-104.261 1.00107.64 C
-ANISOU 4049 CG HIS M 159 15069 14430 11398 3458 261 -1979 C
-ATOM 4050 ND1 HIS M 159 -33.758 -26.788-103.315 1.00110.25 N
-ANISOU 4050 ND1 HIS M 159 15506 14838 11548 3589 363 -2095 N
-ATOM 4051 CD2 HIS M 159 -34.055 -28.738-104.255 1.00102.20 C
-ANISOU 4051 CD2 HIS M 159 14216 13966 10650 3243 407 -1997 C
-ATOM 4052 CE1 HIS M 159 -34.837 -27.323-102.772 1.00113.49 C
-ANISOU 4052 CE1 HIS M 159 15772 15553 11798 3460 583 -2194 C
-ATOM 4053 NE2 HIS M 159 -35.039 -28.506-103.325 1.00111.06 N
-ANISOU 4053 NE2 HIS M 159 15305 15339 11553 3220 613 -2130 N
-ATOM 4054 N CYS M 160 -30.324 -24.899-106.843 1.00 84.95 N
-ANISOU 4054 N CYS M 160 12468 10915 8895 3828 -305 -1830 N
-ATOM 4055 CA CYS M 160 -28.987 -24.703-107.387 1.00 89.55 C
-ANISOU 4055 CA CYS M 160 13124 11331 9569 3705 -465 -1746 C
-ATOM 4056 C CYS M 160 -27.979 -25.527-106.592 1.00 85.05 C
-ANISOU 4056 C CYS M 160 12596 10689 9029 3517 -543 -1678 C
-ATOM 4057 O CYS M 160 -28.105 -25.688-105.376 1.00 95.17 O
-ANISOU 4057 O CYS M 160 14030 11932 10197 3487 -522 -1679 O
-ATOM 4058 CB CYS M 160 -28.612 -23.225-107.340 1.00110.25 C
-ANISOU 4058 CB CYS M 160 16041 13772 12076 3775 -571 -1759 C
-ATOM 4059 SG CYS M 160 -28.664 -22.614-105.654 1.00165.66 S
-ANISOU 4059 SG CYS M 160 23378 20672 18894 3817 -573 -1791 S
-ATOM 4060 N ILE M 161 -26.977 -26.058-107.284 1.00 85.43 N
-ANISOU 4060 N ILE M 161 12515 10730 9213 3408 -644 -1635 N
-ATOM 4061 CA ILE M 161 -25.947 -26.891-106.663 1.00 76.68 C
-ANISOU 4061 CA ILE M 161 11420 9571 8146 3295 -770 -1601 C
-ATOM 4062 C ILE M 161 -24.725 -25.998-106.480 1.00 74.72 C
-ANISOU 4062 C ILE M 161 11278 9240 7873 3207 -920 -1595 C
-ATOM 4063 O ILE M 161 -23.826 -25.955-107.323 1.00 84.56 O
-ANISOU 4063 O ILE M 161 12367 10552 9211 3127 -992 -1609 O
-ATOM 4064 CB ILE M 161 -25.632 -28.130-107.499 1.00 74.49 C
-ANISOU 4064 CB ILE M 161 10911 9374 8018 3275 -800 -1599 C
-ATOM 4065 CG1 ILE M 161 -26.920 -28.860-107.885 1.00 80.01 C
-ANISOU 4065 CG1 ILE M 161 11513 10167 8720 3310 -646 -1602 C
-ATOM 4066 CG2 ILE M 161 -24.698 -29.057-106.738 1.00 72.72 C
-ANISOU 4066 CG2 ILE M 161 10747 9076 7806 3237 -969 -1589 C
-ATOM 4067 CD1 ILE M 161 -26.712 -29.985-108.881 1.00 68.58 C
-ANISOU 4067 CD1 ILE M 161 9880 8775 7402 3297 -675 -1604 C
-ATOM 4068 N PHE M 162 -24.684 -25.279-105.359 1.00 68.29 N
-ANISOU 4068 N PHE M 162 10733 8303 6912 3193 -960 -1587 N
-ATOM 4069 CA PHE M 162 -23.596 -24.347-105.107 1.00 70.13 C
-ANISOU 4069 CA PHE M 162 11108 8453 7083 3065 -1108 -1581 C
-ATOM 4070 C PHE M 162 -23.357 -24.199-103.611 1.00 76.05 C
-ANISOU 4070 C PHE M 162 12127 9070 7697 3034 -1198 -1564 C
-ATOM 4071 O PHE M 162 -24.306 -24.097-102.828 1.00 70.47 O
-ANISOU 4071 O PHE M 162 11608 8300 6868 3130 -1093 -1570 O
-ATOM 4072 CB PHE M 162 -23.885 -22.976-105.723 1.00 69.27 C
-ANISOU 4072 CB PHE M 162 11168 8275 6878 3064 -1074 -1589 C
-ATOM 4073 CG PHE M 162 -22.809 -21.967-105.469 1.00 70.64 C
-ANISOU 4073 CG PHE M 162 11550 8350 6941 2858 -1226 -1576 C
-ATOM 4074 CD1 PHE M 162 -21.699 -21.904-106.293 1.00 75.13 C
-ANISOU 4074 CD1 PHE M 162 11939 9036 7570 2635 -1304 -1584 C
-ATOM 4075 CD2 PHE M 162 -22.900 -21.086-104.405 1.00 72.01 C
-ANISOU 4075 CD2 PHE M 162 12098 8337 6924 2860 -1284 -1569 C
-ATOM 4076 CE1 PHE M 162 -20.699 -20.981-106.060 1.00 79.98 C
-ANISOU 4076 CE1 PHE M 162 12731 9604 8056 2372 -1437 -1579 C
-ATOM 4077 CE2 PHE M 162 -21.905 -20.160-104.167 1.00 73.55 C
-ANISOU 4077 CE2 PHE M 162 12517 8435 6994 2622 -1437 -1553 C
-ATOM 4078 CZ PHE M 162 -20.802 -20.107-104.995 1.00 73.92 C
-ANISOU 4078 CZ PHE M 162 12368 8620 7098 2356 -1514 -1555 C
-ATOM 4079 N SER M 163 -22.075 -24.172-103.230 1.00 79.04 N
-ANISOU 4079 N SER M 163 12508 9438 8084 2892 -1392 -1561 N
-ATOM 4080 CA SER M 163 -21.620 -23.916-101.868 1.00 74.69 C
-ANISOU 4080 CA SER M 163 12232 8752 7396 2829 -1530 -1544 C
-ATOM 4081 C SER M 163 -20.299 -23.157-101.909 1.00 76.36 C
-ANISOU 4081 C SER M 163 12443 8987 7582 2622 -1718 -1558 C
-ATOM 4082 O SER M 163 -19.321 -23.649-102.484 1.00 84.41 O
-ANISOU 4082 O SER M 163 13149 10188 8734 2546 -1826 -1602 O
-ATOM 4083 CB SER M 163 -21.450 -25.218-101.084 1.00 82.85 C
-ANISOU 4083 CB SER M 163 13249 9769 8460 2880 -1627 -1534 C
-ATOM 4084 OG SER M 163 -22.702 -25.805-100.790 1.00 94.09 O
-ANISOU 4084 OG SER M 163 14763 11160 9829 2978 -1447 -1516 O
-ATOM 4085 N PRO M 164 -20.226 -21.967-101.319 1.00 74.85 N
-ANISOU 4085 N PRO M 164 12593 8641 7206 2518 -1764 -1540 N
-ATOM 4086 CA PRO M 164 -18.972 -21.207-101.339 1.00 76.52 C
-ANISOU 4086 CA PRO M 164 12828 8891 7357 2243 -1945 -1553 C
-ATOM 4087 C PRO M 164 -17.895 -21.906-100.522 1.00 88.47 C
-ANISOU 4087 C PRO M 164 14209 10491 8914 2181 -2172 -1581 C
-ATOM 4088 O PRO M 164 -18.149 -22.841 -99.761 1.00108.67 O
-ANISOU 4088 O PRO M 164 16796 12991 11502 2350 -2215 -1572 O
-ATOM 4089 CB PRO M 164 -19.354 -19.858-100.722 1.00 85.62 C
-ANISOU 4089 CB PRO M 164 14485 9787 8261 2182 -1949 -1521 C
-ATOM 4090 CG PRO M 164 -20.858 -19.820-100.749 1.00 83.14 C
-ANISOU 4090 CG PRO M 164 14320 9361 7910 2473 -1739 -1522 C
-ATOM 4091 CD PRO M 164 -21.302 -21.238-100.629 1.00 75.20 C
-ANISOU 4091 CD PRO M 164 13024 8484 7065 2641 -1651 -1527 C
-ATOM 4092 N GLN M 165 -16.661 -21.428-100.689 1.00 83.50 N
-ANISOU 4092 N GLN M 165 13449 10014 8265 1917 -2337 -1626 N
-ATOM 4093 CA GLN M 165 -15.490 -22.002-100.027 1.00 83.07 C
-ANISOU 4093 CA GLN M 165 13199 10108 8255 1866 -2599 -1691 C
-ATOM 4094 C GLN M 165 -14.766 -20.893 -99.257 1.00 83.73 C
-ANISOU 4094 C GLN M 165 13559 10120 8136 1568 -2772 -1680 C
-ATOM 4095 O GLN M 165 -13.679 -20.461 -99.643 1.00 87.86 O
-ANISOU 4095 O GLN M 165 13854 10886 8641 1274 -2886 -1750 O
-ATOM 4096 CB GLN M 165 -14.570 -22.685-101.043 1.00 90.85 C
-ANISOU 4096 CB GLN M 165 13617 11471 9430 1841 -2648 -1811 C
-ATOM 4097 CG GLN M 165 -15.224 -23.833-101.810 1.00 79.70 C
-ANISOU 4097 CG GLN M 165 11966 10111 8206 2131 -2505 -1826 C
-ATOM 4098 CD GLN M 165 -15.519 -25.035-100.927 1.00 81.37 C
-ANISOU 4098 CD GLN M 165 12274 10179 8465 2423 -2626 -1814 C
-ATOM 4099 OE1 GLN M 165 -14.606 -25.739-100.495 1.00 85.43 O
-ANISOU 4099 OE1 GLN M 165 12618 10807 9033 2514 -2884 -1903 O
-ATOM 4100 NE2 GLN M 165 -16.798 -25.272-100.649 1.00 77.63 N
-ANISOU 4100 NE2 GLN M 165 12088 9463 7945 2561 -2455 -1716 N
-ATOM 4101 N ILE M 166 -15.377 -20.446 -98.155 1.00 86.66 N
-ANISOU 4101 N ILE M 166 14422 10174 8331 1622 -2784 -1604 N
-ATOM 4102 CA ILE M 166 -14.805 -19.365 -97.352 1.00 86.22 C
-ANISOU 4102 CA ILE M 166 14722 9989 8051 1348 -2951 -1584 C
-ATOM 4103 C ILE M 166 -13.418 -19.736 -96.847 1.00 88.65 C
-ANISOU 4103 C ILE M 166 14762 10526 8394 1192 -3258 -1662 C
-ATOM 4104 O ILE M 166 -12.544 -18.870 -96.714 1.00 99.19 O
-ANISOU 4104 O ILE M 166 16154 11942 9592 837 -3407 -1686 O
-ATOM 4105 CB ILE M 166 -15.751 -19.001 -96.187 1.00100.69 C
-ANISOU 4105 CB ILE M 166 17117 11453 9689 1499 -2905 -1513 C
-ATOM 4106 CG1 ILE M 166 -17.083 -18.473 -96.716 1.00113.24 C
-ANISOU 4106 CG1 ILE M 166 18933 12872 11220 1670 -2624 -1481 C
-ATOM 4107 CG2 ILE M 166 -15.122 -17.957 -95.275 1.00103.84 C
-ANISOU 4107 CG2 ILE M 166 17925 11689 9841 1227 -3107 -1494 C
-ATOM 4108 CD1 ILE M 166 -18.141 -19.525 -96.879 1.00121.81 C
-ANISOU 4108 CD1 ILE M 166 19842 13990 12449 1998 -2420 -1481 C
-ATOM 4109 N GLU M 167 -13.189 -21.021 -96.570 1.00 89.88 N
-ANISOU 4109 N GLU M 167 14640 10795 8716 1450 -3378 -1714 N
-ATOM 4110 CA GLU M 167 -11.881 -21.472 -96.105 1.00100.06 C
-ANISOU 4110 CA GLU M 167 15638 12327 10051 1393 -3713 -1823 C
-ATOM 4111 C GLU M 167 -10.799 -21.175 -97.138 1.00105.95 C
-ANISOU 4111 C GLU M 167 15856 13523 10876 1122 -3746 -1954 C
-ATOM 4112 O GLU M 167 -9.795 -20.519 -96.838 1.00104.93 O
-ANISOU 4112 O GLU M 167 15656 13576 10636 794 -3940 -2016 O
-ATOM 4113 CB GLU M 167 -11.935 -22.969 -95.792 1.00111.40 C
-ANISOU 4113 CB GLU M 167 16919 13766 11642 1783 -3844 -1866 C
-ATOM 4114 CG GLU M 167 -12.998 -23.364 -94.775 1.00111.75 C
-ANISOU 4114 CG GLU M 167 17485 13402 11572 1985 -3793 -1743 C
-ATOM 4115 CD GLU M 167 -12.532 -23.199 -93.341 1.00117.05 C
-ANISOU 4115 CD GLU M 167 18525 13889 12061 1924 -4087 -1722 C
-ATOM 4116 OE1 GLU M 167 -11.411 -22.691 -93.130 1.00126.15 O
-ANISOU 4116 OE1 GLU M 167 19530 15225 13177 1718 -4337 -1797 O
-ATOM 4117 OE2 GLU M 167 -13.287 -23.580 -92.423 1.00116.81 O1-
-ANISOU 4117 OE2 GLU M 167 18933 13546 11903 2055 -4067 -1636 O1-
-ATOM 4118 N GLU M 168 -10.989 -21.656 -98.364 1.00110.57 N
-ANISOU 4118 N GLU M 168 16062 14317 11634 1224 -3551 -2006 N
-ATOM 4119 CA GLU M 168 -10.043 -21.442 -99.460 1.00111.63 C
-ANISOU 4119 CA GLU M 168 15670 14917 11828 959 -3524 -2148 C
-ATOM 4120 C GLU M 168 -10.729 -20.656-100.567 1.00106.72 C
-ANISOU 4120 C GLU M 168 15184 14221 11146 753 -3206 -2066 C
-ATOM 4121 O GLU M 168 -11.505 -21.232-101.352 1.00 98.70 O
-ANISOU 4121 O GLU M 168 14072 13162 10266 1001 -3000 -2042 O
-ATOM 4122 CB GLU M 168 -9.514 -22.774 -99.988 1.00114.65 C
-ANISOU 4122 CB GLU M 168 15462 15648 12450 1280 -3607 -2321 C
-ATOM 4123 CG GLU M 168 -8.695 -23.551 -98.971 1.00129.51 C
-ANISOU 4123 CG GLU M 168 17201 17629 14378 1511 -3989 -2437 C
-ATOM 4124 CD GLU M 168 -8.203 -24.881 -99.505 1.00150.11 C
-ANISOU 4124 CD GLU M 168 19285 20546 17204 1903 -4107 -2632 C
-ATOM 4125 OE1 GLU M 168 -8.703 -25.324-100.560 1.00152.51 O
-ANISOU 4125 OE1 GLU M 168 19415 20903 17629 2034 -3866 -2641 O
-ATOM 4126 OE2 GLU M 168 -7.309 -25.480 -98.871 1.00161.97 O
-ANISOU 4126 OE2 GLU M 168 20567 22229 18743 2103 -4464 -2787 O
-ATOM 4127 N PRO M 169 -10.471 -19.349-100.681 1.00113.00 N
-ANISOU 4127 N PRO M 169 16239 14980 11716 294 -3181 -2021 N
-ATOM 4128 CA PRO M 169 -11.243 -18.520-101.621 1.00106.34 C
-ANISOU 4128 CA PRO M 169 15688 13953 10764 133 -2926 -1924 C
-ATOM 4129 C PRO M 169 -10.916 -18.764-103.085 1.00106.81 C
-ANISOU 4129 C PRO M 169 15282 14380 10923 -2 -2756 -2018 C
-ATOM 4130 O PRO M 169 -11.628 -18.237-103.950 1.00104.62 O
-ANISOU 4130 O PRO M 169 15242 13937 10573 -74 -2557 -1939 O
-ATOM 4131 CB PRO M 169 -10.872 -17.091-101.208 1.00105.95 C
-ANISOU 4131 CB PRO M 169 16112 13744 10401 -350 -3023 -1863 C
-ATOM 4132 CG PRO M 169 -9.508 -17.222-100.622 1.00112.42 C
-ANISOU 4132 CG PRO M 169 16579 14930 11206 -606 -3277 -1989 C
-ATOM 4133 CD PRO M 169 -9.473 -18.562 -99.937 1.00118.33 C
-ANISOU 4133 CD PRO M 169 17010 15753 12198 -108 -3414 -2056 C
-ATOM 4134 N SER M 170 -9.873 -19.531-103.396 1.00112.25 N
-ANISOU 4134 N SER M 170 15330 15564 11758 -18 -2839 -2201 N
-ATOM 4135 CA SER M 170 -9.513 -19.792-104.782 1.00112.01 C
-ANISOU 4135 CA SER M 170 14831 15925 11802 -150 -2661 -2320 C
-ATOM 4136 C SER M 170 -10.120 -21.079-105.326 1.00107.39 C
-ANISOU 4136 C SER M 170 13964 15357 11484 368 -2551 -2356 C
-ATOM 4137 O SER M 170 -10.138 -21.267-106.548 1.00103.58 O
-ANISOU 4137 O SER M 170 13215 15088 11053 311 -2360 -2418 O
-ATOM 4138 CB SER M 170 -7.987 -19.840-104.935 1.00111.14 C
-ANISOU 4138 CB SER M 170 14125 16433 11670 -485 -2787 -2548 C
-ATOM 4139 OG SER M 170 -7.409 -20.766-104.033 1.00118.67 O
-ANISOU 4139 OG SER M 170 14750 17556 12784 -136 -3052 -2676 O
-ATOM 4140 N GLN M 171 -10.625 -21.955-104.462 1.00101.27 N
-ANISOU 4140 N GLN M 171 13286 14346 10845 834 -2668 -2316 N
-ATOM 4141 CA GLN M 171 -11.177 -23.233-104.888 1.00 95.69 C
-ANISOU 4141 CA GLN M 171 12372 13628 10360 1295 -2600 -2347 C
-ATOM 4142 C GLN M 171 -12.685 -23.117-105.082 1.00 89.48 C
-ANISOU 4142 C GLN M 171 12022 12412 9564 1460 -2389 -2160 C
-ATOM 4143 O GLN M 171 -13.389 -22.580-104.221 1.00 89.97 O
-ANISOU 4143 O GLN M 171 12563 12112 9510 1478 -2402 -2021 O
-ATOM 4144 CB GLN M 171 -10.853 -24.320-103.861 1.00 91.89 C
-ANISOU 4144 CB GLN M 171 11793 13129 9993 1676 -2872 -2418 C
-ATOM 4145 CG GLN M 171 -9.365 -24.519-103.620 1.00 91.76 C
-ANISOU 4145 CG GLN M 171 11296 13572 9998 1603 -3131 -2642 C
-ATOM 4146 N CYS M 172 -13.174 -23.618-106.215 1.00 88.53 N
-ANISOU 4146 N CYS M 172 11718 12363 9557 1586 -2198 -2176 N
-ATOM 4147 CA CYS M 172 -14.607 -23.652-106.504 1.00104.53 C
-ANISOU 4147 CA CYS M 172 14059 14060 11597 1774 -2009 -2033 C
-ATOM 4148 C CYS M 172 -14.952 -24.989-107.149 1.00106.60 C
-ANISOU 4148 C CYS M 172 14035 14409 12057 2101 -1945 -2090 C
-ATOM 4149 O CYS M 172 -14.812 -25.150-108.373 1.00111.14 O
-ANISOU 4149 O CYS M 172 14339 15196 12691 2045 -1813 -2159 O
-ATOM 4150 CB CYS M 172 -15.037 -22.498-107.405 1.00125.05 C
-ANISOU 4150 CB CYS M 172 16879 16581 14055 1497 -1830 -1960 C
-ATOM 4151 SG CYS M 172 -16.779 -22.604-107.908 1.00147.98 S
-ANISOU 4151 SG CYS M 172 20064 19169 16994 1784 -1625 -1835 S
-ATOM 4152 N PRO M 173 -15.400 -25.971-106.364 1.00 92.89 N
-ANISOU 4152 N PRO M 173 12398 12500 10397 2417 -2041 -2062 N
-ATOM 4153 CA PRO M 173 -15.843 -27.242-106.953 1.00 75.21 C
-ANISOU 4153 CA PRO M 173 9992 10277 8306 2704 -1992 -2097 C
-ATOM 4154 C PRO M 173 -17.219 -27.178-107.593 1.00 72.65 C
-ANISOU 4154 C PRO M 173 9848 9770 7984 2749 -1752 -1981 C
-ATOM 4155 O PRO M 173 -17.613 -28.144-108.258 1.00 99.06 O
-ANISOU 4155 O PRO M 173 13058 13143 11436 2927 -1691 -2007 O
-ATOM 4156 CB PRO M 173 -15.848 -28.204-105.752 1.00 82.76 C
-ANISOU 4156 CB PRO M 173 11111 11058 9275 2955 -2209 -2091 C
-ATOM 4157 CG PRO M 173 -15.092 -27.488-104.657 1.00 93.19 C
-ANISOU 4157 CG PRO M 173 12551 12370 10487 2808 -2399 -2096 C
-ATOM 4158 CD PRO M 173 -15.339 -26.037-104.897 1.00 89.31 C
-ANISOU 4158 CD PRO M 173 12215 11848 9872 2492 -2233 -2015 C
-ATOM 4159 N ASP M 174 -17.963 -26.088-107.406 1.00 74.33 N
-ANISOU 4159 N ASP M 174 10369 9801 8072 2616 -1636 -1869 N
-ATOM 4160 CA ASP M 174 -19.281 -25.924-108.004 1.00 81.62 C
-ANISOU 4160 CA ASP M 174 11437 10590 8987 2688 -1435 -1788 C
-ATOM 4161 C ASP M 174 -19.242 -25.164-109.323 1.00 84.00 C
-ANISOU 4161 C ASP M 174 11659 10994 9262 2516 -1312 -1800 C
-ATOM 4162 O ASP M 174 -20.245 -25.153-110.046 1.00 68.54 O
-ANISOU 4162 O ASP M 174 9755 8968 7318 2604 -1173 -1758 O
-ATOM 4163 CB ASP M 174 -20.218 -25.207-107.026 1.00103.07 C
-ANISOU 4163 CB ASP M 174 14548 13054 11562 2721 -1397 -1693 C
-ATOM 4164 CG ASP M 174 -20.272 -25.884-105.671 1.00116.69 C
-ANISOU 4164 CG ASP M 174 16414 14662 13261 2833 -1506 -1674 C
-ATOM 4165 OD1 ASP M 174 -21.150 -26.749-105.475 1.00118.97 O
-ANISOU 4165 OD1 ASP M 174 16740 14885 13576 2982 -1433 -1646 O
-ATOM 4166 OD2 ASP M 174 -19.437 -25.552-104.801 1.00121.72 O1-
-ANISOU 4166 OD2 ASP M 174 17147 15272 13829 2740 -1673 -1686 O1-
-ATOM 4167 N CYS M 175 -18.124 -24.511-109.634 1.00 96.52 N
-ANISOU 4167 N CYS M 175 13138 12750 10785 2247 -1368 -1861 N
-ATOM 4168 CA CYS M 175 -17.868 -23.979-110.968 1.00 91.47 C
-ANISOU 4168 CA CYS M 175 12400 12255 10099 2022 -1257 -1892 C
-ATOM 4169 C CYS M 175 -17.540 -25.160-111.868 1.00 87.16 C
-ANISOU 4169 C CYS M 175 11433 11964 9721 2144 -1206 -2001 C
-ATOM 4170 O CYS M 175 -16.409 -25.650-111.884 1.00 94.95 O
-ANISOU 4170 O CYS M 175 12078 13235 10765 2104 -1286 -2139 O
-ATOM 4171 CB CYS M 175 -16.723 -22.973-110.938 1.00115.89 C
-ANISOU 4171 CB CYS M 175 15509 15489 13033 1622 -1326 -1936 C
-ATOM 4172 SG CYS M 175 -16.871 -21.656-109.705 1.00136.24 S
-ANISOU 4172 SG CYS M 175 18618 17756 15391 1471 -1444 -1828 S
-ATOM 4173 N VAL M 176 -18.533 -25.636-112.608 1.00 73.77 N
-ANISOU 4173 N VAL M 176 9755 10179 8094 2317 -1084 -1958 N
-ATOM 4174 CA VAL M 176 -18.428 -26.892-113.338 1.00 73.43 C
-ANISOU 4174 CA VAL M 176 9395 10302 8203 2494 -1050 -2049 C
-ATOM 4175 C VAL M 176 -18.024 -26.674-114.788 1.00 88.33 C
-ANISOU 4175 C VAL M 176 11094 12407 10061 2301 -923 -2123 C
-ATOM 4176 O VAL M 176 -17.072 -27.284-115.274 1.00 82.82 O
-ANISOU 4176 O VAL M 176 10038 12008 9422 2292 -928 -2280 O
-ATOM 4177 CB VAL M 176 -19.759 -27.672-113.247 1.00 68.01 C
-ANISOU 4177 CB VAL M 176 8842 9404 7593 2763 -1001 -1963 C
-ATOM 4178 CG1 VAL M 176 -19.683 -28.938-114.083 1.00 68.60 C
-ANISOU 4178 CG1 VAL M 176 8663 9607 7794 2922 -977 -2049 C
-ATOM 4179 CG2 VAL M 176 -20.080 -28.004-111.803 1.00 79.95 C
-ANISOU 4179 CG2 VAL M 176 10537 10739 9102 2908 -1110 -1907 C
-ATOM 4180 N VAL M 177 -18.735 -25.800-115.494 1.00 83.00 N
-ANISOU 4180 N VAL M 177 13805 9295 8437 1525 649 -1681 N
-ATOM 4181 CA VAL M 177 -18.766 -25.802-116.950 1.00 67.01 C
-ANISOU 4181 CA VAL M 177 11438 7476 6546 1495 655 -1606 C
-ATOM 4182 C VAL M 177 -18.129 -24.531-117.495 1.00 69.73 C
-ANISOU 4182 C VAL M 177 11966 7733 6796 1215 672 -1589 C
-ATOM 4183 O VAL M 177 -18.476 -23.419-117.075 1.00 68.13 O
-ANISOU 4183 O VAL M 177 12237 7152 6499 1211 834 -1534 O
-ATOM 4184 CB VAL M 177 -20.204 -25.948-117.465 1.00 68.19 C
-ANISOU 4184 CB VAL M 177 11482 7613 6812 1810 867 -1415 C
-ATOM 4185 CG1 VAL M 177 -20.246 -25.595-118.915 1.00 92.81 C
-ANISOU 4185 CG1 VAL M 177 14333 10940 9991 1769 901 -1320 C
-ATOM 4186 CG2 VAL M 177 -20.692 -27.368-117.252 1.00 62.63 C
-ANISOU 4186 CG2 VAL M 177 10491 7064 6243 1965 804 -1428 C
-ATOM 4187 N SER M 178 -17.216 -24.703-118.451 1.00 69.68 N
-ANISOU 4187 N SER M 178 11596 8072 6808 991 515 -1626 N
-ATOM 4188 CA SER M 178 -16.644 -23.591-119.195 1.00 71.82 C
-ANISOU 4188 CA SER M 178 11946 8334 7007 690 535 -1542 C
-ATOM 4189 C SER M 178 -17.590 -23.135-120.299 1.00 73.55 C
-ANISOU 4189 C SER M 178 12094 8536 7317 894 742 -1302 C
-ATOM 4190 O SER M 178 -18.153 -23.952-121.030 1.00 69.96 O
-ANISOU 4190 O SER M 178 11233 8382 6967 1129 752 -1264 O
-ATOM 4191 CB SER M 178 -15.302 -23.997-119.804 1.00 70.06 C
-ANISOU 4191 CB SER M 178 11286 8608 6724 394 295 -1641 C
-ATOM 4192 OG SER M 178 -14.925 -23.108-120.838 1.00 71.15 O
-ANISOU 4192 OG SER M 178 11358 8856 6821 139 334 -1486 O
-ATOM 4193 N ALA M 179 -17.755 -21.817-120.424 1.00 84.50 N
-ANISOU 4193 N ALA M 179 13890 9567 8648 799 904 -1139 N
-ATOM 4194 CA ALA M 179 -18.586 -21.268-121.488 1.00 71.53 C
-ANISOU 4194 CA ALA M 179 12188 7933 7057 1016 1108 -853 C
-ATOM 4195 C ALA M 179 -17.940 -21.390-122.861 1.00 77.20 C
-ANISOU 4195 C ALA M 179 12408 9152 7772 821 1007 -759 C
-ATOM 4196 O ALA M 179 -18.626 -21.190-123.869 1.00 85.38 O
-ANISOU 4196 O ALA M 179 13248 10362 8831 1032 1146 -524 O
-ATOM 4197 CB ALA M 179 -18.910 -19.802-121.200 1.00 66.73 C
-ANISOU 4197 CB ALA M 179 12231 6732 6392 1014 1324 -683 C
-ATOM 4198 N LEU M 180 -16.650 -21.712-122.928 1.00 78.34 N
-ANISOU 4198 N LEU M 180 12312 9602 7853 452 774 -923 N
-ATOM 4199 CA LEU M 180 -15.937 -21.862-124.188 1.00 77.97 C
-ANISOU 4199 CA LEU M 180 11755 10117 7755 276 673 -849 C
-ATOM 4200 C LEU M 180 -16.063 -23.258-124.782 1.00 80.90 C
-ANISOU 4200 C LEU M 180 11537 11023 8176 535 559 -1014 C
-ATOM 4201 O LEU M 180 -15.438 -23.539-125.810 1.00 85.61 O
-ANISOU 4201 O LEU M 180 11669 12162 8699 444 462 -1014 O
-ATOM 4202 CB LEU M 180 -14.457 -21.518-124.004 1.00 73.92 C
-ANISOU 4202 CB LEU M 180 11217 9766 7105 -242 483 -930 C
-ATOM 4203 CG LEU M 180 -14.026 -20.200-124.644 1.00 91.95 C
-ANISOU 4203 CG LEU M 180 13682 11947 9307 -629 564 -645 C
-ATOM 4204 CD1 LEU M 180 -14.602 -19.007-123.896 1.00 98.01 C
-ANISOU 4204 CD1 LEU M 180 15223 11905 10113 -678 754 -530 C
-ATOM 4205 CD2 LEU M 180 -12.514 -20.117-124.751 1.00 96.60 C
-ANISOU 4205 CD2 LEU M 180 14007 12967 9731 -1169 344 -705 C
-ATOM 4206 N GLY M 181 -16.846 -24.136-124.162 1.00 74.33 N
-ANISOU 4206 N GLY M 181 10732 10053 7457 842 570 -1156 N
-ATOM 4207 CA GLY M 181 -16.971 -25.499-124.633 1.00 76.56 C
-ANISOU 4207 CA GLY M 181 10552 10729 7810 1048 454 -1348 C
-ATOM 4208 C GLY M 181 -16.714 -26.516-123.543 1.00 85.20 C
-ANISOU 4208 C GLY M 181 11711 11688 8972 1118 313 -1592 C
-ATOM 4209 O GLY M 181 -15.634 -26.535-122.944 1.00 92.39 O
-ANISOU 4209 O GLY M 181 12670 12635 9799 923 164 -1707 O
-ATOM 4210 N ALA M 182 -17.699 -27.369-123.276 1.00 86.39 N
-ANISOU 4210 N ALA M 182 11847 11719 9260 1380 358 -1644 N
-ATOM 4211 CA ALA M 182 -17.592 -28.341-122.201 1.00 59.45 C
-ANISOU 4211 CA ALA M 182 8536 8127 5926 1469 252 -1808 C
-ATOM 4212 C ALA M 182 -18.346 -29.604-122.582 1.00 66.50 C
-ANISOU 4212 C ALA M 182 9182 9109 6975 1679 228 -1912 C
-ATOM 4213 O ALA M 182 -19.379 -29.552-123.255 1.00 85.65 O
-ANISOU 4213 O ALA M 182 11486 11611 9444 1769 353 -1813 O
-ATOM 4214 CB ALA M 182 -18.137 -27.782-120.885 1.00 63.23 C
-ANISOU 4214 CB ALA M 182 9493 8144 6386 1495 376 -1700 C
-ATOM 4215 N LYS M 183 -17.810 -30.741-122.147 1.00 62.58 N
-ANISOU 4215 N LYS M 183 8618 8609 6552 1747 64 -2106 N
-ATOM 4216 CA LYS M 183 -18.444 -32.039-122.337 1.00 68.14 C
-ANISOU 4216 CA LYS M 183 9186 9274 7429 1899 22 -2231 C
-ATOM 4217 C LYS M 183 -18.565 -32.686-120.967 1.00 77.14 C
-ANISOU 4217 C LYS M 183 10603 10050 8659 1973 -5 -2205 C
-ATOM 4218 O LYS M 183 -17.551 -32.907-120.295 1.00 85.49 O
-ANISOU 4218 O LYS M 183 11735 11092 9657 1989 -134 -2273 O
-ATOM 4219 CB LYS M 183 -17.630 -32.917-123.291 1.00 72.19 C
-ANISOU 4219 CB LYS M 183 9363 10119 7949 1967 -150 -2500 C
-ATOM 4220 CG LYS M 183 -18.368 -34.139-123.802 1.00 83.13 C
-ANISOU 4220 CG LYS M 183 10622 11458 9505 2071 -185 -2674 C
-ATOM 4221 CD LYS M 183 -19.620 -33.734-124.559 1.00 91.59 C
-ANISOU 4221 CD LYS M 183 11565 12657 10577 2000 -40 -2561 C
-ATOM 4222 CE LYS M 183 -20.354 -34.946-125.098 1.00 98.43 C
-ANISOU 4222 CE LYS M 183 12295 13515 11590 2012 -97 -2766 C
-ATOM 4223 NZ LYS M 183 -21.656 -34.563-125.702 1.00 98.35 N1+
-ANISOU 4223 NZ LYS M 183 12123 13699 11545 1924 40 -2620 N1+
-ATOM 4224 N VAL M 184 -19.795 -32.970-120.547 1.00 73.69 N
-ANISOU 4224 N VAL M 184 10283 9384 8331 2018 117 -2074 N
-ATOM 4225 CA VAL M 184 -20.080 -33.464-119.203 1.00 67.15 C
-ANISOU 4225 CA VAL M 184 9721 8235 7559 2077 132 -1970 C
-ATOM 4226 C VAL M 184 -20.663 -34.865-119.305 1.00 68.52 C
-ANISOU 4226 C VAL M 184 9810 8277 7948 2116 77 -2030 C
-ATOM 4227 O VAL M 184 -21.648 -35.087-120.021 1.00 76.67 O
-ANISOU 4227 O VAL M 184 10679 9388 9062 2056 147 -2019 O
-ATOM 4228 CB VAL M 184 -21.042 -32.530-118.446 1.00 61.27 C
-ANISOU 4228 CB VAL M 184 9219 7340 6720 2089 347 -1720 C
-ATOM 4229 CG1 VAL M 184 -21.469 -33.165-117.138 1.00 56.72 C
-ANISOU 4229 CG1 VAL M 184 8854 6515 6183 2159 373 -1594 C
-ATOM 4230 CG2 VAL M 184 -20.389 -31.178-118.197 1.00 53.77 C
-ANISOU 4230 CG2 VAL M 184 8470 6391 5569 2025 389 -1695 C
-ATOM 4231 N LEU M 185 -20.056 -35.805-118.583 1.00 54.75 N
-ANISOU 4231 N LEU M 185 8184 6335 6282 2203 -51 -2081 N
-ATOM 4232 CA LEU M 185 -20.502 -37.192-118.537 1.00 55.01 C
-ANISOU 4232 CA LEU M 185 8237 6122 6543 2226 -111 -2122 C
-ATOM 4233 C LEU M 185 -20.687 -37.589-117.081 1.00 68.38 C
-ANISOU 4233 C LEU M 185 10203 7519 8261 2279 -80 -1883 C
-ATOM 4234 O LEU M 185 -19.731 -37.556-116.300 1.00 79.74 O
-ANISOU 4234 O LEU M 185 11765 8941 9593 2405 -162 -1862 O
-ATOM 4235 CB LEU M 185 -19.498 -38.120-119.226 1.00 60.53 C
-ANISOU 4235 CB LEU M 185 8828 6846 7327 2357 -301 -2418 C
-ATOM 4236 CG LEU M 185 -19.787 -39.620-119.106 1.00 72.50 C
-ANISOU 4236 CG LEU M 185 10471 7978 9096 2404 -378 -2486 C
-ATOM 4237 CD1 LEU M 185 -21.090 -39.976-119.802 1.00 80.96 C
-ANISOU 4237 CD1 LEU M 185 11454 8994 10312 2167 -309 -2519 C
-ATOM 4238 CD2 LEU M 185 -18.635 -40.443-119.667 1.00 69.97 C
-ANISOU 4238 CD2 LEU M 185 10103 7668 8815 2648 -552 -2787 C
-ATOM 4239 N SER M 186 -21.909 -37.963-116.721 1.00 69.92 N
-ANISOU 4239 N SER M 186 10455 7549 8561 2172 36 -1685 N
-ATOM 4240 CA SER M 186 -22.252 -38.329-115.357 1.00 71.49 C
-ANISOU 4240 CA SER M 186 10881 7523 8760 2204 94 -1403 C
-ATOM 4241 C SER M 186 -22.449 -39.833-115.245 1.00 72.30 C
-ANISOU 4241 C SER M 186 11065 7280 9126 2164 6 -1375 C
-ATOM 4242 O SER M 186 -22.861 -40.494-116.202 1.00 86.24 O
-ANISOU 4242 O SER M 186 12718 8970 11079 2023 -41 -1543 O
-ATOM 4243 CB SER M 186 -23.525 -37.615-114.903 1.00 84.93 C
-ANISOU 4243 CB SER M 186 12586 9333 10350 2120 315 -1134 C
-ATOM 4244 OG SER M 186 -24.045 -38.211-113.727 1.00101.16 O
-ANISOU 4244 OG SER M 186 14799 11210 12425 2117 377 -844 O
-ATOM 4245 N SER M 187 -22.157 -40.367-114.061 1.00 78.36 N
-ANISOU 4245 N SER M 187 12052 7828 9893 2278 -17 -1159 N
-ATOM 4246 CA SER M 187 -22.366 -41.789-113.825 1.00 98.20 C
-ANISOU 4246 CA SER M 187 14716 9928 12667 2241 -82 -1060 C
-ATOM 4247 C SER M 187 -22.430 -42.041-112.327 1.00 98.12 C
-ANISOU 4247 C SER M 187 14917 9788 12578 2330 -26 -671 C
-ATOM 4248 O SER M 187 -21.722 -41.395-111.553 1.00 98.04 O
-ANISOU 4248 O SER M 187 14958 9975 12319 2525 -32 -608 O
-ATOM 4249 CB SER M 187 -21.253 -42.636-114.454 1.00102.55 C
-ANISOU 4249 CB SER M 187 15315 10284 13364 2443 -275 -1357 C
-ATOM 4250 OG SER M 187 -20.047 -42.519-113.721 1.00113.36 O
-ANISOU 4250 OG SER M 187 16765 11739 14569 2756 -361 -1311 O
-ATOM 4251 N VAL M 188 -23.277 -42.983-111.932 1.00 94.09 N
-ANISOU 4251 N VAL M 188 14519 8972 12259 2155 23 -408 N
-ATOM 4252 CA VAL M 188 -23.402 -43.379-110.537 1.00 95.93 C
-ANISOU 4252 CA VAL M 188 14941 9082 12426 2227 81 16 C
-ATOM 4253 C VAL M 188 -22.462 -44.546-110.274 1.00106.03 C
-ANISOU 4253 C VAL M 188 16454 9952 13881 2454 -76 43 C
-ATOM 4254 O VAL M 188 -22.473 -45.542-111.006 1.00123.54 O
-ANISOU 4254 O VAL M 188 18772 11762 16404 2379 -166 -109 O
-ATOM 4255 CB VAL M 188 -24.855 -43.751-110.200 1.00102.57 C
-ANISOU 4255 CB VAL M 188 15755 9861 13356 1891 235 362 C
-ATOM 4256 CG1 VAL M 188 -24.957 -44.224-108.759 1.00 99.82 C
-ANISOU 4256 CG1 VAL M 188 15590 9413 12924 1968 299 841 C
-ATOM 4257 CG2 VAL M 188 -25.771 -42.563-110.445 1.00108.58 C
-ANISOU 4257 CG2 VAL M 188 16263 11090 13902 1767 407 358 C
-ATOM 4258 N LYS M 189 -21.645 -44.424-109.231 1.00112.02 N
-ANISOU 4258 N LYS M 189 17310 10827 14425 2754 -110 230 N
-ATOM 4259 CA LYS M 189 -20.692 -45.466-108.878 1.00121.00 C
-ANISOU 4259 CA LYS M 189 18652 11651 15672 3068 -246 318 C
-ATOM 4260 C LYS M 189 -20.442 -45.423-107.379 1.00125.48 C
-ANISOU 4260 C LYS M 189 19316 12380 15979 3262 -208 747 C
-ATOM 4261 O LYS M 189 -20.310 -44.343-106.797 1.00112.65 O
-ANISOU 4261 O LYS M 189 17571 11232 13999 3293 -157 756 O
-ATOM 4262 CB LYS M 189 -19.373 -45.299-109.641 1.00116.57 C
-ANISOU 4262 CB LYS M 189 17989 11245 15056 3371 -412 -90 C
-ATOM 4263 N ASP M 190 -20.380 -46.607-106.764 1.00139.74 N
-ANISOU 4263 N ASP M 190 21364 13776 17953 3393 -232 1098 N
-ATOM 4264 CA ASP M 190 -20.132 -46.743-105.327 1.00148.34 C
-ANISOU 4264 CA ASP M 190 22547 15024 18793 3608 -202 1565 C
-ATOM 4265 C ASP M 190 -21.140 -45.935-104.512 1.00147.15 C
-ANISOU 4265 C ASP M 190 22294 15240 18377 3358 -17 1821 C
-ATOM 4266 O ASP M 190 -20.795 -45.285-103.522 1.00141.30 O
-ANISOU 4266 O ASP M 190 21501 14948 17240 3527 6 1959 O
-ATOM 4267 CB ASP M 190 -18.697 -46.343-104.975 1.00145.40 C
-ANISOU 4267 CB ASP M 190 22082 15060 18104 4035 -346 1439 C
-ATOM 4268 N ARG M 191 -22.401 -45.969-104.951 1.00148.91 N
-ANISOU 4268 N ARG M 191 22473 15316 18789 2962 114 1864 N
-ATOM 4269 CA ARG M 191 -23.517 -45.333-104.247 1.00145.83 C
-ANISOU 4269 CA ARG M 191 21968 15273 18166 2748 318 2144 C
-ATOM 4270 C ARG M 191 -23.379 -43.809-104.210 1.00138.55 C
-ANISOU 4270 C ARG M 191 20875 14903 16863 2833 375 1850 C
-ATOM 4271 O ARG M 191 -23.759 -43.166-103.232 1.00140.55 O
-ANISOU 4271 O ARG M 191 21101 15534 16766 2886 510 2061 O
-ATOM 4272 CB ARG M 191 -23.674 -45.897-102.830 1.00142.48 C
-ANISOU 4272 CB ARG M 191 21670 14883 17582 2849 391 2732 C
-ATOM 4273 N PHE M 192 -22.854 -43.225-105.287 1.00125.45 N
-ANISOU 4273 N PHE M 192 19121 13279 15264 2844 281 1364 N
-ATOM 4274 CA PHE M 192 -22.678 -41.781-105.375 1.00109.29 C
-ANISOU 4274 CA PHE M 192 16968 11654 12903 2888 328 1075 C
-ATOM 4275 C PHE M 192 -22.730 -41.361-106.837 1.00 98.72 C
-ANISOU 4275 C PHE M 192 15488 10265 11757 2744 293 662 C
-ATOM 4276 O PHE M 192 -22.549 -42.178-107.741 1.00111.67 O
-ANISOU 4276 O PHE M 192 17111 11597 13719 2682 184 518 O
-ATOM 4277 CB PHE M 192 -21.357 -41.335-104.738 1.00117.81 C
-ANISOU 4277 CB PHE M 192 18101 12988 13674 3158 192 957 C
-ATOM 4278 CG PHE M 192 -21.428 -41.171-103.247 1.00134.85 C
-ANISOU 4278 CG PHE M 192 20350 15420 15466 3291 268 1288 C
-ATOM 4279 CD1 PHE M 192 -20.455 -41.725-102.430 1.00133.96 C
-ANISOU 4279 CD1 PHE M 192 20304 15392 15205 3537 130 1462 C
-ATOM 4280 CD2 PHE M 192 -22.459 -40.454-102.661 1.00143.28 C
-ANISOU 4280 CD2 PHE M 192 21420 16721 16299 3210 481 1428 C
-ATOM 4281 CE1 PHE M 192 -20.515 -41.576-101.058 1.00133.23 C
-ANISOU 4281 CE1 PHE M 192 20272 15620 14731 3663 193 1766 C
-ATOM 4282 CE2 PHE M 192 -22.525 -40.302-101.288 1.00139.31 C
-ANISOU 4282 CE2 PHE M 192 20995 16524 15414 3353 556 1708 C
-ATOM 4283 CZ PHE M 192 -21.551 -40.863-100.486 1.00135.80 C
-ANISOU 4283 CZ PHE M 192 20609 16170 14817 3561 406 1875 C
-ATOM 4284 N ILE M 193 -22.975 -40.071-107.059 1.00 89.35 N
-ANISOU 4284 N ILE M 193 14219 9377 10353 2711 393 472 N
-ATOM 4285 CA ILE M 193 -23.071 -39.498-108.400 1.00 86.00 C
-ANISOU 4285 CA ILE M 193 13644 8984 10048 2592 386 132 C
-ATOM 4286 C ILE M 193 -21.766 -38.787-108.727 1.00 94.26 C
-ANISOU 4286 C ILE M 193 14687 10178 10949 2711 240 -202 C
-ATOM 4287 O ILE M 193 -21.295 -37.944-107.951 1.00102.40 O
-ANISOU 4287 O ILE M 193 15817 11425 11663 2799 252 -221 O
-ATOM 4288 CB ILE M 193 -24.264 -38.532-108.510 1.00 82.17 C
-ANISOU 4288 CB ILE M 193 13072 8721 9426 2500 611 194 C
-ATOM 4289 CG1 ILE M 193 -25.572 -39.310-108.678 1.00 91.27 C
-ANISOU 4289 CG1 ILE M 193 14099 9801 10778 2291 724 463 C
-ATOM 4290 CG2 ILE M 193 -24.066 -37.555-109.664 1.00 61.93 C
-ANISOU 4290 CG2 ILE M 193 10399 6277 6854 2469 606 -143 C
-ATOM 4291 N ASN M 194 -21.189 -39.112-109.883 1.00 88.95 N
-ANISOU 4291 N ASN M 194 13892 9423 10482 2689 103 -475 N
-ATOM 4292 CA ASN M 194 -19.911 -38.565-110.316 1.00 84.79 C
-ANISOU 4292 CA ASN M 194 13296 9092 9828 2771 -46 -768 C
-ATOM 4293 C ASN M 194 -20.065 -37.816-111.634 1.00 80.26 C
-ANISOU 4293 C ASN M 194 12552 8636 9308 2631 -17 -1033 C
-ATOM 4294 O ASN M 194 -20.830 -38.230-112.515 1.00 87.08 O
-ANISOU 4294 O ASN M 194 13302 9387 10396 2524 28 -1073 O
-ATOM 4295 CB ASN M 194 -18.864 -39.669-110.469 1.00 90.39 C
-ANISOU 4295 CB ASN M 194 13981 9693 10671 2962 -245 -835 C
-ATOM 4296 CG ASN M 194 -18.480 -40.294-109.146 1.00104.39 C
-ANISOU 4296 CG ASN M 194 15910 11423 12332 3158 -290 -547 C
-ATOM 4297 OD1 ASN M 194 -18.946 -41.380-108.804 1.00117.66 O
-ANISOU 4297 OD1 ASN M 194 17710 12782 14216 3211 -270 -304 O
-ATOM 4298 ND2 ASN M 194 -17.627 -39.611-108.393 1.00115.09 N
-ANISOU 4298 ND2 ASN M 194 17267 13116 13348 3243 -356 -559 N
-ATOM 4299 N PHE M 195 -19.307 -36.727-111.760 1.00 67.72 N
-ANISOU 4299 N PHE M 195 10942 7294 7496 2607 -53 -1204 N
-ATOM 4300 CA PHE M 195 -19.341 -35.808-112.897 1.00 62.64 C
-ANISOU 4300 CA PHE M 195 10162 6796 6843 2477 -14 -1401 C
-ATOM 4301 C PHE M 195 -17.940 -35.698-113.493 1.00 64.91 C
-ANISOU 4301 C PHE M 195 10292 7312 7060 2487 -203 -1637 C
-ATOM 4302 O PHE M 195 -17.076 -34.998-112.948 1.00 62.83 O
-ANISOU 4302 O PHE M 195 10087 7236 6549 2443 -270 -1678 O
-ATOM 4303 CB PHE M 195 -19.854 -34.438-112.465 1.00 55.44 C
-ANISOU 4303 CB PHE M 195 9418 5938 5708 2403 158 -1337 C
-ATOM 4304 CG PHE M 195 -21.320 -34.244-112.683 1.00 69.21 C
-ANISOU 4304 CG PHE M 195 11158 7608 7530 2394 374 -1178 C
-ATOM 4305 CD1 PHE M 195 -22.226 -35.202-112.265 1.00 74.99 C
-ANISOU 4305 CD1 PHE M 195 11871 8222 8399 2423 438 -965 C
-ATOM 4306 CD2 PHE M 195 -21.795 -33.087-113.282 1.00 63.97 C
-ANISOU 4306 CD2 PHE M 195 10501 7021 6783 2359 519 -1205 C
-ATOM 4307 CE1 PHE M 195 -23.581 -35.021-112.460 1.00 85.26 C
-ANISOU 4307 CE1 PHE M 195 13100 9564 9731 2397 633 -795 C
-ATOM 4308 CE2 PHE M 195 -23.149 -32.897-113.477 1.00 69.71 C
-ANISOU 4308 CE2 PHE M 195 11178 7769 7541 2406 724 -1029 C
-ATOM 4309 CZ PHE M 195 -24.043 -33.865-113.066 1.00 85.64 C
-ANISOU 4309 CZ PHE M 195 13117 9751 9670 2416 778 -829 C
-ATOM 4310 N PHE M 196 -17.721 -36.389-114.610 1.00 67.18 N
-ANISOU 4310 N PHE M 196 10365 7626 7535 2529 -290 -1800 N
-ATOM 4311 CA PHE M 196 -16.497 -36.263-115.392 1.00 60.26 C
-ANISOU 4311 CA PHE M 196 9265 7057 6576 2556 -442 -2023 C
-ATOM 4312 C PHE M 196 -16.682 -35.137-116.405 1.00 64.06 C
-ANISOU 4312 C PHE M 196 9614 7736 6990 2356 -362 -2114 C
-ATOM 4313 O PHE M 196 -17.549 -35.222-117.281 1.00 70.21 O
-ANISOU 4313 O PHE M 196 10297 8463 7916 2315 -272 -2141 O
-ATOM 4314 CB PHE M 196 -16.174 -37.576-116.099 1.00 57.58 C
-ANISOU 4314 CB PHE M 196 8783 6658 6439 2759 -560 -2175 C
-ATOM 4315 CG PHE M 196 -16.122 -38.763-115.182 1.00 66.61 C
-ANISOU 4315 CG PHE M 196 10107 7505 7697 2979 -617 -2038 C
-ATOM 4316 CD1 PHE M 196 -17.259 -39.510-114.927 1.00 73.49 C
-ANISOU 4316 CD1 PHE M 196 11153 7967 8803 2941 -525 -1894 C
-ATOM 4317 CD2 PHE M 196 -14.929 -39.148-114.591 1.00 80.96 C
-ANISOU 4317 CD2 PHE M 196 11902 9486 9374 3219 -762 -2022 C
-ATOM 4318 CE1 PHE M 196 -17.213 -40.609-114.087 1.00 73.52 C
-ANISOU 4318 CE1 PHE M 196 11353 7658 8924 3123 -569 -1718 C
-ATOM 4319 CE2 PHE M 196 -14.875 -40.247-113.752 1.00 79.29 C
-ANISOU 4319 CE2 PHE M 196 11871 8991 9263 3466 -804 -1845 C
-ATOM 4320 CZ PHE M 196 -16.018 -40.978-113.500 1.00 71.85 C
-ANISOU 4320 CZ PHE M 196 11149 7569 8580 3411 -704 -1686 C
-ATOM 4321 N VAL M 197 -15.877 -34.084-116.285 1.00 59.11 N
-ANISOU 4321 N VAL M 197 8982 7347 6128 2211 -396 -2143 N
-ATOM 4322 CA VAL M 197 -16.073 -32.858-117.051 1.00 61.38 C
-ANISOU 4322 CA VAL M 197 9236 7748 6336 2002 -296 -2153 C
-ATOM 4323 C VAL M 197 -14.800 -32.536-117.818 1.00 67.83 C
-ANISOU 4323 C VAL M 197 9778 8980 7012 1893 -438 -2293 C
-ATOM 4324 O VAL M 197 -13.704 -32.535-117.242 1.00 60.61 O
-ANISOU 4324 O VAL M 197 8825 8280 5923 1859 -582 -2330 O
-ATOM 4325 CB VAL M 197 -16.468 -31.676-116.146 1.00 64.69 C
-ANISOU 4325 CB VAL M 197 10000 7983 6597 1859 -162 -2025 C
-ATOM 4326 CG1 VAL M 197 -16.550 -30.397-116.958 1.00 58.43 C
-ANISOU 4326 CG1 VAL M 197 9223 7247 5729 1662 -60 -2013 C
-ATOM 4327 CG2 VAL M 197 -17.793 -31.952-115.453 1.00 71.99 C
-ANISOU 4327 CG2 VAL M 197 11137 8595 7620 1997 6 -1861 C
-ATOM 4328 N GLY M 198 -14.954 -32.263-119.115 1.00 75.70 N
-ANISOU 4328 N GLY M 198 10548 10161 8053 1837 -396 -2347 N
-ATOM 4329 CA GLY M 198 -13.892 -31.718-119.937 1.00 67.17 C
-ANISOU 4329 CA GLY M 198 9194 9522 6807 1682 -486 -2419 C
-ATOM 4330 C GLY M 198 -14.207 -30.294-120.350 1.00 71.11 C
-ANISOU 4330 C GLY M 198 9806 9991 7221 1405 -348 -2283 C
-ATOM 4331 O GLY M 198 -15.246 -30.038-120.965 1.00 61.22 O
-ANISOU 4331 O GLY M 198 8580 8605 6076 1450 -192 -2198 O
-ATOM 4332 N ASN M 199 -13.326 -29.358-120.007 1.00 79.42 N
-ANISOU 4332 N ASN M 199 10937 11166 8071 1112 -402 -2246 N
-ATOM 4333 CA ASN M 199 -13.549 -27.939-120.245 1.00 77.19 C
-ANISOU 4333 CA ASN M 199 10877 10738 7712 822 -269 -2101 C
-ATOM 4334 C ASN M 199 -12.479 -27.383-121.170 1.00 75.16 C
-ANISOU 4334 C ASN M 199 10312 10948 7296 534 -358 -2083 C
-ATOM 4335 O ASN M 199 -11.294 -27.706-121.036 1.00 87.49 O
-ANISOU 4335 O ASN M 199 11615 12925 8704 430 -545 -2178 O
-ATOM 4336 CB ASN M 199 -13.545 -27.144-118.934 1.00 84.08 C
-ANISOU 4336 CB ASN M 199 12230 11244 8473 633 -236 -2072 C
-ATOM 4337 CG ASN M 199 -14.746 -27.441-118.064 1.00 89.15 C
-ANISOU 4337 CG ASN M 199 13196 11447 9231 906 -95 -2030 C
-ATOM 4338 OD1 ASN M 199 -15.862 -27.596-118.556 1.00 87.91 O
-ANISOU 4338 OD1 ASN M 199 13030 11142 9231 1122 63 -1937 O
-ATOM 4339 ND2 ASN M 199 -14.524 -27.512-116.758 1.00102.16 N
-ANISOU 4339 ND2 ASN M 199 15097 12953 10765 888 -151 -2085 N
-ATOM 4340 N THR M 200 -12.907 -26.540-122.105 1.00 64.24 N
-ANISOU 4340 N THR M 200 8934 9545 5929 419 -218 -1924 N
-ATOM 4341 CA THR M 200 -11.995 -25.762-122.932 1.00 75.97 C
-ANISOU 4341 CA THR M 200 10198 11416 7251 69 -263 -1823 C
-ATOM 4342 C THR M 200 -11.736 -24.425-122.248 1.00 90.75 C
-ANISOU 4342 C THR M 200 12534 12927 9020 -364 -218 -1706 C
-ATOM 4343 O THR M 200 -12.682 -23.741-121.846 1.00 98.84 O
-ANISOU 4343 O THR M 200 14038 13382 10134 -315 -38 -1608 O
-ATOM 4344 CB THR M 200 -12.585 -25.542-124.325 1.00 71.62 C
-ANISOU 4344 CB THR M 200 9416 11046 6751 172 -130 -1672 C
-ATOM 4345 OG1 THR M 200 -12.716 -26.801-124.998 1.00 76.89 O
-ANISOU 4345 OG1 THR M 200 9655 12081 7478 524 -198 -1847 O
-ATOM 4346 CG2 THR M 200 -11.692 -24.624-125.141 1.00 64.43 C
-ANISOU 4346 CG2 THR M 200 8311 10512 5659 -224 -152 -1494 C
-ATOM 4347 N ILE M 201 -10.465 -24.051-122.112 1.00 86.84 N
-ANISOU 4347 N ILE M 201 11903 12774 8320 -788 -381 -1725 N
-ATOM 4348 CA ILE M 201 -10.081 -22.891-121.311 1.00 94.04 C
-ANISOU 4348 CA ILE M 201 13281 13341 9110 -1280 -388 -1689 C
-ATOM 4349 C ILE M 201 -9.494 -21.798-122.197 1.00105.81 C
-ANISOU 4349 C ILE M 201 14718 14989 10497 -1779 -364 -1469 C
-ATOM 4350 O ILE M 201 -8.645 -22.061-123.059 1.00104.50 O
-ANISOU 4350 O ILE M 201 13995 15503 10207 -1911 -474 -1408 O
-ATOM 4351 CB ILE M 201 -9.105 -23.276-120.184 1.00 91.38 C
-ANISOU 4351 CB ILE M 201 12894 13245 8580 -1466 -613 -1889 C
-ATOM 4352 CG1 ILE M 201 -7.740 -23.701-120.739 1.00103.70 C
-ANISOU 4352 CG1 ILE M 201 13809 15662 9932 -1664 -826 -1899 C
-ATOM 4353 CG2 ILE M 201 -9.708 -24.357-119.303 1.00 70.43 C
-ANISOU 4353 CG2 ILE M 201 10313 10416 6030 -966 -622 -2045 C
-ATOM 4354 CD1 ILE M 201 -6.826 -24.295-119.693 1.00108.43 C
-ANISOU 4354 CD1 ILE M 201 14246 16630 10323 -1708 -1051 -2070 C
-ATOM 4355 N ASN M 202 -9.962 -20.573-121.980 1.00118.22 N
-ANISOU 4355 N ASN M 202 16886 15921 12111 -2034 -209 -1335 N
-ATOM 4356 CA ASN M 202 -9.392 -19.333-122.486 1.00122.57 C
-ANISOU 4356 CA ASN M 202 17600 16401 12569 -2626 -183 -1113 C
-ATOM 4357 C ASN M 202 -8.366 -18.878-121.458 1.00124.96 C
-ANISOU 4357 C ASN M 202 18120 16695 12667 -3229 -375 -1282 C
-ATOM 4358 O ASN M 202 -8.396 -19.300-120.302 1.00122.41 O
-ANISOU 4358 O ASN M 202 17981 16235 12296 -3114 -462 -1541 O
-ATOM 4359 CB ASN M 202 -10.512 -18.303-122.640 1.00133.16 C
-ANISOU 4359 CB ASN M 202 19577 16944 14074 -2509 95 -906 C
-ATOM 4360 CG ASN M 202 -10.210 -17.145-123.585 1.00144.98 C
-ANISOU 4360 CG ASN M 202 21185 18353 15546 -2951 190 -555 C
-ATOM 4361 OD1 ASN M 202 -9.107 -16.917-124.080 1.00131.36 O
-ANISOU 4361 OD1 ASN M 202 19117 17128 13665 -3481 48 -448 O
-ATOM 4362 ND2 ASN M 202 -11.300 -16.419-123.845 1.00181.39 N
-ANISOU 4362 ND2 ASN M 202 26282 22327 20310 -2670 456 -336 N
-ATOM 4363 N SER M 203 -7.445 -18.018-121.875 1.00132.64 N
-ANISOU 4363 N SER M 203 19049 17857 13491 -3908 -449 -1121 N
-ATOM 4364 CA SER M 203 -6.409 -17.612-120.932 1.00137.24 C
-ANISOU 4364 CA SER M 203 19770 18538 13838 -4563 -662 -1296 C
-ATOM 4365 C SER M 203 -6.917 -16.613-119.900 1.00134.46 C
-ANISOU 4365 C SER M 203 20339 17227 13521 -4801 -569 -1434 C
-ATOM 4366 O SER M 203 -6.260 -16.416-118.872 1.00129.29 O
-ANISOU 4366 O SER M 203 19873 16589 12660 -5242 -748 -1678 O
-ATOM 4367 CB SER M 203 -5.215 -17.025-121.682 1.00145.20 C
-ANISOU 4367 CB SER M 203 20403 20119 14649 -5300 -788 -1073 C
-ATOM 4368 OG SER M 203 -4.795 -17.896-122.722 1.00146.13 O
-ANISOU 4368 OG SER M 203 19676 21141 14705 -5017 -842 -942 O
-ATOM 4369 N SER M 204 -8.070 -15.984-120.147 1.00143.72 N
-ANISOU 4369 N SER M 204 22080 17606 14920 -4490 -291 -1295 N
-ATOM 4370 CA SER M 204 -8.580 -14.968-119.230 1.00156.17 C
-ANISOU 4370 CA SER M 204 24589 18232 16519 -4650 -171 -1433 C
-ATOM 4371 C SER M 204 -9.187 -15.585-117.978 1.00159.01 C
-ANISOU 4371 C SER M 204 25183 18379 16854 -4170 -172 -1767 C
-ATOM 4372 O SER M 204 -9.245 -14.929-116.932 1.00167.91 O
-ANISOU 4372 O SER M 204 26972 18951 17876 -4401 -170 -2008 O
-ATOM 4373 CB SER M 204 -9.610 -14.093-119.943 1.00158.57 C
-ANISOU 4373 CB SER M 204 25400 17802 17046 -4385 146 -1131 C
-ATOM 4374 OG SER M 204 -10.884 -14.718-119.969 1.00150.53 O
-ANISOU 4374 OG SER M 204 24363 16635 16198 -3518 344 -1113 O
-ATOM 4375 N TYR M 205 -9.655 -16.830-118.066 1.00159.42 N
-ANISOU 4375 N TYR M 205 24727 18854 16991 -3518 -170 -1785 N
-ATOM 4376 CA TYR M 205 -10.227 -17.490-116.898 1.00167.80 C
-ANISOU 4376 CA TYR M 205 25958 19773 18024 -3070 -168 -2042 C
-ATOM 4377 C TYR M 205 -9.186 -17.665-115.799 1.00186.41 C
-ANISOU 4377 C TYR M 205 28271 22464 20094 -3509 -442 -2331 C
-ATOM 4378 O TYR M 205 -9.412 -17.279-114.645 1.00188.69 O
-ANISOU 4378 O TYR M 205 29111 22329 20254 -3563 -432 -2571 O
-ATOM 4379 CB TYR M 205 -10.816 -18.846-117.292 1.00158.90 C
-ANISOU 4379 CB TYR M 205 24260 19064 17052 -2385 -138 -1976 C
-ATOM 4380 CG TYR M 205 -12.016 -18.767-118.203 1.00155.07 C
-ANISOU 4380 CG TYR M 205 23816 18293 16810 -1894 131 -1730 C
-ATOM 4381 CD1 TYR M 205 -13.298 -18.618-117.680 1.00153.85 C
-ANISOU 4381 CD1 TYR M 205 24118 17581 16754 -1406 363 -1731 C
-ATOM 4382 CD2 TYR M 205 -11.879 -18.857-119.575 1.00155.75 C
-ANISOU 4382 CD2 TYR M 205 23442 18751 16987 -1896 154 -1487 C
-ATOM 4383 CE1 TYR M 205 -14.402 -18.553-118.510 1.00152.74 C
-ANISOU 4383 CE1 TYR M 205 23954 17283 16796 -949 601 -1484 C
-ATOM 4384 CE2 TYR M 205 -12.975 -18.793-120.408 1.00155.15 C
-ANISOU 4384 CE2 TYR M 205 23360 18501 17090 -1451 386 -1256 C
-ATOM 4385 CZ TYR M 205 -14.231 -18.641-119.873 1.00154.48 C
-ANISOU 4385 CZ TYR M 205 23712 17883 17100 -984 605 -1249 C
-ATOM 4386 OH TYR M 205 -15.319 -18.578-120.712 1.00155.85 O
-ANISOU 4386 OH TYR M 205 23818 17984 17412 -540 828 -997 O
-ATOM 4387 N PHE M 206 -8.029 -18.232-116.155 1.00203.55 N
-ANISOU 4387 N PHE M 206 29764 25453 22121 -3808 -688 -2308 N
-ATOM 4388 CA PHE M 206 -6.962 -18.581-115.211 1.00201.15 C
-ANISOU 4388 CA PHE M 206 29233 25689 21505 -4160 -973 -2533 C
-ATOM 4389 C PHE M 206 -6.690 -17.531-114.135 1.00213.87 C
-ANISOU 4389 C PHE M 206 31515 26855 22889 -4749 -1038 -2783 C
-ATOM 4390 O PHE M 206 -6.577 -17.913-112.959 1.00229.95 O
-ANISOU 4390 O PHE M 206 33635 29016 24720 -4670 -1156 -3027 O
-ATOM 4391 CB PHE M 206 -5.689 -18.884-116.016 1.00188.48 C
-ANISOU 4391 CB PHE M 206 26870 24991 19753 -4545 -1188 -2398 C
-ATOM 4392 CG PHE M 206 -5.401 -20.348-116.181 1.00171.69 C
-ANISOU 4392 CG PHE M 206 24005 23617 17614 -3996 -1303 -2385 C
-ATOM 4393 CD1 PHE M 206 -5.195 -20.868-117.436 1.00166.20 C
-ANISOU 4393 CD1 PHE M 206 22717 23413 17019 -3785 -1286 -2188 C
-ATOM 4394 CD2 PHE M 206 -5.311 -21.196-115.091 1.00161.46 C
-ANISOU 4394 CD2 PHE M 206 22626 22536 16186 -3683 -1426 -2566 C
-ATOM 4395 CE1 PHE M 206 -4.925 -22.205-117.616 1.00155.64 C
-ANISOU 4395 CE1 PHE M 206 20769 22697 15672 -3253 -1382 -2208 C
-ATOM 4396 CE2 PHE M 206 -5.035 -22.541-115.272 1.00153.81 C
-ANISOU 4396 CE2 PHE M 206 21037 22180 15223 -3151 -1520 -2531 C
-ATOM 4397 CZ PHE M 206 -4.843 -23.042-116.533 1.00149.84 C
-ANISOU 4397 CZ PHE M 206 20000 22093 14839 -2933 -1497 -2373 C
-ATOM 4398 N PRO M 207 -6.583 -16.225-114.439 1.00188.56 N
-ANISOU 4398 N PRO M 207 28832 23117 19696 -5340 -967 -2743 N
-ATOM 4399 CA PRO M 207 -6.254 -15.277-113.355 1.00173.83 C
-ANISOU 4399 CA PRO M 207 27638 20826 17584 -5948 -1057 -3054 C
-ATOM 4400 C PRO M 207 -7.270 -15.235-112.224 1.00160.94 C
-ANISOU 4400 C PRO M 207 26654 18555 15940 -5452 -906 -3319 C
-ATOM 4401 O PRO M 207 -6.885 -15.310-111.051 1.00143.74 O
-ANISOU 4401 O PRO M 207 24458 16584 13574 -5517 -1038 -3527 O
-ATOM 4402 CB PRO M 207 -6.165 -13.932-114.092 1.00174.73 C
-ANISOU 4402 CB PRO M 207 28256 20327 17807 -6555 -946 -2898 C
-ATOM 4403 CG PRO M 207 -5.691 -14.293-115.429 1.00175.75 C
-ANISOU 4403 CG PRO M 207 27646 21082 18047 -6611 -975 -2525 C
-ATOM 4404 CD PRO M 207 -6.443 -15.569-115.758 1.00176.28 C
-ANISOU 4404 CD PRO M 207 27201 21475 18302 -5644 -869 -2422 C
-ATOM 4405 N ASP M 208 -8.560 -15.120-112.536 1.00164.02 N
-ANISOU 4405 N ASP M 208 27413 18296 16613 -4798 -591 -3189 N
-ATOM 4406 CA ASP M 208 -9.588 -14.922-111.520 1.00165.56 C
-ANISOU 4406 CA ASP M 208 28209 17889 16805 -4291 -399 -3377 C
-ATOM 4407 C ASP M 208 -10.525 -16.117-111.392 1.00159.40 C
-ANISOU 4407 C ASP M 208 27110 17322 16132 -3433 -282 -3301 C
-ATOM 4408 O ASP M 208 -10.708 -16.642-110.290 1.00141.16 O
-ANISOU 4408 O ASP M 208 24721 15201 13712 -3121 -324 -3437 O
-ATOM 4409 CB ASP M 208 -10.388 -13.651-111.837 1.00168.10 C
-ANISOU 4409 CB ASP M 208 29300 17249 17322 -4220 -103 -3279 C
-ATOM 4410 N HIS M 209 -11.136 -16.556-112.496 1.00167.57 N
-ANISOU 4410 N HIS M 209 27783 18418 17470 -2985 -125 -2975 N
-ATOM 4411 CA HIS M 209 -12.120 -17.637-112.508 1.00168.65 C
-ANISOU 4411 CA HIS M 209 27594 18717 17769 -2201 8 -2849 C
-ATOM 4412 C HIS M 209 -11.574 -18.851-113.248 1.00162.27 C
-ANISOU 4412 C HIS M 209 25915 18683 17056 -2108 -164 -2691 C
-ATOM 4413 O HIS M 209 -11.836 -19.020-114.450 1.00160.16 O
-ANISOU 4413 O HIS M 209 25326 18516 17012 -1944 -74 -2446 O
-ATOM 4414 CB HIS M 209 -13.429 -17.164-113.148 1.00169.91 C
-ANISOU 4414 CB HIS M 209 28077 18308 18173 -1703 348 -2626 C
-ATOM 4415 CG HIS M 209 -14.456 -18.246-113.302 1.00165.72 C
-ANISOU 4415 CG HIS M 209 27160 17996 17811 -989 478 -2467 C
-ATOM 4416 ND1 HIS M 209 -15.019 -18.904-112.229 1.00167.20 N
-ANISOU 4416 ND1 HIS M 209 27395 18229 17904 -596 508 -2586 N
-ATOM 4417 CD2 HIS M 209 -15.016 -18.788-114.410 1.00152.84 C
-ANISOU 4417 CD2 HIS M 209 25079 16573 16420 -646 578 -2194 C
-ATOM 4418 CE1 HIS M 209 -15.883 -19.803-112.671 1.00158.09 C
-ANISOU 4418 CE1 HIS M 209 25850 17272 16945 -79 620 -2380 C
-ATOM 4419 NE2 HIS M 209 -15.900 -19.751-113.990 1.00148.82 N
-ANISOU 4419 NE2 HIS M 209 24374 16200 15971 -103 658 -2165 N
-ATOM 4420 N PRO M 210 -10.835 -19.737-112.580 1.00158.13 N
-ANISOU 4420 N PRO M 210 24997 18732 16355 -2158 -402 -2823 N
-ATOM 4421 CA PRO M 210 -10.221 -20.873-113.271 1.00153.65 C
-ANISOU 4421 CA PRO M 210 23646 18878 15854 -2039 -566 -2698 C
-ATOM 4422 C PRO M 210 -11.073 -22.128-113.225 1.00142.28 C
-ANISOU 4422 C PRO M 210 21936 17523 14603 -1343 -480 -2610 C
-ATOM 4423 O PRO M 210 -11.864 -22.342-112.311 1.00147.63 O
-ANISOU 4423 O PRO M 210 22912 17917 15264 -1009 -374 -2665 O
-ATOM 4424 CB PRO M 210 -8.919 -21.071-112.483 1.00154.72 C
-ANISOU 4424 CB PRO M 210 23551 19579 15656 -2465 -869 -2875 C
-ATOM 4425 CG PRO M 210 -9.320 -20.734-111.080 1.00155.20 C
-ANISOU 4425 CG PRO M 210 24172 19275 15522 -2438 -837 -3094 C
-ATOM 4426 CD PRO M 210 -10.390 -19.653-111.174 1.00156.69 C
-ANISOU 4426 CD PRO M 210 25074 18610 15850 -2369 -550 -3100 C
-ATOM 4427 N LEU M 211 -10.875 -22.974-114.229 1.00124.08 N
-ANISOU 4427 N LEU M 211 19053 15634 12459 -1150 -531 -2476 N
-ATOM 4428 CA LEU M 211 -11.556 -24.255-114.344 1.00103.36 C
-ANISOU 4428 CA LEU M 211 16133 13108 10030 -571 -482 -2403 C
-ATOM 4429 C LEU M 211 -10.519 -25.332-114.632 1.00100.93 C
-ANISOU 4429 C LEU M 211 15213 13467 9669 -521 -716 -2422 C
-ATOM 4430 O LEU M 211 -9.324 -25.054-114.770 1.00115.99 O
-ANISOU 4430 O LEU M 211 16877 15824 11371 -911 -901 -2468 O
-ATOM 4431 CB LEU M 211 -12.630 -24.211-115.436 1.00 89.26 C
-ANISOU 4431 CB LEU M 211 14325 11068 8523 -286 -259 -2237 C
-ATOM 4432 CG LEU M 211 -13.903 -23.447-115.073 1.00 81.60 C
-ANISOU 4432 CG LEU M 211 13905 9479 7618 -102 8 -2175 C
-ATOM 4433 CD1 LEU M 211 -14.579 -22.920-116.337 1.00 66.96 C
-ANISOU 4433 CD1 LEU M 211 12025 7473 5944 -15 197 -1981 C
-ATOM 4434 CD2 LEU M 211 -14.855 -24.302-114.255 1.00 72.39 C
-ANISOU 4434 CD2 LEU M 211 12798 8190 6515 357 96 -2164 C
-ATOM 4435 N HIS M 212 -10.983 -26.572-114.742 1.00 78.54 N
-ANISOU 4435 N HIS M 212 12129 10702 7012 -33 -701 -2379 N
-ATOM 4436 CA HIS M 212 -10.108 -27.723-114.895 1.00 78.34 C
-ANISOU 4436 CA HIS M 212 11599 11219 6947 155 -897 -2406 C
-ATOM 4437 C HIS M 212 -10.324 -28.375-116.251 1.00 75.46 C
-ANISOU 4437 C HIS M 212 10862 10999 6808 409 -855 -2368 C
-ATOM 4438 O HIS M 212 -11.466 -28.555-116.690 1.00 74.94 O
-ANISOU 4438 O HIS M 212 10916 10573 6983 640 -681 -2313 O
-ATOM 4439 CB HIS M 212 -10.345 -28.743-113.779 1.00 83.72 C
-ANISOU 4439 CB HIS M 212 12346 11838 7625 521 -940 -2401 C
-ATOM 4440 CG HIS M 212 -10.053 -28.217-112.407 1.00 84.58 C
-ANISOU 4440 CG HIS M 212 12761 11926 7448 307 -1005 -2457 C
-ATOM 4441 ND1 HIS M 212 -8.791 -27.824-112.017 1.00 81.72 N
-ANISOU 4441 ND1 HIS M 212 12243 12050 6759 -60 -1216 -2542 N
-ATOM 4442 CD2 HIS M 212 -10.852 -28.040-111.328 1.00 92.79 C
-ANISOU 4442 CD2 HIS M 212 14227 12585 8445 405 -893 -2450 C
-ATOM 4443 CE1 HIS M 212 -8.826 -27.418-110.761 1.00 92.80 C
-ANISOU 4443 CE1 HIS M 212 13985 13348 7927 -197 -1241 -2613 C
-ATOM 4444 NE2 HIS M 212 -10.065 -27.540-110.319 1.00 93.11 N
-ANISOU 4444 NE2 HIS M 212 14389 12860 8130 103 -1040 -2561 N
-ATOM 4445 N SER M 213 -9.215 -28.736-116.902 1.00 75.75 N
-ANISOU 4445 N SER M 213 10424 11629 6730 370 -1018 -2407 N
-ATOM 4446 CA SER M 213 -9.288 -29.326-118.235 1.00 81.74 C
-ANISOU 4446 CA SER M 213 10808 12611 7640 605 -992 -2418 C
-ATOM 4447 C SER M 213 -10.044 -30.648-118.210 1.00 74.47 C
-ANISOU 4447 C SER M 213 9883 11447 6966 1123 -951 -2464 C
-ATOM 4448 O SER M 213 -10.944 -30.876-119.025 1.00 70.74 O
-ANISOU 4448 O SER M 213 9406 10763 6709 1277 -824 -2466 O
-ATOM 4449 CB SER M 213 -7.881 -29.515-118.801 1.00 85.44 C
-ANISOU 4449 CB SER M 213 10748 13836 7877 521 -1175 -2459 C
-ATOM 4450 OG SER M 213 -7.229 -28.269-118.986 1.00 82.61 O
-ANISOU 4450 OG SER M 213 10368 13713 7306 -45 -1207 -2387 O
-ATOM 4451 N ILE M 214 -9.681 -31.540-117.289 1.00 71.93 N
-ANISOU 4451 N ILE M 214 9560 11167 6603 1377 -1063 -2487 N
-ATOM 4452 CA ILE M 214 -10.398 -32.794-117.075 1.00 78.00 C
-ANISOU 4452 CA ILE M 214 10415 11607 7615 1815 -1027 -2495 C
-ATOM 4453 C ILE M 214 -10.550 -32.982-115.573 1.00 82.53 C
-ANISOU 4453 C ILE M 214 11290 11944 8123 1875 -1045 -2396 C
-ATOM 4454 O ILE M 214 -9.552 -32.984-114.844 1.00 98.76 O
-ANISOU 4454 O ILE M 214 13246 14353 9924 1842 -1196 -2385 O
-ATOM 4455 CB ILE M 214 -9.677 -34.003-117.698 1.00 78.75 C
-ANISOU 4455 CB ILE M 214 10144 12038 7738 2202 -1152 -2609 C
-ATOM 4456 CG1 ILE M 214 -9.547 -33.835-119.213 1.00 84.44 C
-ANISOU 4456 CG1 ILE M 214 10544 13060 8480 2166 -1128 -2726 C
-ATOM 4457 CG2 ILE M 214 -10.420 -35.288-117.384 1.00 79.66 C
-ANISOU 4457 CG2 ILE M 214 10444 11700 8124 2598 -1117 -2609 C
-ATOM 4458 N SER M 215 -11.786 -33.133-115.104 1.00 70.76 N
-ANISOU 4458 N SER M 215 10128 9934 6822 1960 -891 -2308 N
-ATOM 4459 CA SER M 215 -12.033 -33.250-113.674 1.00 68.66 C
-ANISOU 4459 CA SER M 215 10150 9473 6466 2016 -882 -2189 C
-ATOM 4460 C SER M 215 -13.072 -34.329-113.412 1.00 68.31 C
-ANISOU 4460 C SER M 215 10248 9015 6691 2318 -786 -2074 C
-ATOM 4461 O SER M 215 -13.831 -34.726-114.300 1.00 73.55 O
-ANISOU 4461 O SER M 215 10861 9472 7612 2390 -697 -2103 O
-ATOM 4462 CB SER M 215 -12.509 -31.920-113.068 1.00 78.32 C
-ANISOU 4462 CB SER M 215 11714 10506 7536 1696 -763 -2166 C
-ATOM 4463 OG SER M 215 -13.827 -31.595-113.492 1.00 72.18 O
-ANISOU 4463 OG SER M 215 11128 9332 6964 1709 -546 -2108 O
-ATOM 4464 N VAL M 216 -13.094 -34.800-112.167 1.00 73.22 N
-ANISOU 4464 N VAL M 216 11037 9553 7229 2463 -811 -1929 N
-ATOM 4465 CA VAL M 216 -14.152 -35.667-111.662 1.00 73.06 C
-ANISOU 4465 CA VAL M 216 11209 9128 7422 2663 -700 -1748 C
-ATOM 4466 C VAL M 216 -14.626 -35.091-110.334 1.00 73.93 C
-ANISOU 4466 C VAL M 216 11608 9158 7325 2583 -608 -1598 C
-ATOM 4467 O VAL M 216 -13.834 -34.946-109.395 1.00 63.49 O
-ANISOU 4467 O VAL M 216 10309 8098 5717 2588 -721 -1571 O
-ATOM 4468 CB VAL M 216 -13.690 -37.125-111.497 1.00 62.98 C
-ANISOU 4468 CB VAL M 216 9843 7813 6272 3014 -820 -1668 C
-ATOM 4469 CG1 VAL M 216 -12.375 -37.195-110.747 1.00 66.24 C
-ANISOU 4469 CG1 VAL M 216 10135 8655 6380 3140 -1000 -1638 C
-ATOM 4470 CG2 VAL M 216 -14.755 -37.930-110.786 1.00 63.52 C
-ANISOU 4470 CG2 VAL M 216 10151 7455 6529 3135 -705 -1421 C
-ATOM 4471 N ARG M 217 -15.905 -34.739-110.261 1.00 78.08 N
-ANISOU 4471 N ARG M 217 12327 9389 7951 2522 -404 -1507 N
-ATOM 4472 CA ARG M 217 -16.482 -34.155-109.060 1.00 60.94 C
-ANISOU 4472 CA ARG M 217 10437 7154 5561 2495 -280 -1383 C
-ATOM 4473 C ARG M 217 -17.539 -35.101-108.515 1.00 75.45 C
-ANISOU 4473 C ARG M 217 12352 8753 7561 2675 -160 -1108 C
-ATOM 4474 O ARG M 217 -18.292 -35.706-109.280 1.00 64.48 O
-ANISOU 4474 O ARG M 217 10869 7156 6472 2695 -89 -1053 O
-ATOM 4475 CB ARG M 217 -17.091 -32.775-109.353 1.00 59.79 C
-ANISOU 4475 CB ARG M 217 10472 6916 5330 2306 -112 -1486 C
-ATOM 4476 CG ARG M 217 -16.406 -32.063-110.508 1.00 79.66 C
-ANISOU 4476 CG ARG M 217 12847 9551 7870 2098 -186 -1699 C
-ATOM 4477 CD ARG M 217 -16.675 -30.570-110.553 1.00 70.03 C
-ANISOU 4477 CD ARG M 217 11891 8224 6492 1896 -54 -1791 C
-ATOM 4478 NE ARG M 217 -15.869 -29.957-111.606 1.00 80.00 N
-ANISOU 4478 NE ARG M 217 13001 9635 7762 1656 -146 -1943 N
-ATOM 4479 CZ ARG M 217 -15.738 -28.650-111.793 1.00 94.19 C
-ANISOU 4479 CZ ARG M 217 15019 11344 9426 1407 -85 -2034 C
-ATOM 4480 NH1 ARG M 217 -16.372 -27.797-111.003 1.00102.87 N1+
-ANISOU 4480 NH1 ARG M 217 16538 12176 10373 1409 75 -2033 N1+
-ATOM 4481 NH2 ARG M 217 -14.977 -28.196-112.781 1.00102.42 N
-ANISOU 4481 NH2 ARG M 217 15877 12559 10479 1165 -174 -2119 N
-ATOM 4482 N ARG M 218 -17.584 -35.243-107.195 1.00 74.78 N
-ANISOU 4482 N ARG M 218 12422 8734 7255 2774 -144 -928 N
-ATOM 4483 CA ARG M 218 -18.577 -36.084-106.544 1.00 74.38 C
-ANISOU 4483 CA ARG M 218 12445 8505 7311 2909 -19 -607 C
-ATOM 4484 C ARG M 218 -19.688 -35.204-105.994 1.00 78.84 C
-ANISOU 4484 C ARG M 218 13194 9060 7701 2873 216 -529 C
-ATOM 4485 O ARG M 218 -19.418 -34.192-105.341 1.00 95.05 O
-ANISOU 4485 O ARG M 218 15425 11272 9417 2841 240 -656 O
-ATOM 4486 CB ARG M 218 -17.958 -36.911-105.417 1.00 86.16 C
-ANISOU 4486 CB ARG M 218 13963 10123 8651 3096 -136 -388 C
-ATOM 4487 CG ARG M 218 -18.970 -37.709-104.607 1.00 91.53 C
-ANISOU 4487 CG ARG M 218 14737 10647 9395 3200 5 6 C
-ATOM 4488 CD ARG M 218 -18.268 -38.579-103.580 1.00110.21 C
-ANISOU 4488 CD ARG M 218 17118 13137 11618 3416 -120 266 C
-ATOM 4489 NE ARG M 218 -17.412 -39.582-104.206 1.00120.33 N
-ANISOU 4489 NE ARG M 218 18283 14287 13150 3563 -301 245 N
-ATOM 4490 CZ ARG M 218 -16.673 -40.456-103.532 1.00133.09 C
-ANISOU 4490 CZ ARG M 218 19894 15982 14693 3826 -427 477 C
-ATOM 4491 NH1 ARG M 218 -16.679 -40.449-102.205 1.00124.01 N
-ANISOU 4491 NH1 ARG M 218 18824 15081 13215 3932 -401 758 N
-ATOM 4492 NH2 ARG M 218 -15.922 -41.333-104.184 1.00146.96 N
-ANISOU 4492 NH2 ARG M 218 21565 17595 16677 4023 -571 432 N
-ATOM 4493 N LEU M 219 -20.931 -35.587-106.262 1.00 71.90 N
-ANISOU 4493 N LEU M 219 12274 8017 7028 2880 389 -333 N
-ATOM 4494 CA LEU M 219 -22.071 -34.849-105.739 1.00 78.58 C
-ANISOU 4494 CA LEU M 219 13247 8919 7689 2922 636 -212 C
-ATOM 4495 C LEU M 219 -22.271 -35.223-104.276 1.00 81.97 C
-ANISOU 4495 C LEU M 219 13791 9492 7863 3061 690 67 C
-ATOM 4496 O LEU M 219 -22.464 -36.402-103.956 1.00 82.48 O
-ANISOU 4496 O LEU M 219 13768 9490 8081 3090 659 364 O
-ATOM 4497 CB LEU M 219 -23.322 -35.155-106.556 1.00 81.40 C
-ANISOU 4497 CB LEU M 219 13439 9174 8316 2866 793 -69 C
-ATOM 4498 CG LEU M 219 -24.538 -34.273-106.289 1.00 80.46 C
-ANISOU 4498 CG LEU M 219 13383 9182 8006 2962 1069 42 C
-ATOM 4499 CD1 LEU M 219 -24.152 -32.809-106.410 1.00 74.00 C
-ANISOU 4499 CD1 LEU M 219 12783 8378 6957 3014 1117 -252 C
-ATOM 4500 CD2 LEU M 219 -25.641 -34.611-107.269 1.00 88.24 C
-ANISOU 4500 CD2 LEU M 219 14116 10162 9250 2873 1182 168 C
-ATOM 4501 N LYS M 220 -22.207 -34.227-103.391 1.00 77.11 N
-ANISOU 4501 N LYS M 220 13393 9060 6847 3141 769 -31 N
-ATOM 4502 CA LYS M 220 -22.390 -34.476-101.967 1.00 83.89 C
-ANISOU 4502 CA LYS M 220 14351 10141 7384 3293 828 212 C
-ATOM 4503 C LYS M 220 -23.759 -35.086-101.699 1.00 85.21 C
-ANISOU 4503 C LYS M 220 14412 10328 7638 3366 1047 618 C
-ATOM 4504 O LYS M 220 -24.732 -34.829-102.414 1.00 85.19 O
-ANISOU 4504 O LYS M 220 14319 10255 7794 3335 1212 644 O
-ATOM 4505 CB LYS M 220 -22.238 -33.182-101.164 1.00 89.74 C
-ANISOU 4505 CB LYS M 220 15376 11066 7656 3362 903 -34 C
-ATOM 4506 CG LYS M 220 -20.817 -32.658-101.058 1.00 86.43 C
-ANISOU 4506 CG LYS M 220 15062 10732 7043 3223 663 -380 C
-ATOM 4507 CD LYS M 220 -20.773 -31.365-100.256 1.00 75.82 C
-ANISOU 4507 CD LYS M 220 14065 9510 5235 3238 745 -660 C
-ATOM 4508 N GLU M 221 -23.826 -35.902-100.645 1.00 76.87 N
-ANISOU 4508 N GLU M 221 13337 9423 6448 3456 1047 969 N
-ATOM 4509 CA GLU M 221 -25.064 -36.593-100.307 1.00 97.46 C
-ANISOU 4509 CA GLU M 221 15814 12093 9123 3467 1240 1420 C
-ATOM 4510 C GLU M 221 -26.183 -35.630 -99.938 1.00101.12 C
-ANISOU 4510 C GLU M 221 16317 12823 9281 3610 1528 1445 C
-ATOM 4511 O GLU M 221 -27.355 -36.016 -99.980 1.00114.08 O
-ANISOU 4511 O GLU M 221 17775 14568 11002 3583 1714 1778 O
-ATOM 4512 CB GLU M 221 -24.821 -37.588 -99.168 1.00122.66 C
-ANISOU 4512 CB GLU M 221 19003 15416 12186 3544 1185 1828 C
-ATOM 4513 CG GLU M 221 -24.056 -37.025 -97.975 1.00143.97 C
-ANISOU 4513 CG GLU M 221 21869 18463 14371 3737 1129 1728 C
-ATOM 4514 CD GLU M 221 -22.551 -36.992 -98.195 1.00157.65 C
-ANISOU 4514 CD GLU M 221 23653 20136 16111 3716 841 1417 C
-ATOM 4515 OE1 GLU M 221 -22.096 -37.374 -99.295 1.00152.20 O
-ANISOU 4515 OE1 GLU M 221 22875 19130 15823 3595 700 1270 O
-ATOM 4516 OE2 GLU M 221 -21.824 -36.579 -97.268 1.00169.00 O
-ANISOU 4516 OE2 GLU M 221 25193 21901 17120 3821 754 1314 O
-ATOM 4517 N THR M 222 -25.853 -34.390 -99.579 1.00 95.30 N
-ANISOU 4517 N THR M 222 15820 12206 8184 3762 1571 1100 N
-ATOM 4518 CA THR M 222 -26.864 -33.360 -99.371 1.00 92.57 C
-ANISOU 4518 CA THR M 222 15570 12045 7557 3976 1855 1053 C
-ATOM 4519 C THR M 222 -27.275 -32.673-100.667 1.00 87.67 C
-ANISOU 4519 C THR M 222 14919 11206 7185 3937 1932 836 C
-ATOM 4520 O THR M 222 -28.086 -31.741-100.623 1.00 95.29 O
-ANISOU 4520 O THR M 222 15983 12289 7934 4172 2175 785 O
-ATOM 4521 CB THR M 222 -26.364 -32.316 -98.366 1.00 90.07 C
-ANISOU 4521 CB THR M 222 15604 11896 6722 4171 1879 751 C
-ATOM 4522 OG1 THR M 222 -25.069 -31.847 -98.761 1.00 92.77 O
-ANISOU 4522 OG1 THR M 222 16127 12007 7113 3994 1632 325 O
-ATOM 4523 CG2 THR M 222 -26.277 -32.912 -96.969 1.00 87.20 C
-ANISOU 4523 CG2 THR M 222 15226 11903 6005 4285 1876 1036 C
-ATOM 4524 N LYS M 223 -26.736 -33.106-101.808 1.00 91.26 N
-ANISOU 4524 N LYS M 223 15240 11375 8060 3690 1740 718 N
-ATOM 4525 CA LYS M 223 -27.079 -32.579-103.129 1.00 98.83 C
-ANISOU 4525 CA LYS M 223 16115 12170 9266 3630 1790 552 C
-ATOM 4526 C LYS M 223 -26.909 -31.066-103.219 1.00101.39 C
-ANISOU 4526 C LYS M 223 16760 12415 9348 3794 1889 207 C
-ATOM 4527 O LYS M 223 -27.516 -30.421-104.080 1.00111.15 O
-ANISOU 4527 O LYS M 223 17964 13596 10673 3872 2030 161 O
-ATOM 4528 CB LYS M 223 -28.509 -32.967-103.528 1.00 97.18 C
-ANISOU 4528 CB LYS M 223 15599 12145 9179 3654 1999 891 C
-ATOM 4529 CG LYS M 223 -28.776 -34.465-103.535 1.00 95.41 C
-ANISOU 4529 CG LYS M 223 15095 11923 9234 3409 1907 1236 C
-ATOM 4530 CD LYS M 223 -27.977 -35.172-104.616 1.00 87.43 C
-ANISOU 4530 CD LYS M 223 13994 10576 8648 3136 1647 1054 C
-ATOM 4531 N ASP M 224 -26.092 -30.476-102.347 1.00 93.79 N
-ANISOU 4531 N ASP M 224 16125 11442 8068 3839 1817 -32 N
-ATOM 4532 CA ASP M 224 -25.908 -29.032-102.325 1.00 98.92 C
-ANISOU 4532 CA ASP M 224 17172 11939 8475 3954 1909 -381 C
-ATOM 4533 C ASP M 224 -24.490 -28.620-102.704 1.00 91.55 C
-ANISOU 4533 C ASP M 224 16408 10780 7597 3658 1643 -751 C
-ATOM 4534 O ASP M 224 -24.081 -27.492-102.417 1.00 90.30 O
-ANISOU 4534 O ASP M 224 16624 10477 7210 3639 1650 -1058 O
-ATOM 4535 CB ASP M 224 -26.275 -28.469-100.951 1.00111.28 C
-ANISOU 4535 CB ASP M 224 19039 13704 9539 4243 2082 -411 C
-ATOM 4536 CG ASP M 224 -25.310 -28.901 -99.865 1.00120.98 C
-ANISOU 4536 CG ASP M 224 20345 15102 10519 4122 1875 -480 C
-ATOM 4537 OD1 ASP M 224 -24.685 -29.972-100.017 1.00130.21 O
-ANISOU 4537 OD1 ASP M 224 21239 16316 11921 3907 1652 -327 O
-ATOM 4538 OD2 ASP M 224 -25.179 -28.168 -98.860 1.00116.68 O1-
-ANISOU 4538 OD2 ASP M 224 20073 14648 9613 4216 1902 -669 O1-
-ATOM 4539 N GLY M 225 -23.731 -29.508-103.342 1.00 75.19 N
-ANISOU 4539 N GLY M 225 14050 8686 5835 3404 1399 -720 N
-ATOM 4540 CA GLY M 225 -22.407 -29.139-103.800 1.00 71.94 C
-ANISOU 4540 CA GLY M 225 13712 8158 5463 3124 1155 -1032 C
-ATOM 4541 C GLY M 225 -21.554 -30.293-104.282 1.00 71.69 C
-ANISOU 4541 C GLY M 225 13337 8199 5703 2946 894 -965 C
-ATOM 4542 O GLY M 225 -21.760 -31.440-103.876 1.00 71.02 O
-ANISOU 4542 O GLY M 225 13053 8227 5704 3031 861 -695 O
-ATOM 4543 N PHE M 226 -20.598 -30.003-105.158 1.00 79.11 N
-ANISOU 4543 N PHE M 226 14217 9070 6772 2714 718 -1193 N
-ATOM 4544 CA PHE M 226 -19.597 -30.970-105.580 1.00 83.54 C
-ANISOU 4544 CA PHE M 226 14478 9745 7517 2595 461 -1189 C
-ATOM 4545 C PHE M 226 -18.335 -30.814-104.739 1.00 84.14 C
-ANISOU 4545 C PHE M 226 14629 10064 7276 2472 246 -1348 C
-ATOM 4546 O PHE M 226 -18.124 -29.795-104.077 1.00 93.02 O
-ANISOU 4546 O PHE M 226 16054 11219 8068 2373 268 -1545 O
-ATOM 4547 CB PHE M 226 -19.252 -30.801-107.061 1.00 89.05 C
-ANISOU 4547 CB PHE M 226 14989 10350 8496 2433 393 -1328 C
-ATOM 4548 CG PHE M 226 -20.407 -31.037-107.990 1.00 94.74 C
-ANISOU 4548 CG PHE M 226 15566 10921 9509 2528 567 -1182 C
-ATOM 4549 CD1 PHE M 226 -21.249 -29.998-108.345 1.00 96.59 C
-ANISOU 4549 CD1 PHE M 226 15967 11028 9705 2577 786 -1197 C
-ATOM 4550 CD2 PHE M 226 -20.641 -32.293-108.521 1.00 90.17 C
-ANISOU 4550 CD2 PHE M 226 14694 10336 9229 2571 507 -1037 C
-ATOM 4551 CE1 PHE M 226 -22.306 -30.211-109.209 1.00 85.21 C
-ANISOU 4551 CE1 PHE M 226 14334 9555 8489 2667 936 -1044 C
-ATOM 4552 CE2 PHE M 226 -21.699 -32.511-109.385 1.00 75.89 C
-ANISOU 4552 CE2 PHE M 226 12726 8452 7655 2598 646 -927 C
-ATOM 4553 CZ PHE M 226 -22.531 -31.469-109.729 1.00 67.28 C
-ANISOU 4553 CZ PHE M 226 11735 7334 6494 2645 856 -920 C
-ATOM 4554 N MET M 227 -17.486 -31.838-104.781 1.00 80.36 N
-ANISOU 4554 N MET M 227 13877 9771 6885 2487 33 -1269 N
-ATOM 4555 CA MET M 227 -16.240 -31.819-104.030 1.00 79.94 C
-ANISOU 4555 CA MET M 227 13795 10066 6512 2396 -193 -1375 C
-ATOM 4556 C MET M 227 -15.177 -32.603-104.785 1.00 86.53 C
-ANISOU 4556 C MET M 227 14275 11078 7524 2383 -420 -1384 C
-ATOM 4557 O MET M 227 -15.481 -33.564-105.497 1.00 88.95 O
-ANISOU 4557 O MET M 227 14393 11220 8182 2547 -405 -1237 O
-ATOM 4558 CB MET M 227 -16.423 -32.396-102.622 1.00 98.53 C
-ANISOU 4558 CB MET M 227 16217 12616 8604 2609 -182 -1147 C
-ATOM 4559 CG MET M 227 -17.201 -33.707-102.575 1.00114.20 C
-ANISOU 4559 CG MET M 227 18065 14453 10873 2880 -92 -761 C
-ATOM 4560 SD MET M 227 -17.027 -34.573-100.997 1.00131.02 S
-ANISOU 4560 SD MET M 227 20193 16898 12691 3123 -145 -420 S
-ATOM 4561 CE MET M 227 -18.239 -35.881-101.175 1.00127.92 C
-ANISOU 4561 CE MET M 227 19722 16168 12713 3319 24 34 C
-ATOM 4562 N PHE M 228 -13.926 -32.174-104.628 1.00 88.59 N
-ANISOU 4562 N PHE M 228 14445 11701 7514 2182 -630 -1572 N
-ATOM 4563 CA PHE M 228 -12.771 -32.877-105.173 1.00 82.93 C
-ANISOU 4563 CA PHE M 228 13354 11300 6856 2222 -855 -1574 C
-ATOM 4564 C PHE M 228 -12.101 -33.650-104.045 1.00 92.78 C
-ANISOU 4564 C PHE M 228 14486 12936 7829 2440 -1008 -1393 C
-ATOM 4565 O PHE M 228 -11.707 -33.060-103.033 1.00 96.68 O
-ANISOU 4565 O PHE M 228 15091 13742 7903 2293 -1080 -1470 O
-ATOM 4566 CB PHE M 228 -11.777 -31.908-105.812 1.00 71.67 C
-ANISOU 4566 CB PHE M 228 11816 10135 5281 1837 -994 -1854 C
-ATOM 4567 CG PHE M 228 -12.296 -31.221-107.037 1.00 68.94 C
-ANISOU 4567 CG PHE M 228 11534 9456 5205 1653 -860 -1979 C
-ATOM 4568 CD1 PHE M 228 -12.547 -29.860-107.028 1.00 75.55 C
-ANISOU 4568 CD1 PHE M 228 12690 10107 5910 1321 -765 -2160 C
-ATOM 4569 CD2 PHE M 228 -12.520 -31.932-108.202 1.00 77.51 C
-ANISOU 4569 CD2 PHE M 228 12379 10414 6657 1826 -829 -1918 C
-ATOM 4570 CE1 PHE M 228 -13.018 -29.221-108.157 1.00 89.63 C
-ANISOU 4570 CE1 PHE M 228 14531 11599 7927 1192 -633 -2220 C
-ATOM 4571 CE2 PHE M 228 -12.991 -31.300-109.336 1.00 84.95 C
-ANISOU 4571 CE2 PHE M 228 13343 11129 7806 1672 -710 -2008 C
-ATOM 4572 CZ PHE M 228 -13.239 -29.943-109.315 1.00 89.79 C
-ANISOU 4572 CZ PHE M 228 14252 11576 8288 1367 -609 -2130 C
-ATOM 4573 N LEU M 229 -11.959 -34.963-104.227 1.00 86.55 N
-ANISOU 4573 N LEU M 229 13492 12131 7263 2796 -1059 -1158 N
-ATOM 4574 CA LEU M 229 -11.492 -35.808-103.135 1.00 86.09 C
-ANISOU 4574 CA LEU M 229 13355 12375 6979 3092 -1166 -893 C
-ATOM 4575 C LEU M 229 -9.981 -35.739-102.946 1.00 94.29 C
-ANISOU 4575 C LEU M 229 14079 14084 7662 3066 -1428 -978 C
-ATOM 4576 O LEU M 229 -9.498 -35.909-101.821 1.00112.73 O
-ANISOU 4576 O LEU M 229 16369 16846 9618 3175 -1534 -834 O
-ATOM 4577 CB LEU M 229 -11.932 -37.256-103.362 1.00 86.16 C
-ANISOU 4577 CB LEU M 229 13331 12034 7370 3498 -1109 -580 C
-ATOM 4578 CG LEU M 229 -13.351 -37.602-102.893 1.00 91.45 C
-ANISOU 4578 CG LEU M 229 14276 12243 8229 3566 -882 -326 C
-ATOM 4579 CD1 LEU M 229 -14.409 -37.050-103.839 1.00 92.73 C
-ANISOU 4579 CD1 LEU M 229 14556 11980 8697 3339 -697 -495 C
-ATOM 4580 CD2 LEU M 229 -13.518 -39.104-102.710 1.00 98.19 C
-ANISOU 4580 CD2 LEU M 229 15123 12845 9341 3938 -879 52 C
-ATOM 4581 N THR M 230 -9.222 -35.492-104.008 1.00 90.49 N
-ANISOU 4581 N THR M 230 13342 13783 7257 2924 -1537 -1189 N
-ATOM 4582 CA THR M 230 -7.770 -35.451-103.913 1.00100.50 C
-ANISOU 4582 CA THR M 230 14231 15784 8172 2893 -1786 -1247 C
-ATOM 4583 C THR M 230 -7.230 -34.349-104.812 1.00101.32 C
-ANISOU 4583 C THR M 230 14203 16083 8211 2401 -1851 -1571 C
-ATOM 4584 O THR M 230 -7.944 -33.784-105.645 1.00 95.60 O
-ANISOU 4584 O THR M 230 13663 14891 7771 2183 -1702 -1719 O
-ATOM 4585 CB THR M 230 -7.137 -36.797-104.298 1.00100.69 C
-ANISOU 4585 CB THR M 230 13942 15970 8346 3435 -1879 -1036 C
-ATOM 4586 OG1 THR M 230 -7.799 -37.330-105.455 1.00102.42 O
-ANISOU 4586 OG1 THR M 230 14230 15607 9077 3594 -1744 -1070 O
-ATOM 4587 CG2 THR M 230 -7.227 -37.792-103.148 1.00 87.92 C
-ANISOU 4587 CG2 THR M 230 12396 14389 6622 3887 -1887 -663 C
-ATOM 4588 N ASP M 231 -5.944 -34.044-104.629 1.00102.01 N
-ANISOU 4588 N ASP M 231 13943 16917 7897 2216 -2079 -1648 N
-ATOM 4589 CA ASP M 231 -5.236 -33.172-105.555 1.00 99.17 C
-ANISOU 4589 CA ASP M 231 13360 16852 7467 1755 -2169 -1888 C
-ATOM 4590 C ASP M 231 -5.118 -33.787-106.942 1.00102.96 C
-ANISOU 4590 C ASP M 231 13569 17245 8307 2020 -2132 -1876 C
-ATOM 4591 O ASP M 231 -4.779 -33.076-107.895 1.00108.51 O
-ANISOU 4591 O ASP M 231 14121 18074 9034 1657 -2150 -2044 O
-ATOM 4592 CB ASP M 231 -3.843 -32.850-105.003 1.00110.50 C
-ANISOU 4592 CB ASP M 231 14406 19223 8356 1500 -2439 -1928 C
-ATOM 4593 CG ASP M 231 -3.162 -31.720-105.752 1.00114.64 C
-ANISOU 4593 CG ASP M 231 14762 20056 8739 846 -2533 -2168 C
-ATOM 4594 N GLN M 232 -5.397 -35.085-107.075 1.00 96.59 N
-ANISOU 4594 N GLN M 232 12719 16211 7769 2633 -2079 -1683 N
-ATOM 4595 CA GLN M 232 -5.296 -35.801-108.338 1.00 98.07 C
-ANISOU 4595 CA GLN M 232 12685 16300 8277 2953 -2047 -1709 C
-ATOM 4596 C GLN M 232 -6.663 -36.153-108.918 1.00 96.70 C
-ANISOU 4596 C GLN M 232 12862 15275 8603 3075 -1825 -1716 C
-ATOM 4597 O GLN M 232 -6.780 -37.118-109.678 1.00 97.87 O
-ANISOU 4597 O GLN M 232 12929 15211 9045 3470 -1789 -1701 O
-ATOM 4598 CB GLN M 232 -4.450 -37.061-108.159 1.00103.69 C
-ANISOU 4598 CB GLN M 232 13081 17417 8899 3580 -2173 -1521 C
-ATOM 4599 CG GLN M 232 -3.034 -36.785-107.680 1.00112.25 C
-ANISOU 4599 CG GLN M 232 13706 19495 9449 3504 -2405 -1488 C
-ATOM 4600 CD GLN M 232 -2.235 -38.051-107.457 1.00129.43 C
-ANISOU 4600 CD GLN M 232 15576 22085 11515 4230 -2508 -1257 C
-ATOM 4601 OE1 GLN M 232 -2.796 -39.132-107.280 1.00126.91 O
-ANISOU 4601 OE1 GLN M 232 15507 21222 11491 4768 -2411 -1077 O
-ATOM 4602 NE2 GLN M 232 -0.914 -37.924-107.476 1.00143.96 N
-ANISOU 4602 NE2 GLN M 232 16874 24902 12923 4253 -2703 -1242 N
-ATOM 4603 N SER M 233 -7.700 -35.397-108.564 1.00 99.82 N
-ANISOU 4603 N SER M 233 13644 15206 9078 2753 -1674 -1748 N
-ATOM 4604 CA SER M 233 -9.007 -35.546-109.189 1.00 77.65 C
-ANISOU 4604 CA SER M 233 11101 11710 6690 2787 -1464 -1757 C
-ATOM 4605 C SER M 233 -9.165 -34.674-110.424 1.00 71.35 C
-ANISOU 4605 C SER M 233 10239 10858 6014 2453 -1398 -1965 C
-ATOM 4606 O SER M 233 -10.173 -34.798-111.129 1.00 77.36 O
-ANISOU 4606 O SER M 233 11135 11158 7101 2488 -1240 -1983 O
-ATOM 4607 CB SER M 233 -10.124 -35.212-108.191 1.00 70.99 C
-ANISOU 4607 CB SER M 233 10675 10450 5849 2691 -1308 -1643 C
-ATOM 4608 OG SER M 233 -10.207 -36.182-107.162 1.00 85.57 O
-ANISOU 4608 OG SER M 233 12595 12263 7653 3043 -1329 -1388 O
-ATOM 4609 N TYR M 234 -8.199 -33.802-110.703 1.00 78.77 N
-ANISOU 4609 N TYR M 234 13289 10286 6353 854 -2070 -3058 N
-ATOM 4610 CA TYR M 234 -8.288 -32.885-111.826 1.00 85.04 C
-ANISOU 4610 CA TYR M 234 13732 11136 7444 717 -1917 -3068 C
-ATOM 4611 C TYR M 234 -6.924 -32.750-112.484 1.00 92.86 C
-ANISOU 4611 C TYR M 234 14249 12346 8687 473 -2322 -3120 C
-ATOM 4612 O TYR M 234 -5.886 -32.799-111.819 1.00104.86 O
-ANISOU 4612 O TYR M 234 15853 13886 10104 367 -2770 -3210 O
-ATOM 4613 CB TYR M 234 -8.801 -31.506-111.387 1.00 87.14 C
-ANISOU 4613 CB TYR M 234 14486 11105 7518 670 -1778 -3164 C
-ATOM 4614 CG TYR M 234 -8.067 -30.928-110.199 1.00 93.02 C
-ANISOU 4614 CG TYR M 234 15771 11645 7927 546 -2162 -3308 C
-ATOM 4615 CD1 TYR M 234 -8.541 -31.112-108.907 1.00 85.65 C
-ANISOU 4615 CD1 TYR M 234 15466 10513 6565 707 -2091 -3356 C
-ATOM 4616 CD2 TYR M 234 -6.902 -30.193-110.370 1.00105.51 C
-ANISOU 4616 CD2 TYR M 234 17249 13238 9604 235 -2597 -3395 C
-ATOM 4617 CE1 TYR M 234 -7.871 -30.584-107.819 1.00103.72 C
-ANISOU 4617 CE1 TYR M 234 18303 12596 8512 589 -2475 -3495 C
-ATOM 4618 CE2 TYR M 234 -6.226 -29.661-109.290 1.00111.76 C
-ANISOU 4618 CE2 TYR M 234 18541 13830 10092 96 -2998 -3530 C
-ATOM 4619 CZ TYR M 234 -6.712 -29.858-108.017 1.00107.83 C
-ANISOU 4619 CZ TYR M 234 18702 13113 9155 287 -2951 -3583 C
-ATOM 4620 OH TYR M 234 -6.036 -29.330-106.940 1.00107.50 O
-ANISOU 4620 OH TYR M 234 19053 12890 8900 132 -3288 -3638 O
-ATOM 4621 N ILE M 235 -6.945 -32.578-113.803 1.00 86.53 N
-ANISOU 4621 N ILE M 235 12941 11726 8211 376 -2157 -3066 N
-ATOM 4622 CA ILE M 235 -5.748 -32.392-114.614 1.00 82.38 C
-ANISOU 4622 CA ILE M 235 11896 11466 7940 109 -2424 -3111 C
-ATOM 4623 C ILE M 235 -5.926 -31.106-115.404 1.00 96.94 C
-ANISOU 4623 C ILE M 235 13731 13219 9884 -151 -2276 -3094 C
-ATOM 4624 O ILE M 235 -6.886 -30.976-116.174 1.00107.27 O
-ANISOU 4624 O ILE M 235 14985 14481 11293 -56 -1915 -2997 O
-ATOM 4625 CB ILE M 235 -5.510 -33.574-115.564 1.00 79.40 C
-ANISOU 4625 CB ILE M 235 10910 11427 7832 231 -2364 -3058 C
-ATOM 4626 CG1 ILE M 235 -5.199 -34.844-114.777 1.00 73.94 C
-ANISOU 4626 CG1 ILE M 235 10268 10782 7046 483 -2602 -3079 C
-ATOM 4627 CG2 ILE M 235 -4.398 -33.253-116.543 1.00 85.86 C
-ANISOU 4627 CG2 ILE M 235 11156 12559 8908 -59 -2518 -3116 C
-ATOM 4628 CD1 ILE M 235 -5.246 -36.090-115.623 1.00 71.65 C
-ANISOU 4628 CD1 ILE M 235 9519 10726 6978 685 -2501 -3029 C
-ATOM 4629 N ASP M 236 -5.009 -30.164-115.224 1.00 94.01 N
-ANISOU 4629 N ASP M 236 13429 12807 9484 -493 -2585 -3180 N
-ATOM 4630 CA ASP M 236 -5.090 -28.867-115.876 1.00 99.38 C
-ANISOU 4630 CA ASP M 236 14209 13335 10217 -794 -2514 -3157 C
-ATOM 4631 C ASP M 236 -3.970 -28.707-116.896 1.00 92.73 C
-ANISOU 4631 C ASP M 236 12782 12833 9620 -1190 -2657 -3147 C
-ATOM 4632 O ASP M 236 -3.016 -29.486-116.946 1.00 97.02 O
-ANISOU 4632 O ASP M 236 12844 13731 10290 -1226 -2859 -3205 O
-ATOM 4633 CB ASP M 236 -5.028 -27.734-114.845 1.00123.67 C
-ANISOU 4633 CB ASP M 236 17947 16018 13023 -933 -2736 -3260 C
-ATOM 4634 CG ASP M 236 -6.190 -27.767-113.876 1.00136.11 C
-ANISOU 4634 CG ASP M 236 20119 17270 14325 -547 -2517 -3292 C
-ATOM 4635 OD1 ASP M 236 -6.001 -27.394-112.699 1.00140.79 O
-ANISOU 4635 OD1 ASP M 236 21241 17624 14626 -550 -2744 -3413 O
-ATOM 4636 OD2 ASP M 236 -7.295 -28.167-114.296 1.00136.35 O1-
-ANISOU 4636 OD2 ASP M 236 20083 17301 14423 -253 -2114 -3204 O1-
-ATOM 4637 N VAL M 237 -4.113 -27.683-117.718 1.00 92.53 N
-ANISOU 4637 N VAL M 237 12812 12695 9652 -1480 -2544 -3077 N
-ATOM 4638 CA VAL M 237 -3.073 -27.254-118.642 1.00 88.85 C
-ANISOU 4638 CA VAL M 237 11901 12505 9352 -1968 -2651 -3058 C
-ATOM 4639 C VAL M 237 -2.226 -26.201-117.944 1.00104.42 C
-ANISOU 4639 C VAL M 237 14168 14299 11207 -2394 -3041 -3144 C
-ATOM 4640 O VAL M 237 -2.748 -25.372-117.189 1.00117.69 O
-ANISOU 4640 O VAL M 237 16523 15519 12674 -2361 -3124 -3176 O
-ATOM 4641 CB VAL M 237 -3.693 -26.711-119.945 1.00 80.90 C
-ANISOU 4641 CB VAL M 237 10867 11441 8430 -2100 -2339 -2905 C
-ATOM 4642 CG1 VAL M 237 -2.617 -26.236-120.899 1.00 83.56 C
-ANISOU 4642 CG1 VAL M 237 10790 12073 8886 -2666 -2407 -2870 C
-ATOM 4643 CG2 VAL M 237 -4.549 -27.780-120.603 1.00 76.51 C
-ANISOU 4643 CG2 VAL M 237 10037 11049 7985 -1687 -1997 -2828 C
-ATOM 4644 N LEU M 238 -0.915 -26.243-118.176 1.00108.72 N
-ANISOU 4644 N LEU M 238 14200 15215 11892 -2789 -3287 -3201 N
-ATOM 4645 CA LEU M 238 -0.016 -25.293-117.540 1.00118.76 C
-ANISOU 4645 CA LEU M 238 15683 16359 13080 -3259 -3705 -3283 C
-ATOM 4646 C LEU M 238 -0.388 -23.861-117.925 1.00120.43 C
-ANISOU 4646 C LEU M 238 16424 16151 13182 -3638 -3661 -3188 C
-ATOM 4647 O LEU M 238 -0.860 -23.610-119.039 1.00122.58 O
-ANISOU 4647 O LEU M 238 16618 16428 13528 -3721 -3347 -3046 O
-ATOM 4648 CB LEU M 238 1.434 -25.574-117.926 1.00119.55 C
-ANISOU 4648 CB LEU M 238 15009 17007 13407 -3660 -3923 -3350 C
-ATOM 4649 CG LEU M 238 2.090 -26.777-117.251 1.00110.83 C
-ANISOU 4649 CG LEU M 238 13466 16244 12399 -3338 -4177 -3494 C
-ATOM 4650 CD1 LEU M 238 3.593 -26.762-117.483 1.00106.70 C
-ANISOU 4650 CD1 LEU M 238 12215 16221 12106 -3788 -4473 -3597 C
-ATOM 4651 CD2 LEU M 238 1.767 -26.795-115.766 1.00103.85 C
-ANISOU 4651 CD2 LEU M 238 13244 14960 11254 -3054 -4490 -3577 C
-ATOM 4652 N PRO M 239 -0.190 -22.904-117.015 1.00111.87 N
-ANISOU 4652 N PRO M 239 15936 14666 11904 -3865 -4004 -3267 N
-ATOM 4653 CA PRO M 239 -0.566 -21.514-117.318 1.00122.97 C
-ANISOU 4653 CA PRO M 239 17946 15588 13188 -4194 -4013 -3188 C
-ATOM 4654 C PRO M 239 0.134 -20.942-118.538 1.00138.52 C
-ANISOU 4654 C PRO M 239 19544 17775 15310 -4840 -3974 -3051 C
-ATOM 4655 O PRO M 239 -0.426 -20.059-119.202 1.00146.25 O
-ANISOU 4655 O PRO M 239 20934 18408 16228 -5008 -3844 -2919 O
-ATOM 4656 CB PRO M 239 -0.174 -20.764-116.038 1.00120.43 C
-ANISOU 4656 CB PRO M 239 18238 14880 12638 -4369 -4475 -3340 C
-ATOM 4657 CG PRO M 239 -0.211 -21.807-114.971 1.00114.84 C
-ANISOU 4657 CG PRO M 239 17476 14309 11849 -3884 -4568 -3475 C
-ATOM 4658 CD PRO M 239 0.263 -23.067-115.624 1.00103.39 C
-ANISOU 4658 CD PRO M 239 15118 13494 10674 -3770 -4412 -3434 C
-ATOM 4659 N GLU M 240 1.340 -21.414-118.859 1.00135.32 N
-ANISOU 4659 N GLU M 240 18380 17940 15096 -5206 -4082 -3079 N
-ATOM 4660 CA GLU M 240 2.026 -20.930-120.051 1.00133.23 C
-ANISOU 4660 CA GLU M 240 17712 17956 14953 -5855 -3976 -2948 C
-ATOM 4661 C GLU M 240 1.401 -21.466-121.332 1.00131.77 C
-ANISOU 4661 C GLU M 240 17208 18000 14860 -5643 -3480 -2804 C
-ATOM 4662 O GLU M 240 1.588 -20.867-122.397 1.00133.14 O
-ANISOU 4662 O GLU M 240 17321 18230 15037 -6133 -3325 -2649 O
-ATOM 4663 CB GLU M 240 3.509 -21.305-119.994 1.00129.95 C
-ANISOU 4663 CB GLU M 240 16495 18127 14755 -6225 -4178 -3036 C
-ATOM 4664 N PHE M 241 0.655 -22.567-121.251 1.00130.09 N
-ANISOU 4664 N PHE M 241 16836 17896 14695 -4955 -3246 -2842 N
-ATOM 4665 CA PHE M 241 0.072 -23.214-122.419 1.00123.54 C
-ANISOU 4665 CA PHE M 241 15682 17302 13956 -4720 -2815 -2728 C
-ATOM 4666 C PHE M 241 -1.439 -23.026-122.505 1.00118.78 C
-ANISOU 4666 C PHE M 241 15680 16208 13243 -4253 -2609 -2629 C
-ATOM 4667 O PHE M 241 -2.094 -23.719-123.290 1.00115.11 O
-ANISOU 4667 O PHE M 241 14988 15899 12851 -3937 -2290 -2553 O
-ATOM 4668 CB PHE M 241 0.413 -24.706-122.414 1.00110.97 C
-ANISOU 4668 CB PHE M 241 13375 16252 12538 -4319 -2707 -2847 C
-ATOM 4669 CG PHE M 241 1.886 -24.991-122.334 1.00111.64 C
-ANISOU 4669 CG PHE M 241 12770 16871 12778 -4681 -2914 -2980 C
-ATOM 4670 CD1 PHE M 241 2.354 -26.085-121.625 1.00112.30 C
-ANISOU 4670 CD1 PHE M 241 12436 17252 12980 -4297 -3087 -3154 C
-ATOM 4671 CD2 PHE M 241 2.802 -24.170-122.970 1.00118.74 C
-ANISOU 4671 CD2 PHE M 241 13429 17979 13708 -5412 -2945 -2928 C
-ATOM 4672 CE1 PHE M 241 3.708 -26.351-121.548 1.00118.82 C
-ANISOU 4672 CE1 PHE M 241 12575 18586 13986 -4579 -3309 -3298 C
-ATOM 4673 CE2 PHE M 241 4.157 -24.431-122.897 1.00129.90 C
-ANISOU 4673 CE2 PHE M 241 14122 19936 15298 -5748 -3122 -3066 C
-ATOM 4674 CZ PHE M 241 4.610 -25.524-122.185 1.00127.07 C
-ANISOU 4674 CZ PHE M 241 13312 19875 15094 -5292 -3310 -3257 C
-ATOM 4675 N ARG M 242 -2.009 -22.109-121.718 1.00120.20 N
-ANISOU 4675 N ARG M 242 16611 15805 13256 -4189 -2793 -2645 N
-ATOM 4676 CA ARG M 242 -3.453 -21.898-121.754 1.00112.81 C
-ANISOU 4676 CA ARG M 242 16195 14425 12243 -3706 -2600 -2582 C
-ATOM 4677 C ARG M 242 -3.910 -21.373-123.107 1.00115.32 C
-ANISOU 4677 C ARG M 242 16588 14645 12584 -3901 -2404 -2380 C
-ATOM 4678 O ARG M 242 -5.047 -21.627-123.522 1.00114.40 O
-ANISOU 4678 O ARG M 242 16582 14388 12497 -3460 -2173 -2309 O
-ATOM 4679 CB ARG M 242 -3.870 -20.929-120.649 1.00112.00 C
-ANISOU 4679 CB ARG M 242 16888 13723 11946 -3611 -2842 -2678 C
-ATOM 4680 N ASP M 243 -3.045 -20.642-123.804 1.00122.04 N
-ANISOU 4680 N ASP M 243 17389 15570 13413 -4580 -2506 -2279 N
-ATOM 4681 CA ASP M 243 -3.352 -20.083-125.114 1.00125.03 C
-ANISOU 4681 CA ASP M 243 17903 15845 13758 -4861 -2358 -2064 C
-ATOM 4682 C ASP M 243 -2.753 -20.888-126.257 1.00125.10 C
-ANISOU 4682 C ASP M 243 17180 16489 13865 -5092 -2085 -1990 C
-ATOM 4683 O ASP M 243 -3.421 -21.104-127.272 1.00125.09 O
-ANISOU 4683 O ASP M 243 17159 16509 13862 -4950 -1848 -1854 O
-ATOM 4684 CB ASP M 243 -2.851 -18.638-125.191 1.00132.77 C
-ANISOU 4684 CB ASP M 243 19434 16423 14590 -5525 -2638 -1969 C
-ATOM 4685 CG ASP M 243 -1.487 -18.463-124.546 1.00142.87 C
-ANISOU 4685 CG ASP M 243 20462 17947 15877 -6071 -2897 -2081 C
-ATOM 4686 OD1 ASP M 243 -1.303 -18.929-123.401 1.00136.39 O
-ANISOU 4686 OD1 ASP M 243 19546 17186 15089 -5772 -3050 -2278 O
-ATOM 4687 OD2 ASP M 243 -0.598 -17.862-125.184 1.00155.26 O1-
-ANISOU 4687 OD2 ASP M 243 21928 19656 17409 -6818 -2957 -1967 O1-
-ATOM 4688 N SER M 244 -1.508 -21.346-126.110 1.00127.65 N
-ANISOU 4688 N SER M 244 16895 17336 14271 -5425 -2124 -2097 N
-ATOM 4689 CA SER M 244 -0.832 -22.048-127.194 1.00131.70 C
-ANISOU 4689 CA SER M 244 16695 18482 14865 -5665 -1846 -2067 C
-ATOM 4690 C SER M 244 -1.341 -23.470-127.382 1.00128.26 C
-ANISOU 4690 C SER M 244 15809 18369 14555 -5012 -1593 -2151 C
-ATOM 4691 O SER M 244 -1.155 -24.041-128.462 1.00130.49 O
-ANISOU 4691 O SER M 244 15657 19061 14863 -5083 -1311 -2109 O
-ATOM 4692 CB SER M 244 0.677 -22.076-126.944 1.00141.57 C
-ANISOU 4692 CB SER M 244 17375 20218 16198 -6196 -1977 -2187 C
-ATOM 4693 OG SER M 244 0.979 -22.705-125.710 1.00142.19 O
-ANISOU 4693 OG SER M 244 17244 20391 16392 -5831 -2207 -2401 O
-ATOM 4694 N TYR M 245 -1.975 -24.053-126.366 1.00116.97 N
-ANISOU 4694 N TYR M 245 14506 16757 13179 -4403 -1682 -2267 N
-ATOM 4695 CA TYR M 245 -2.429 -25.443-126.408 1.00101.54 C
-ANISOU 4695 CA TYR M 245 12165 15074 11343 -3811 -1488 -2347 C
-ATOM 4696 C TYR M 245 -3.913 -25.503-126.071 1.00 91.90 C
-ANISOU 4696 C TYR M 245 11441 13393 10085 -3259 -1428 -2290 C
-ATOM 4697 O TYR M 245 -4.291 -25.776-124.923 1.00 88.53 O
-ANISOU 4697 O TYR M 245 11211 12775 9654 -2880 -1544 -2392 O
-ATOM 4698 CB TYR M 245 -1.614 -26.316-125.454 1.00 93.10 C
-ANISOU 4698 CB TYR M 245 10657 14331 10387 -3627 -1657 -2556 C
-ATOM 4699 CG TYR M 245 -1.648 -27.784-125.799 1.00 94.06 C
-ANISOU 4699 CG TYR M 245 10240 14858 10640 -3190 -1467 -2642 C
-ATOM 4700 CD1 TYR M 245 -0.697 -28.337-126.642 1.00 83.05 C
-ANISOU 4700 CD1 TYR M 245 8180 14028 9347 -3389 -1328 -2715 C
-ATOM 4701 CD2 TYR M 245 -2.632 -28.616-125.285 1.00101.59 C
-ANISOU 4701 CD2 TYR M 245 11367 15626 11608 -2587 -1419 -2659 C
-ATOM 4702 CE1 TYR M 245 -0.723 -29.678-126.964 1.00 94.45 C
-ANISOU 4702 CE1 TYR M 245 9184 15799 10902 -2958 -1178 -2818 C
-ATOM 4703 CE2 TYR M 245 -2.666 -29.959-125.601 1.00102.45 C
-ANISOU 4703 CE2 TYR M 245 11048 16051 11827 -2211 -1283 -2732 C
-ATOM 4704 CZ TYR M 245 -1.710 -30.483-126.443 1.00 97.16 C
-ANISOU 4704 CZ TYR M 245 9762 15899 11257 -2377 -1179 -2818 C
-ATOM 4705 OH TYR M 245 -1.737 -31.821-126.762 1.00 96.17 O
-ANISOU 4705 OH TYR M 245 9260 16047 11233 -1971 -1066 -2915 O
-ATOM 4706 N PRO M 246 -4.782 -25.248-127.044 1.00 87.75 N
-ANISOU 4706 N PRO M 246 11123 12693 9526 -3209 -1249 -2128 N
-ATOM 4707 CA PRO M 246 -6.218 -25.439-126.820 1.00 82.37 C
-ANISOU 4707 CA PRO M 246 10772 11664 8862 -2655 -1166 -2087 C
-ATOM 4708 C PRO M 246 -6.591 -26.908-126.897 1.00 81.39 C
-ANISOU 4708 C PRO M 246 10212 11853 8858 -2197 -979 -2147 C
-ATOM 4709 O PRO M 246 -5.954 -27.702-127.593 1.00105.29 O
-ANISOU 4709 O PRO M 246 12738 15323 11943 -2292 -863 -2177 O
-ATOM 4710 CB PRO M 246 -6.869 -24.645-127.962 1.00 75.88 C
-ANISOU 4710 CB PRO M 246 10270 10585 7976 -2819 -1100 -1889 C
-ATOM 4711 CG PRO M 246 -5.756 -23.843-128.590 1.00 84.39 C
-ANISOU 4711 CG PRO M 246 11336 11781 8949 -3522 -1174 -1814 C
-ATOM 4712 CD PRO M 246 -4.512 -24.629-128.350 1.00 87.79 C
-ANISOU 4712 CD PRO M 246 11138 12768 9452 -3699 -1146 -1965 C
-ATOM 4713 N ILE M 247 -7.641 -27.267-126.160 1.00 68.93 N
-ANISOU 4713 N ILE M 247 8846 10036 7309 -1702 -944 -2175 N
-ATOM 4714 CA ILE M 247 -8.141 -28.638-126.133 1.00 65.58 C
-ANISOU 4714 CA ILE M 247 8103 9827 6986 -1278 -789 -2211 C
-ATOM 4715 C ILE M 247 -9.662 -28.593-126.210 1.00 66.00 C
-ANISOU 4715 C ILE M 247 8425 9575 7077 -903 -658 -2121 C
-ATOM 4716 O ILE M 247 -10.316 -28.088-125.292 1.00 64.03 O
-ANISOU 4716 O ILE M 247 8548 8996 6782 -693 -691 -2154 O
-ATOM 4717 CB ILE M 247 -7.700 -29.404-124.874 1.00 73.66 C
-ANISOU 4717 CB ILE M 247 9021 10960 8006 -1069 -895 -2364 C
-ATOM 4718 CG1 ILE M 247 -6.175 -29.435-124.752 1.00 77.22 C
-ANISOU 4718 CG1 ILE M 247 9150 11731 8459 -1413 -1076 -2474 C
-ATOM 4719 CG2 ILE M 247 -8.260 -30.807-124.903 1.00 70.60 C
-ANISOU 4719 CG2 ILE M 247 8378 10739 7707 -668 -751 -2375 C
-ATOM 4720 CD1 ILE M 247 -5.670 -30.227-123.557 1.00 79.98 C
-ANISOU 4720 CD1 ILE M 247 9398 12185 8804 -1195 -1254 -2622 C
-ATOM 4721 N LYS M 248 -10.226 -29.126-127.292 1.00 65.23 N
-ANISOU 4721 N LYS M 248 8126 9598 7061 -811 -512 -2022 N
-ATOM 4722 CA LYS M 248 -11.671 -29.177-127.481 1.00 68.38 C
-ANISOU 4722 CA LYS M 248 8675 9766 7539 -464 -409 -1936 C
-ATOM 4723 C LYS M 248 -12.145 -30.616-127.332 1.00 64.25 C
-ANISOU 4723 C LYS M 248 7838 9455 7117 -139 -275 -1967 C
-ATOM 4724 O LYS M 248 -11.675 -31.506-128.048 1.00 67.05 O
-ANISOU 4724 O LYS M 248 7854 10117 7505 -203 -233 -1974 O
-ATOM 4725 CB LYS M 248 -12.073 -28.611-128.842 1.00 79.73 C
-ANISOU 4725 CB LYS M 248 10197 11115 8983 -621 -410 -1779 C
-ATOM 4726 CG LYS M 248 -12.424 -27.133-128.796 1.00 99.62 C
-ANISOU 4726 CG LYS M 248 13213 13200 11438 -718 -549 -1712 C
-ATOM 4727 CD LYS M 248 -13.090 -26.677-130.082 1.00113.08 C
-ANISOU 4727 CD LYS M 248 15057 14754 13154 -769 -586 -1539 C
-ATOM 4728 CE LYS M 248 -13.676 -25.283-129.923 1.00111.23 C
-ANISOU 4728 CE LYS M 248 15364 14009 12890 -725 -760 -1484 C
-ATOM 4729 NZ LYS M 248 -14.736 -25.251-128.877 1.00102.13 N1+
-ANISOU 4729 NZ LYS M 248 14322 12627 11857 -212 -716 -1591 N1+
-ATOM 4730 N TYR M 249 -13.083 -30.835-126.414 1.00 60.93 N
-ANISOU 4730 N TYR M 249 7554 8864 6733 198 -200 -1992 N
-ATOM 4731 CA TYR M 249 -13.523 -32.172-126.030 1.00 63.46 C
-ANISOU 4731 CA TYR M 249 7655 9338 7119 461 -87 -2014 C
-ATOM 4732 C TYR M 249 -14.766 -32.539-126.836 1.00 68.49 C
-ANISOU 4732 C TYR M 249 8177 9944 7903 642 30 -1900 C
-ATOM 4733 O TYR M 249 -15.833 -31.943-126.656 1.00 74.77 O
-ANISOU 4733 O TYR M 249 9136 10511 8760 823 94 -1859 O
-ATOM 4734 CB TYR M 249 -13.780 -32.227-124.525 1.00 67.19 C
-ANISOU 4734 CB TYR M 249 8354 9672 7504 659 -51 -2098 C
-ATOM 4735 CG TYR M 249 -12.542 -31.904-123.710 1.00 73.33 C
-ANISOU 4735 CG TYR M 249 9259 10472 8131 476 -230 -2214 C
-ATOM 4736 CD1 TYR M 249 -12.212 -30.592-123.397 1.00 80.28 C
-ANISOU 4736 CD1 TYR M 249 10461 11129 8913 306 -347 -2254 C
-ATOM 4737 CD2 TYR M 249 -11.694 -32.911-123.272 1.00 74.55 C
-ANISOU 4737 CD2 TYR M 249 9224 10853 8250 473 -326 -2287 C
-ATOM 4738 CE1 TYR M 249 -11.076 -30.294-122.664 1.00 85.23 C
-ANISOU 4738 CE1 TYR M 249 11192 11779 9412 102 -551 -2360 C
-ATOM 4739 CE2 TYR M 249 -10.556 -32.622-122.538 1.00 81.44 C
-ANISOU 4739 CE2 TYR M 249 10174 11760 9008 311 -541 -2397 C
-ATOM 4740 CZ TYR M 249 -10.253 -31.313-122.235 1.00 85.69 C
-ANISOU 4740 CZ TYR M 249 11008 12096 9453 107 -651 -2431 C
-ATOM 4741 OH TYR M 249 -9.120 -31.020-121.507 1.00 88.04 O
-ANISOU 4741 OH TYR M 249 11377 12430 9646 -89 -902 -2541 O
-ATOM 4742 N VAL M 250 -14.625 -33.526-127.717 1.00 65.88 N
-ANISOU 4742 N VAL M 250 7557 9844 7632 609 43 -1867 N
-ATOM 4743 CA VAL M 250 -15.677 -33.863-128.674 1.00 60.30 C
-ANISOU 4743 CA VAL M 250 6735 9121 7054 713 93 -1755 C
-ATOM 4744 C VAL M 250 -16.685 -34.837-128.083 1.00 61.84 C
-ANISOU 4744 C VAL M 250 6828 9312 7358 973 209 -1740 C
-ATOM 4745 O VAL M 250 -17.895 -34.605-128.142 1.00 73.11 O
-ANISOU 4745 O VAL M 250 8261 10608 8911 1133 276 -1669 O
-ATOM 4746 CB VAL M 250 -15.053 -34.428-129.966 1.00 56.98 C
-ANISOU 4746 CB VAL M 250 6106 8934 6609 532 48 -1739 C
-ATOM 4747 CG1 VAL M 250 -16.144 -34.767-130.966 1.00 54.64 C
-ANISOU 4747 CG1 VAL M 250 5738 8598 6424 623 48 -1625 C
-ATOM 4748 CG2 VAL M 250 -14.065 -33.439-130.553 1.00 58.77 C
-ANISOU 4748 CG2 VAL M 250 6426 9196 6707 210 -22 -1739 C
-ATOM 4749 N HIS M 251 -16.220 -35.951-127.523 1.00 55.87 N
-ANISOU 4749 N HIS M 251 5971 8699 6559 1012 224 -1802 N
-ATOM 4750 CA HIS M 251 -17.129 -36.969-127.015 1.00 55.84 C
-ANISOU 4750 CA HIS M 251 5900 8687 6629 1185 331 -1762 C
-ATOM 4751 C HIS M 251 -16.599 -37.495-125.690 1.00 65.61 C
-ANISOU 4751 C HIS M 251 7268 9930 7731 1238 342 -1839 C
-ATOM 4752 O HIS M 251 -15.455 -37.241-125.308 1.00 80.35 O
-ANISOU 4752 O HIS M 251 9212 11843 9477 1155 223 -1934 O
-ATOM 4753 CB HIS M 251 -17.303 -38.114-128.023 1.00 60.23 C
-ANISOU 4753 CB HIS M 251 6239 9372 7273 1168 282 -1716 C
-ATOM 4754 CG HIS M 251 -18.511 -38.968-127.778 1.00 67.80 C
-ANISOU 4754 CG HIS M 251 7123 10288 8350 1278 378 -1631 C
-ATOM 4755 ND1 HIS M 251 -19.679 -38.474-127.238 1.00 80.29 N
-ANISOU 4755 ND1 HIS M 251 8719 11762 10026 1383 532 -1570 N
-ATOM 4756 CD2 HIS M 251 -18.731 -40.285-128.007 1.00 60.23 C
-ANISOU 4756 CD2 HIS M 251 6069 9383 7432 1282 344 -1601 C
-ATOM 4757 CE1 HIS M 251 -20.565 -39.450-127.143 1.00 74.23 C
-ANISOU 4757 CE1 HIS M 251 7827 11019 9360 1409 606 -1495 C
-ATOM 4758 NE2 HIS M 251 -20.015 -40.559-127.603 1.00 61.93 N
-ANISOU 4758 NE2 HIS M 251 6232 9533 7766 1334 477 -1502 N
-ATOM 4759 N ALA M 252 -17.453 -38.231-124.981 1.00 50.50 N
-ANISOU 4759 N ALA M 252 5386 7971 5831 1355 472 -1788 N
-ATOM 4760 CA ALA M 252 -17.058 -38.877-123.737 1.00 51.74 C
-ANISOU 4760 CA ALA M 252 5729 8107 5822 1396 469 -1830 C
-ATOM 4761 C ALA M 252 -18.032 -40.007-123.456 1.00 59.47 C
-ANISOU 4761 C ALA M 252 6679 9074 6843 1443 598 -1728 C
-ATOM 4762 O ALA M 252 -19.248 -39.805-123.529 1.00 75.01 O
-ANISOU 4762 O ALA M 252 8559 11014 8928 1480 794 -1650 O
-ATOM 4763 CB ALA M 252 -17.039 -37.881-122.572 1.00 52.85 C
-ANISOU 4763 CB ALA M 252 6158 8119 5805 1437 551 -1894 C
-ATOM 4764 N PHE M 253 -17.503 -41.188-123.143 1.00 56.68 N
-ANISOU 4764 N PHE M 253 6396 8737 6403 1437 470 -1730 N
-ATOM 4765 CA PHE M 253 -18.349 -42.342-122.875 1.00 63.88 C
-ANISOU 4765 CA PHE M 253 7339 9605 7329 1421 558 -1615 C
-ATOM 4766 C PHE M 253 -17.667 -43.242-121.855 1.00 69.89 C
-ANISOU 4766 C PHE M 253 8394 10289 7874 1438 421 -1628 C
-ATOM 4767 O PHE M 253 -16.498 -43.057-121.508 1.00 69.57 O
-ANISOU 4767 O PHE M 253 8461 10257 7716 1488 217 -1741 O
-ATOM 4768 CB PHE M 253 -18.671 -43.117-124.160 1.00 60.15 C
-ANISOU 4768 CB PHE M 253 6622 9185 7048 1379 467 -1562 C
-ATOM 4769 CG PHE M 253 -17.461 -43.653-124.870 1.00 59.28 C
-ANISOU 4769 CG PHE M 253 6459 9141 6924 1412 201 -1670 C
-ATOM 4770 CD1 PHE M 253 -17.033 -44.953-124.655 1.00 64.18 C
-ANISOU 4770 CD1 PHE M 253 7206 9701 7477 1455 26 -1683 C
-ATOM 4771 CD2 PHE M 253 -16.751 -42.858-125.757 1.00 62.90 C
-ANISOU 4771 CD2 PHE M 253 6748 9721 7429 1401 131 -1766 C
-ATOM 4772 CE1 PHE M 253 -15.917 -45.448-125.307 1.00 60.49 C
-ANISOU 4772 CE1 PHE M 253 6656 9313 7013 1544 -205 -1822 C
-ATOM 4773 CE2 PHE M 253 -15.636 -43.349-126.412 1.00 63.15 C
-ANISOU 4773 CE2 PHE M 253 6680 9869 7445 1435 -59 -1890 C
-ATOM 4774 CZ PHE M 253 -15.219 -44.644-126.187 1.00 58.42 C
-ANISOU 4774 CZ PHE M 253 6165 9229 6803 1535 -223 -1934 C
-ATOM 4775 N GLU M 254 -18.419 -44.227-121.374 1.00 71.90 N
-ANISOU 4775 N GLU M 254 8781 10460 8077 1378 513 -1503 N
-ATOM 4776 CA GLU M 254 -17.933 -45.199-120.406 1.00 77.48 C
-ANISOU 4776 CA GLU M 254 9843 11038 8556 1377 362 -1475 C
-ATOM 4777 C GLU M 254 -18.089 -46.596-120.986 1.00 79.51 C
-ANISOU 4777 C GLU M 254 10093 11220 8896 1334 200 -1396 C
-ATOM 4778 O GLU M 254 -19.152 -46.938-121.515 1.00 79.57 O
-ANISOU 4778 O GLU M 254 9943 11238 9053 1212 355 -1282 O
-ATOM 4779 CB GLU M 254 -18.687 -45.079-119.079 1.00 86.37 C
-ANISOU 4779 CB GLU M 254 11275 12087 9455 1296 635 -1380 C
-ATOM 4780 CG GLU M 254 -18.245 -46.084-118.030 1.00114.04 C
-ANISOU 4780 CG GLU M 254 15238 15421 12671 1264 465 -1317 C
-ATOM 4781 CD GLU M 254 -18.947 -45.887-116.702 1.00133.05 C
-ANISOU 4781 CD GLU M 254 17994 17771 14788 1157 773 -1230 C
-ATOM 4782 OE1 GLU M 254 -19.738 -44.927-116.582 1.00137.66 O
-ANISOU 4782 OE1 GLU M 254 18426 18464 15414 1150 1132 -1253 O
-ATOM 4783 OE2 GLU M 254 -18.707 -46.693-115.778 1.00139.63 O1-
-ANISOU 4783 OE2 GLU M 254 19276 18444 15334 1091 655 -1146 O1-
-ATOM 4784 N SER M 255 -17.032 -47.398-120.890 1.00 85.81 N
-ANISOU 4784 N SER M 255 11064 11933 9607 1444 -138 -1468 N
-ATOM 4785 CA SER M 255 -17.058 -48.738-121.457 1.00 90.42 C
-ANISOU 4785 CA SER M 255 11704 12397 10256 1448 -345 -1428 C
-ATOM 4786 C SER M 255 -16.011 -49.594-120.764 1.00 95.04 C
-ANISOU 4786 C SER M 255 12636 12815 10660 1600 -706 -1486 C
-ATOM 4787 O SER M 255 -14.897 -49.130-120.508 1.00 88.59 O
-ANISOU 4787 O SER M 255 11790 12078 9794 1766 -890 -1641 O
-ATOM 4788 CB SER M 255 -16.804 -48.707-122.970 1.00 83.44 C
-ANISOU 4788 CB SER M 255 10446 11649 9608 1522 -433 -1543 C
-ATOM 4789 OG SER M 255 -16.783 -50.016-123.513 1.00 78.48 O
-ANISOU 4789 OG SER M 255 9921 10877 9021 1555 -656 -1537 O
-ATOM 4790 N ASN M 256 -16.382 -50.842-120.468 1.00105.75 N
-ANISOU 4790 N ASN M 256 14326 13929 11926 1532 -834 -1356 N
-ATOM 4791 CA ASN M 256 -15.472 -51.827-119.880 1.00118.71 C
-ANISOU 4791 CA ASN M 256 16358 15342 13404 1704 -1245 -1395 C
-ATOM 4792 C ASN M 256 -14.829 -51.297-118.601 1.00119.61 C
-ANISOU 4792 C ASN M 256 16743 15433 13269 1766 -1326 -1416 C
-ATOM 4793 O ASN M 256 -13.642 -51.512-118.343 1.00126.64 O
-ANISOU 4793 O ASN M 256 17721 16286 14112 2012 -1706 -1561 O
-ATOM 4794 CB ASN M 256 -14.402 -52.260-120.885 1.00129.84 C
-ANISOU 4794 CB ASN M 256 17534 16807 14990 2001 -1578 -1625 C
-ATOM 4795 CG ASN M 256 -14.993 -52.799-122.175 1.00137.00 C
-ANISOU 4795 CG ASN M 256 18238 17716 16100 1948 -1526 -1626 C
-ATOM 4796 OD1 ASN M 256 -16.095 -52.422-122.575 1.00141.29 O
-ANISOU 4796 OD1 ASN M 256 18614 18336 16735 1703 -1215 -1497 O
-ATOM 4797 ND2 ASN M 256 -14.260 -53.691-122.833 1.00135.11 N
-ANISOU 4797 ND2 ASN M 256 18016 17388 15930 2198 -1852 -1789 N
-ATOM 4798 N ASN M 257 -15.625 -50.589-117.797 1.00113.05 N
-ANISOU 4798 N ASN M 257 16039 14637 12279 1554 -973 -1286 N
-ATOM 4799 CA ASN M 257 -15.162 -49.994-116.541 1.00104.43 C
-ANISOU 4799 CA ASN M 257 15263 13514 10903 1576 -1007 -1303 C
-ATOM 4800 C ASN M 257 -14.009 -49.019-116.778 1.00 94.61 C
-ANISOU 4800 C ASN M 257 13716 12469 9764 1776 -1181 -1536 C
-ATOM 4801 O ASN M 257 -13.058 -48.947-115.996 1.00 98.96 O
-ANISOU 4801 O ASN M 257 14499 12957 10144 1900 -1491 -1618 O
-ATOM 4802 CB ASN M 257 -14.769 -51.074-115.530 1.00109.86 C
-ANISOU 4802 CB ASN M 257 16564 13889 11288 1603 -1353 -1203 C
-ATOM 4803 CG ASN M 257 -15.868 -52.094-115.315 1.00115.30 C
-ANISOU 4803 CG ASN M 257 17589 14362 11856 1338 -1197 -951 C
-ATOM 4804 OD1 ASN M 257 -16.782 -51.882-114.517 1.00118.30 O
-ANISOU 4804 OD1 ASN M 257 18210 14728 12008 1073 -831 -784 O
-ATOM 4805 ND2 ASN M 257 -15.786 -53.210-116.030 1.00115.40 N
-ANISOU 4805 ND2 ASN M 257 17623 14208 12014 1396 -1464 -932 N
-ATOM 4806 N PHE M 258 -14.094 -48.266-117.873 1.00 84.01 N
-ANISOU 4806 N PHE M 258 11861 11360 8698 1780 -1002 -1634 N
-ATOM 4807 CA PHE M 258 -13.127 -47.228-118.199 1.00 75.00 C
-ANISOU 4807 CA PHE M 258 10405 10429 7662 1878 -1096 -1829 C
-ATOM 4808 C PHE M 258 -13.877 -46.002-118.695 1.00 76.09 C
-ANISOU 4808 C PHE M 258 10268 10723 7921 1740 -705 -1817 C
-ATOM 4809 O PHE M 258 -14.967 -46.113-119.266 1.00 77.79 O
-ANISOU 4809 O PHE M 258 10353 10948 8257 1639 -433 -1706 O
-ATOM 4810 CB PHE M 258 -12.124 -47.675-119.275 1.00 73.13 C
-ANISOU 4810 CB PHE M 258 9803 10329 7655 2065 -1379 -2003 C
-ATOM 4811 CG PHE M 258 -11.009 -48.539-118.756 1.00 85.33 C
-ANISOU 4811 CG PHE M 258 11530 11771 9121 2295 -1847 -2104 C
-ATOM 4812 CD1 PHE M 258 -10.928 -49.877-119.111 1.00 74.24 C
-ANISOU 4812 CD1 PHE M 258 10232 10211 7765 2455 -2080 -2103 C
-ATOM 4813 CD2 PHE M 258 -10.042 -48.014-117.913 1.00 92.32 C
-ANISOU 4813 CD2 PHE M 258 12497 12694 9887 2364 -2097 -2208 C
-ATOM 4814 CE1 PHE M 258 -9.903 -50.673-118.639 1.00 72.83 C
-ANISOU 4814 CE1 PHE M 258 10231 9912 7531 2723 -2553 -2210 C
-ATOM 4815 CE2 PHE M 258 -9.016 -48.807-117.434 1.00 86.78 C
-ANISOU 4815 CE2 PHE M 258 11938 11898 9136 2609 -2581 -2308 C
-ATOM 4816 CZ PHE M 258 -8.947 -50.138-117.797 1.00 81.10 C
-ANISOU 4816 CZ PHE M 258 11317 11020 8478 2810 -2811 -2312 C
-ATOM 4817 N ILE M 259 -13.282 -44.830-118.480 1.00 66.80 N
-ANISOU 4817 N ILE M 259 9012 9650 6718 1736 -716 -1933 N
-ATOM 4818 CA ILE M 259 -13.826 -43.568-118.969 1.00 59.92 C
-ANISOU 4818 CA ILE M 259 7924 8886 5959 1637 -422 -1944 C
-ATOM 4819 C ILE M 259 -12.980 -43.104-120.144 1.00 70.09 C
-ANISOU 4819 C ILE M 259 8795 10373 7462 1646 -548 -2076 C
-ATOM 4820 O ILE M 259 -11.745 -43.060-120.050 1.00 84.61 O
-ANISOU 4820 O ILE M 259 10555 12302 9289 1696 -830 -2213 O
-ATOM 4821 CB ILE M 259 -13.868 -42.496-117.868 1.00 74.93 C
-ANISOU 4821 CB ILE M 259 10117 10711 7641 1591 -323 -1974 C
-ATOM 4822 CG1 ILE M 259 -14.567 -43.035-116.618 1.00 75.25 C
-ANISOU 4822 CG1 ILE M 259 10618 10577 7397 1572 -191 -1858 C
-ATOM 4823 CG2 ILE M 259 -14.576 -41.249-118.377 1.00 79.84 C
-ANISOU 4823 CG2 ILE M 259 10566 11383 8386 1531 -27 -1981 C
-ATOM 4824 CD1 ILE M 259 -16.010 -43.425-116.849 1.00 71.63 C
-ANISOU 4824 CD1 ILE M 259 10100 10109 7009 1498 186 -1702 C
-ATOM 4825 N TYR M 260 -13.646 -42.755-121.244 1.00 64.95 N
-ANISOU 4825 N TYR M 260 7873 9805 7000 1583 -341 -2034 N
-ATOM 4826 CA TYR M 260 -12.997 -42.326-122.474 1.00 56.70 C
-ANISOU 4826 CA TYR M 260 6470 8953 6122 1545 -400 -2130 C
-ATOM 4827 C TYR M 260 -13.485 -40.940-122.868 1.00 51.02 C
-ANISOU 4827 C TYR M 260 5686 8242 5455 1418 -199 -2101 C
-ATOM 4828 O TYR M 260 -14.671 -40.619-122.724 1.00 59.75 O
-ANISOU 4828 O TYR M 260 6884 9237 6580 1414 27 -1994 O
-ATOM 4829 CB TYR M 260 -13.272 -43.303-123.618 1.00 64.79 C
-ANISOU 4829 CB TYR M 260 7284 10038 7295 1591 -405 -2109 C
-ATOM 4830 CG TYR M 260 -12.835 -44.724-123.351 1.00 68.43 C
-ANISOU 4830 CG TYR M 260 7845 10438 7717 1745 -633 -2145 C
-ATOM 4831 CD1 TYR M 260 -13.686 -45.623-122.726 1.00 62.81 C
-ANISOU 4831 CD1 TYR M 260 7415 9518 6931 1759 -603 -2007 C
-ATOM 4832 CD2 TYR M 260 -11.582 -45.173-123.744 1.00 66.31 C
-ANISOU 4832 CD2 TYR M 260 7389 10317 7490 1876 -879 -2323 C
-ATOM 4833 CE1 TYR M 260 -13.299 -46.924-122.486 1.00 62.90 C
-ANISOU 4833 CE1 TYR M 260 7596 9412 6893 1895 -854 -2027 C
-ATOM 4834 CE2 TYR M 260 -11.185 -46.476-123.508 1.00 65.62 C
-ANISOU 4834 CE2 TYR M 260 7422 10133 7378 2074 -1129 -2375 C
-ATOM 4835 CZ TYR M 260 -12.049 -47.347-122.878 1.00 64.43 C
-ANISOU 4835 CZ TYR M 260 7628 9716 7137 2080 -1135 -2217 C
-ATOM 4836 OH TYR M 260 -11.667 -48.647-122.641 1.00 72.25 O
-ANISOU 4836 OH TYR M 260 8816 10549 8088 2271 -1424 -2254 O
-ATOM 4837 N PHE M 261 -12.559 -40.134-123.383 1.00 58.84 N
-ANISOU 4837 N PHE M 261 6511 9369 6478 1314 -292 -2200 N
-ATOM 4838 CA PHE M 261 -12.821 -38.768-123.820 1.00 69.64 C
-ANISOU 4838 CA PHE M 261 7872 10710 7878 1171 -173 -2176 C
-ATOM 4839 C PHE M 261 -12.171 -38.582-125.182 1.00 71.36 C
-ANISOU 4839 C PHE M 261 7787 11132 8196 1038 -214 -2219 C
-ATOM 4840 O PHE M 261 -10.943 -38.630-125.295 1.00 69.03 O
-ANISOU 4840 O PHE M 261 7323 11022 7884 965 -363 -2341 O
-ATOM 4841 CB PHE M 261 -12.264 -37.751-122.824 1.00 68.65 C
-ANISOU 4841 CB PHE M 261 7979 10494 7611 1092 -257 -2247 C
-ATOM 4842 CG PHE M 261 -13.261 -37.269-121.820 1.00 64.32 C
-ANISOU 4842 CG PHE M 261 7771 9715 6953 1177 -93 -2195 C
-ATOM 4843 CD1 PHE M 261 -13.531 -38.011-120.683 1.00 75.09 C
-ANISOU 4843 CD1 PHE M 261 9370 10992 8168 1300 -77 -2182 C
-ATOM 4844 CD2 PHE M 261 -13.909 -36.059-121.996 1.00 58.17 C
-ANISOU 4844 CD2 PHE M 261 7104 8800 6199 1143 45 -2170 C
-ATOM 4845 CE1 PHE M 261 -14.440 -37.564-119.746 1.00 73.06 C
-ANISOU 4845 CE1 PHE M 261 9420 10562 7777 1372 130 -2154 C
-ATOM 4846 CE2 PHE M 261 -14.821 -35.605-121.063 1.00 62.49 C
-ANISOU 4846 CE2 PHE M 261 7942 9157 6646 1268 224 -2163 C
-ATOM 4847 CZ PHE M 261 -15.086 -36.359-119.936 1.00 65.92 C
-ANISOU 4847 CZ PHE M 261 8576 9553 6919 1375 295 -2161 C
-ATOM 4848 N LEU M 262 -12.982 -38.373-126.210 1.00 69.33 N
-ANISOU 4848 N LEU M 262 7452 10858 8033 1000 -82 -2124 N
-ATOM 4849 CA LEU M 262 -12.472 -38.038-127.530 1.00 67.58 C
-ANISOU 4849 CA LEU M 262 7024 10807 7846 833 -87 -2142 C
-ATOM 4850 C LEU M 262 -12.296 -36.529-127.618 1.00 58.70 C
-ANISOU 4850 C LEU M 262 6029 9602 6673 620 -78 -2113 C
-ATOM 4851 O LEU M 262 -13.240 -35.773-127.348 1.00 56.92 O
-ANISOU 4851 O LEU M 262 6020 9144 6462 659 -10 -2023 O
-ATOM 4852 CB LEU M 262 -13.427 -38.536-128.611 1.00 61.18 C
-ANISOU 4852 CB LEU M 262 6135 9984 7126 880 -4 -2046 C
-ATOM 4853 CG LEU M 262 -13.717 -40.032-128.520 1.00 61.83 C
-ANISOU 4853 CG LEU M 262 6155 10083 7253 1065 -35 -2061 C
-ATOM 4854 CD1 LEU M 262 -14.756 -40.431-129.542 1.00 65.02 C
-ANISOU 4854 CD1 LEU M 262 6511 10444 7749 1076 15 -1958 C
-ATOM 4855 CD2 LEU M 262 -12.438 -40.824-128.719 1.00 60.17 C
-ANISOU 4855 CD2 LEU M 262 5769 10089 7004 1107 -155 -2228 C
-ATOM 4856 N THR M 263 -11.091 -36.097-127.994 1.00 52.76 N
-ANISOU 4856 N THR M 263 5139 9039 5867 392 -149 -2197 N
-ATOM 4857 CA THR M 263 -10.744 -34.682-128.004 1.00 65.13 C
-ANISOU 4857 CA THR M 263 6867 10514 7366 123 -181 -2170 C
-ATOM 4858 C THR M 263 -9.884 -34.355-129.221 1.00 64.19 C
-ANISOU 4858 C THR M 263 6540 10641 7207 -189 -158 -2181 C
-ATOM 4859 O THR M 263 -9.302 -35.237-129.854 1.00 68.38 O
-ANISOU 4859 O THR M 263 6759 11466 7755 -172 -120 -2267 O
-ATOM 4860 CB THR M 263 -9.993 -34.282-126.732 1.00 70.53 C
-ANISOU 4860 CB THR M 263 7668 11152 7979 75 -322 -2269 C
-ATOM 4861 OG1 THR M 263 -9.864 -32.858-126.685 1.00 87.76 O
-ANISOU 4861 OG1 THR M 263 10100 13154 10091 -183 -370 -2229 O
-ATOM 4862 CG2 THR M 263 -8.602 -34.902-126.733 1.00 56.37 C
-ANISOU 4862 CG2 THR M 263 5528 9696 6194 -9 -440 -2419 C
-ATOM 4863 N VAL M 264 -9.805 -33.062-129.532 1.00 60.15 N
-ANISOU 4863 N VAL M 264 6234 9996 6624 -481 -175 -2099 N
-ATOM 4864 CA VAL M 264 -8.978 -32.541-130.618 1.00 70.54 C
-ANISOU 4864 CA VAL M 264 7426 11522 7852 -874 -133 -2081 C
-ATOM 4865 C VAL M 264 -7.967 -31.574-130.016 1.00 90.19 C
-ANISOU 4865 C VAL M 264 9973 14018 10277 -1210 -249 -2130 C
-ATOM 4866 O VAL M 264 -8.350 -30.544-129.445 1.00 95.39 O
-ANISOU 4866 O VAL M 264 11018 14329 10895 -1279 -351 -2062 O
-ATOM 4867 CB VAL M 264 -9.818 -31.842-131.698 1.00 72.01 C
-ANISOU 4867 CB VAL M 264 7874 11507 7980 -994 -85 -1898 C
-ATOM 4868 CG1 VAL M 264 -8.916 -31.139-132.699 1.00 61.53 C
-ANISOU 4868 CG1 VAL M 264 6518 10361 6499 -1482 -38 -1854 C
-ATOM 4869 CG2 VAL M 264 -10.718 -32.839-132.400 1.00 78.67 C
-ANISOU 4869 CG2 VAL M 264 8619 12386 8887 -713 -6 -1859 C
-ATOM 4870 N GLN M 265 -6.682 -31.897-130.149 1.00 90.25 N
-ANISOU 4870 N GLN M 265 9592 14417 10282 -1416 -247 -2263 N
-ATOM 4871 CA GLN M 265 -5.611 -31.097-129.567 1.00 85.21 C
-ANISOU 4871 CA GLN M 265 8918 13847 9609 -1772 -386 -2326 C
-ATOM 4872 C GLN M 265 -4.559 -30.814-130.630 1.00 93.31 C
-ANISOU 4872 C GLN M 265 9621 15262 10571 -2242 -262 -2341 C
-ATOM 4873 O GLN M 265 -4.703 -31.190-131.797 1.00 95.04 O
-ANISOU 4873 O GLN M 265 9707 15667 10737 -2273 -59 -2303 O
-ATOM 4874 CB GLN M 265 -4.965 -31.808-128.370 1.00 80.35 C
-ANISOU 4874 CB GLN M 265 8077 13367 9084 -1547 -557 -2508 C
-ATOM 4875 CG GLN M 265 -5.937 -32.436-127.390 1.00 89.82 C
-ANISOU 4875 CG GLN M 265 9530 14282 10317 -1066 -619 -2508 C
-ATOM 4876 CD GLN M 265 -5.243 -33.354-126.400 1.00107.67 C
-ANISOU 4876 CD GLN M 265 11565 16708 12637 -834 -798 -2676 C
-ATOM 4877 OE1 GLN M 265 -4.134 -33.825-126.649 1.00119.14 O
-ANISOU 4877 OE1 GLN M 265 12564 18543 14160 -913 -853 -2815 O
-ATOM 4878 NE2 GLN M 265 -5.891 -33.607-125.269 1.00107.28 N
-ANISOU 4878 NE2 GLN M 265 11835 16375 12550 -541 -894 -2668 N
-ATOM 4879 N ARG M 266 -3.490 -30.139-130.216 1.00 99.93 N
-ANISOU 4879 N ARG M 266 10337 16234 11398 -2636 -380 -2402 N
-ATOM 4880 CA ARG M 266 -2.302 -30.021-131.048 1.00 91.56 C
-ANISOU 4880 CA ARG M 266 8830 15655 10303 -3094 -240 -2462 C
-ATOM 4881 C ARG M 266 -1.457 -31.277-130.901 1.00 93.49 C
-ANISOU 4881 C ARG M 266 8426 16396 10699 -2818 -211 -2711 C
-ATOM 4882 O ARG M 266 -1.377 -31.863-129.818 1.00101.72 O
-ANISOU 4882 O ARG M 266 9397 17385 11866 -2459 -427 -2834 O
-ATOM 4883 CB ARG M 266 -1.484 -28.787-130.663 1.00 85.82 C
-ANISOU 4883 CB ARG M 266 8199 14885 9524 -3676 -398 -2425 C
-ATOM 4884 CG ARG M 266 -2.105 -27.465-131.087 1.00 93.95 C
-ANISOU 4884 CG ARG M 266 9861 15460 10376 -4047 -417 -2181 C
-ATOM 4885 CD ARG M 266 -1.139 -26.305-130.897 1.00 87.23 C
-ANISOU 4885 CD ARG M 266 9072 14617 9456 -4726 -557 -2144 C
-ATOM 4886 NE ARG M 266 -1.695 -25.044-131.381 1.00 88.68 N
-ANISOU 4886 NE ARG M 266 9915 14328 9450 -5096 -601 -1901 N
-ATOM 4887 N GLU M 267 -0.834 -31.698-132.005 1.00 97.39 N
-ANISOU 4887 N GLU M 267 8479 17362 11163 -2969 52 -2791 N
-ATOM 4888 CA GLU M 267 -0.031 -32.917-131.984 1.00103.85 C
-ANISOU 4888 CA GLU M 267 8667 18659 12132 -2650 90 -3060 C
-ATOM 4889 C GLU M 267 1.058 -32.838-130.922 1.00103.84 C
-ANISOU 4889 C GLU M 267 8298 18859 12296 -2723 -180 -3228 C
-ATOM 4890 O GLU M 267 1.175 -33.724-130.067 1.00 97.39 O
-ANISOU 4890 O GLU M 267 7330 18045 11631 -2252 -402 -3382 O
-ATOM 4891 CB GLU M 267 0.564 -33.175-133.370 1.00114.35 C
-ANISOU 4891 CB GLU M 267 9586 20494 13368 -2874 456 -3141 C
-ATOM 4892 CG GLU M 267 -0.468 -33.142-134.492 1.00118.44 C
-ANISOU 4892 CG GLU M 267 10519 20804 13679 -2876 686 -2959 C
-ATOM 4893 CD GLU M 267 0.027 -33.788-135.774 1.00127.06 C
-ANISOU 4893 CD GLU M 267 11224 22395 14658 -2910 1042 -3101 C
-ATOM 4894 OE1 GLU M 267 0.785 -34.777-135.690 1.00126.78 O
-ANISOU 4894 OE1 GLU M 267 10632 22774 14766 -2600 1088 -3385 O
-ATOM 4895 OE2 GLU M 267 -0.352 -33.314-136.865 1.00132.38 O1-
-ANISOU 4895 OE2 GLU M 267 12180 23032 15086 -3225 1265 -2937 O1-
-ATOM 4896 N THR M 268 1.861 -31.777-130.954 1.00112.74 N
-ANISOU 4896 N THR M 268 9309 20138 13389 -3334 -199 -3191 N
-ATOM 4897 CA THR M 268 2.797 -31.494-129.873 1.00123.11 C
-ANISOU 4897 CA THR M 268 10367 21561 14849 -3480 -528 -3315 C
-ATOM 4898 C THR M 268 2.527 -30.096-129.336 1.00129.45 C
-ANISOU 4898 C THR M 268 11750 21906 15530 -3944 -722 -3113 C
-ATOM 4899 O THR M 268 1.375 -29.653-129.306 1.00135.08 O
-ANISOU 4899 O THR M 268 13130 22091 16105 -3847 -715 -2919 O
-ATOM 4900 CB THR M 268 4.246 -31.626-130.346 1.00134.19 C
-ANISOU 4900 CB THR M 268 11176 23452 16357 -3659 -373 -3414 C
-ATOM 4901 OG1 THR M 268 4.457 -30.792-131.492 1.00144.00 O
-ANISOU 4901 OG1 THR M 268 12439 24855 17419 -4258 -39 -3272 O
-ATOM 4902 CG2 THR M 268 4.562 -33.071-130.704 1.00128.57 C
-ANISOU 4902 CG2 THR M 268 10076 23011 15764 -3037 -232 -3605 C
-ATOM 4903 N LEU M 269 3.572 -29.387-128.919 1.00128.75 N
-ANISOU 4903 N LEU M 269 11412 22009 15500 -4442 -911 -3168 N
-ATOM 4904 CA LEU M 269 3.428 -28.030-128.410 1.00125.19 C
-ANISOU 4904 CA LEU M 269 11533 21110 14925 -4924 -1131 -2998 C
-ATOM 4905 C LEU M 269 3.941 -26.985-129.388 1.00140.20 C
-ANISOU 4905 C LEU M 269 13414 23160 16696 -5710 -921 -2847 C
-ATOM 4906 O LEU M 269 3.257 -25.990-129.645 1.00140.56 O
-ANISOU 4906 O LEU M 269 14125 22737 16545 -6015 -918 -2623 O
-ATOM 4907 CB LEU M 269 4.151 -27.883-127.063 1.00124.00 C
-ANISOU 4907 CB LEU M 269 11290 20924 14901 -4944 -1584 -3135 C
-ATOM 4908 CG LEU M 269 3.831 -28.894-125.960 1.00115.42 C
-ANISOU 4908 CG LEU M 269 10236 19707 13911 -4236 -1850 -3286 C
-ATOM 4909 CD1 LEU M 269 4.697 -30.135-126.112 1.00126.70 C
-ANISOU 4909 CD1 LEU M 269 10950 21618 15573 -3825 -1789 -3453 C
-ATOM 4910 CD2 LEU M 269 4.065 -28.271-124.600 1.00100.67 C
-ANISOU 4910 CD2 LEU M 269 8725 17508 12016 -4350 -2321 -3317 C
-ATOM 4911 N ASP M 270 5.134 -27.192-129.950 1.00147.65 N
-ANISOU 4911 N ASP M 270 13774 24586 17741 -5867 -709 -2886 N
-ATOM 4912 CA ASP M 270 5.711 -26.250-130.900 1.00158.78 C
-ANISOU 4912 CA ASP M 270 15203 26125 19002 -6561 -461 -2709 C
-ATOM 4913 C ASP M 270 5.114 -26.368-132.297 1.00162.01 C
-ANISOU 4913 C ASP M 270 15728 26645 19183 -6663 -29 -2598 C
-ATOM 4914 O ASP M 270 5.327 -25.470-133.120 1.00166.72 O
-ANISOU 4914 O ASP M 270 16545 27231 19569 -7276 158 -2401 O
-ATOM 4915 CB ASP M 270 7.228 -26.446-130.977 1.00164.33 C
-ANISOU 4915 CB ASP M 270 15217 27336 19886 -6685 -383 -2820 C
-ATOM 4916 N ALA M 271 4.382 -27.439-132.584 1.00157.49 N
-ANISOU 4916 N ALA M 271 15053 26156 18631 -6091 111 -2709 N
-ATOM 4917 CA ALA M 271 3.795 -27.623-133.900 1.00156.89 C
-ANISOU 4917 CA ALA M 271 15096 26180 18336 -6156 491 -2614 C
-ATOM 4918 C ALA M 271 2.475 -26.868-134.010 1.00142.97 C
-ANISOU 4918 C ALA M 271 14179 23764 16380 -6240 379 -2355 C
-ATOM 4919 O ALA M 271 1.816 -26.561-133.013 1.00136.37 O
-ANISOU 4919 O ALA M 271 13810 22392 15611 -5968 46 -2304 O
-ATOM 4920 CB ALA M 271 3.576 -29.108-134.191 1.00159.51 C
-ANISOU 4920 CB ALA M 271 15041 26794 18771 -5438 665 -2825 C
-ATOM 4921 N GLN M 272 2.090 -26.572-135.251 1.00136.24 N
-ANISOU 4921 N GLN M 272 13606 22890 15269 -6513 663 -2172 N
-ATOM 4922 CA GLN M 272 0.875 -25.822-135.530 1.00130.23 C
-ANISOU 4922 CA GLN M 272 13709 21454 14318 -6509 549 -1888 C
-ATOM 4923 C GLN M 272 -0.243 -26.676-136.111 1.00122.31 C
-ANISOU 4923 C GLN M 272 12881 20315 13277 -5898 670 -1868 C
-ATOM 4924 O GLN M 272 -1.319 -26.145-136.404 1.00123.17 O
-ANISOU 4924 O GLN M 272 13651 19891 13256 -5825 564 -1647 O
-ATOM 4925 CB GLN M 272 1.178 -24.659-136.481 1.00134.82 C
-ANISOU 4925 CB GLN M 272 14646 21982 14596 -7341 678 -1636 C
-ATOM 4926 CG GLN M 272 2.098 -23.604-135.893 1.00147.43 C
-ANISOU 4926 CG GLN M 272 16250 23559 16209 -8030 490 -1594 C
-ATOM 4927 CD GLN M 272 2.446 -22.516-136.889 1.00160.38 C
-ANISOU 4927 CD GLN M 272 18248 25166 17523 -8916 639 -1329 C
-ATOM 4928 OE1 GLN M 272 2.482 -22.754-138.096 1.00159.74 O
-ANISOU 4928 OE1 GLN M 272 18111 25374 17211 -9087 1000 -1253 O
-ATOM 4929 NE2 GLN M 272 2.703 -21.314-136.387 1.00168.47 N
-ANISOU 4929 NE2 GLN M 272 19734 25778 18498 -9398 350 -1172 N
-ATOM 4930 N THR M 273 -0.025 -27.976-136.284 1.00111.06 N
-ANISOU 4930 N THR M 273 10893 19336 11970 -5452 856 -2098 N
-ATOM 4931 CA THR M 273 -1.041 -28.865-136.828 1.00 99.63 C
-ANISOU 4931 CA THR M 273 9591 17771 10492 -4899 949 -2094 C
-ATOM 4932 C THR M 273 -1.813 -29.551-135.707 1.00 92.18 C
-ANISOU 4932 C THR M 273 8715 16513 9797 -4202 689 -2183 C
-ATOM 4933 O THR M 273 -1.288 -29.779-134.614 1.00 98.04 O
-ANISOU 4933 O THR M 273 9177 17335 10738 -4049 515 -2341 O
-ATOM 4934 CB THR M 273 -0.406 -29.913-137.743 1.00 98.80 C
-ANISOU 4934 CB THR M 273 8913 18294 10334 -4815 1306 -2300 C
-ATOM 4935 OG1 THR M 273 0.710 -30.517-137.077 1.00 95.73 O
-ANISOU 4935 OG1 THR M 273 7813 18386 10176 -4706 1311 -2588 O
-ATOM 4936 CG2 THR M 273 0.074 -29.268-139.034 1.00113.34 C
-ANISOU 4936 CG2 THR M 273 10821 20399 11844 -5485 1627 -2172 C
-ATOM 4937 N PHE M 274 -3.069 -29.887-135.991 1.00 88.56 N
-ANISOU 4937 N PHE M 274 8633 15703 9312 -3802 657 -2076 N
-ATOM 4938 CA PHE M 274 -3.975 -30.460-135.006 1.00 89.91 C
-ANISOU 4938 CA PHE M 274 8940 15542 9681 -3199 450 -2115 C
-ATOM 4939 C PHE M 274 -4.295 -31.911-135.341 1.00 86.33 C
-ANISOU 4939 C PHE M 274 8201 15297 9303 -2695 565 -2259 C
-ATOM 4940 O PHE M 274 -4.189 -32.348-136.489 1.00 98.91 O
-ANISOU 4940 O PHE M 274 9669 17154 10760 -2760 786 -2282 O
-ATOM 4941 CB PHE M 274 -5.275 -29.652-134.926 1.00 90.27 C
-ANISOU 4941 CB PHE M 274 9639 14979 9679 -3121 287 -1880 C
-ATOM 4942 CG PHE M 274 -5.129 -28.338-134.216 1.00 91.48 C
-ANISOU 4942 CG PHE M 274 10159 14794 9807 -3444 85 -1779 C
-ATOM 4943 CD1 PHE M 274 -4.535 -27.260-134.849 1.00 95.91 C
-ANISOU 4943 CD1 PHE M 274 10908 15357 10177 -4079 113 -1644 C
-ATOM 4944 CD2 PHE M 274 -5.589 -28.179-132.921 1.00 92.52 C
-ANISOU 4944 CD2 PHE M 274 10491 14586 10077 -3132 -132 -1821 C
-ATOM 4945 CE1 PHE M 274 -4.398 -26.050-134.204 1.00 96.68 C
-ANISOU 4945 CE1 PHE M 274 11399 15093 10241 -4393 -108 -1555 C
-ATOM 4946 CE2 PHE M 274 -5.456 -26.969-132.270 1.00 98.83 C
-ANISOU 4946 CE2 PHE M 274 11679 15041 10830 -3411 -333 -1753 C
-ATOM 4947 CZ PHE M 274 -4.859 -25.903-132.913 1.00 99.09 C
-ANISOU 4947 CZ PHE M 274 11910 15047 10692 -4040 -340 -1622 C
-ATOM 4948 N HIS M 275 -4.697 -32.657-134.313 1.00 75.31 N
-ANISOU 4948 N HIS M 275 6756 13759 8101 -2203 404 -2355 N
-ATOM 4949 CA HIS M 275 -5.103 -34.045-134.484 1.00 75.39 C
-ANISOU 4949 CA HIS M 275 6584 13868 8194 -1715 452 -2475 C
-ATOM 4950 C HIS M 275 -6.091 -34.415-133.382 1.00 73.44 C
-ANISOU 4950 C HIS M 275 6580 13230 8094 -1284 256 -2434 C
-ATOM 4951 O HIS M 275 -6.438 -33.598-132.521 1.00 66.09 O
-ANISOU 4951 O HIS M 275 5941 11982 7187 -1337 112 -2338 O
-ATOM 4952 CB HIS M 275 -3.888 -34.981-134.498 1.00 95.19 C
-ANISOU 4952 CB HIS M 275 8507 16886 10775 -1610 533 -2752 C
-ATOM 4953 CG HIS M 275 -3.333 -35.286-133.141 1.00106.04 C
-ANISOU 4953 CG HIS M 275 9679 18278 12334 -1398 305 -2894 C
-ATOM 4954 ND1 HIS M 275 -3.236 -34.340-132.143 1.00119.28 N
-ANISOU 4954 ND1 HIS M 275 11556 19727 14040 -1595 112 -2814 N
-ATOM 4955 CD2 HIS M 275 -2.831 -36.432-132.623 1.00104.84 C
-ANISOU 4955 CD2 HIS M 275 9185 18321 12327 -1002 206 -3115 C
-ATOM 4956 CE1 HIS M 275 -2.708 -34.893-131.065 1.00121.89 C
-ANISOU 4956 CE1 HIS M 275 11678 20124 14511 -1343 -96 -2972 C
-ATOM 4957 NE2 HIS M 275 -2.451 -36.161-131.331 1.00118.56 N
-ANISOU 4957 NE2 HIS M 275 10925 19953 14169 -976 -54 -3149 N
-ATOM 4958 N THR M 276 -6.547 -35.662-133.422 1.00 70.43 N
-ANISOU 4958 N THR M 276 6100 12871 7791 -870 261 -2514 N
-ATOM 4959 CA THR M 276 -7.529 -36.185-132.485 1.00 68.97 C
-ANISOU 4959 CA THR M 276 6124 12359 7723 -487 125 -2468 C
-ATOM 4960 C THR M 276 -6.877 -37.221-131.580 1.00 72.36 C
-ANISOU 4960 C THR M 276 6298 12935 8261 -191 6 -2661 C
-ATOM 4961 O THR M 276 -6.102 -38.065-132.044 1.00 78.77 O
-ANISOU 4961 O THR M 276 6767 14071 9092 -88 48 -2842 O
-ATOM 4962 CB THR M 276 -8.716 -36.809-133.232 1.00 67.61 C
-ANISOU 4962 CB THR M 276 6108 12029 7552 -283 181 -2370 C
-ATOM 4963 OG1 THR M 276 -9.430 -35.788-133.937 1.00 81.67 O
-ANISOU 4963 OG1 THR M 276 8178 13608 9245 -511 217 -2174 O
-ATOM 4964 CG2 THR M 276 -9.663 -37.511-132.275 1.00 55.21 C
-ANISOU 4964 CG2 THR M 276 4680 10191 6107 78 77 -2335 C
-ATOM 4965 N ARG M 277 -7.180 -37.143-130.288 1.00 67.76 N
-ANISOU 4965 N ARG M 277 5909 12105 7733 -42 -152 -2633 N
-ATOM 4966 CA ARG M 277 -6.749 -38.134-129.317 1.00 62.40 C
-ANISOU 4966 CA ARG M 277 5113 11469 7129 262 -321 -2773 C
-ATOM 4967 C ARG M 277 -7.960 -38.738-128.621 1.00 67.19 C
-ANISOU 4967 C ARG M 277 6038 11735 7756 553 -360 -2664 C
-ATOM 4968 O ARG M 277 -9.010 -38.097-128.482 1.00 75.92 O
-ANISOU 4968 O ARG M 277 7439 12570 8838 504 -285 -2500 O
-ATOM 4969 CB ARG M 277 -5.808 -37.531-128.266 1.00 59.56 C
-ANISOU 4969 CB ARG M 277 4701 11157 6770 131 -507 -2854 C
-ATOM 4970 CG ARG M 277 -4.391 -37.267-128.748 1.00 68.90 C
-ANISOU 4970 CG ARG M 277 5434 12764 7980 -118 -510 -3015 C
-ATOM 4971 CD ARG M 277 -3.444 -37.108-127.562 1.00 84.27 C
-ANISOU 4971 CD ARG M 277 7271 14774 9975 -132 -788 -3135 C
-ATOM 4972 NE ARG M 277 -2.916 -35.752-127.426 1.00 90.74 N
-ANISOU 4972 NE ARG M 277 8119 15613 10744 -593 -822 -3093 N
-ATOM 4973 CZ ARG M 277 -1.643 -35.422-127.618 1.00 93.02 C
-ANISOU 4973 CZ ARG M 277 7973 16280 11089 -881 -873 -3227 C
-ATOM 4974 NH1 ARG M 277 -0.757 -36.349-127.956 1.00 96.41 N1+
-ANISOU 4974 NH1 ARG M 277 7864 17127 11640 -700 -881 -3437 N1+
-ATOM 4975 NH2 ARG M 277 -1.254 -34.164-127.469 1.00 89.48 N
-ANISOU 4975 NH2 ARG M 277 7621 15793 10583 -1349 -923 -3162 N
-ATOM 4976 N ILE M 278 -7.805 -39.990-128.203 1.00 61.06 N
-ANISOU 4976 N ILE M 278 5197 10979 7025 855 -479 -2761 N
-ATOM 4977 CA ILE M 278 -8.725 -40.655-127.293 1.00 75.86 C
-ANISOU 4977 CA ILE M 278 7371 12557 8894 1087 -544 -2669 C
-ATOM 4978 C ILE M 278 -8.037 -40.769-125.940 1.00 77.02 C
-ANISOU 4978 C ILE M 278 7604 12661 9001 1183 -773 -2748 C
-ATOM 4979 O ILE M 278 -6.850 -41.107-125.856 1.00 70.08 O
-ANISOU 4979 O ILE M 278 6459 12008 8160 1245 -950 -2922 O
-ATOM 4980 CB ILE M 278 -9.162 -42.037-127.820 1.00 66.64 C
-ANISOU 4980 CB ILE M 278 6179 11367 7775 1327 -548 -2686 C
-ATOM 4981 CG1 ILE M 278 -10.113 -42.714-126.831 1.00 73.84 C
-ANISOU 4981 CG1 ILE M 278 7419 11975 8664 1492 -603 -2565 C
-ATOM 4982 CG2 ILE M 278 -7.961 -42.918-128.081 1.00 63.26 C
-ANISOU 4982 CG2 ILE M 278 5458 11190 7388 1507 -696 -2913 C
-ATOM 4983 CD1 ILE M 278 -10.729 -43.986-127.355 1.00 68.70 C
-ANISOU 4983 CD1 ILE M 278 6812 11234 8056 1655 -615 -2541 C
-ATOM 4984 N ILE M 279 -8.783 -40.469-124.883 1.00 75.06 N
-ANISOU 4984 N ILE M 279 7719 12134 8667 1202 -774 -2631 N
-ATOM 4985 CA ILE M 279 -8.255 -40.380-123.530 1.00 79.72 C
-ANISOU 4985 CA ILE M 279 8502 12633 9156 1249 -992 -2682 C
-ATOM 4986 C ILE M 279 -8.942 -41.447-122.694 1.00 75.89 C
-ANISOU 4986 C ILE M 279 8324 11919 8591 1480 -1047 -2605 C
-ATOM 4987 O ILE M 279 -10.175 -41.476-122.609 1.00 72.79 O
-ANISOU 4987 O ILE M 279 8153 11338 8166 1483 -836 -2456 O
-ATOM 4988 CB ILE M 279 -8.482 -38.984-122.932 1.00 74.06 C
-ANISOU 4988 CB ILE M 279 8031 11770 8339 1038 -934 -2625 C
-ATOM 4989 CG1 ILE M 279 -7.781 -37.922-123.780 1.00 70.84 C
-ANISOU 4989 CG1 ILE M 279 7370 11555 7992 747 -902 -2675 C
-ATOM 4990 CG2 ILE M 279 -8.010 -38.945-121.502 1.00 75.80 C
-ANISOU 4990 CG2 ILE M 279 8521 11869 8412 1090 -1173 -2679 C
-ATOM 4991 CD1 ILE M 279 -7.910 -36.519-123.232 1.00 73.31 C
-ANISOU 4991 CD1 ILE M 279 7970 11680 8204 528 -898 -2634 C
-ATOM 4992 N ARG M 280 -8.155 -42.325-122.083 1.00 57.41 N
-ANISOU 4992 N ARG M 280 5995 9596 6221 1665 -1338 -2705 N
-ATOM 4993 CA ARG M 280 -8.686 -43.397-121.254 1.00 64.92 C
-ANISOU 4993 CA ARG M 280 7303 10305 7061 1853 -1437 -2620 C
-ATOM 4994 C ARG M 280 -8.164 -43.238-119.836 1.00 75.14 C
-ANISOU 4994 C ARG M 280 8911 11471 8166 1881 -1699 -2645 C
-ATOM 4995 O ARG M 280 -6.962 -43.027-119.634 1.00 91.60 O
-ANISOU 4995 O ARG M 280 10806 13712 10286 1902 -1985 -2800 O
-ATOM 4996 CB ARG M 280 -8.301 -44.771-121.807 1.00 68.50 C
-ANISOU 4996 CB ARG M 280 7604 10806 7617 2094 -1614 -2702 C
-ATOM 4997 CG ARG M 280 -8.709 -45.938-120.918 1.00 75.64 C
-ANISOU 4997 CG ARG M 280 8936 11419 8386 2264 -1789 -2607 C
-ATOM 4998 CD ARG M 280 -8.188 -47.254-121.471 1.00 77.33 C
-ANISOU 4998 CD ARG M 280 9031 11644 8708 2538 -2031 -2723 C
-ATOM 4999 NE ARG M 280 -7.400 -47.987-120.483 1.00 80.12 N
-ANISOU 4999 NE ARG M 280 9614 11861 8967 2770 -2462 -2791 N
-ATOM 5000 CZ ARG M 280 -6.724 -49.100-120.746 1.00 98.89 C
-ANISOU 5000 CZ ARG M 280 11922 14219 11433 3085 -2776 -2935 C
-ATOM 5001 NH1 ARG M 280 -6.746 -49.618-121.965 1.00106.58 N1+
-ANISOU 5001 NH1 ARG M 280 12614 15309 12571 3195 -2673 -3037 N1+
-ATOM 5002 NH2 ARG M 280 -6.028 -49.700-119.790 1.00114.98 N
-ANISOU 5002 NH2 ARG M 280 14204 16102 13382 3312 -3217 -2986 N
-ATOM 5003 N PHE M 281 -9.063 -43.331-118.858 1.00 76.12 N
-ANISOU 5003 N PHE M 281 9508 11332 8082 1867 -1600 -2498 N
-ATOM 5004 CA PHE M 281 -8.638 -43.331-117.468 1.00 71.59 C
-ANISOU 5004 CA PHE M 281 9335 10602 7265 1904 -1863 -2509 C
-ATOM 5005 C PHE M 281 -9.634 -44.109-116.619 1.00 68.74 C
-ANISOU 5005 C PHE M 281 9481 9964 6672 1942 -1761 -2334 C
-ATOM 5006 O PHE M 281 -10.746 -44.429-117.051 1.00 61.82 O
-ANISOU 5006 O PHE M 281 8614 9033 5841 1896 -1441 -2200 O
-ATOM 5007 CB PHE M 281 -8.439 -41.904-116.935 1.00 80.44 C
-ANISOU 5007 CB PHE M 281 10559 11727 8277 1717 -1822 -2558 C
-ATOM 5008 CG PHE M 281 -9.665 -41.038-117.004 1.00 76.87 C
-ANISOU 5008 CG PHE M 281 10258 11175 7773 1582 -1387 -2451 C
-ATOM 5009 CD1 PHE M 281 -10.603 -41.054-115.985 1.00 79.45 C
-ANISOU 5009 CD1 PHE M 281 11065 11281 7840 1587 -1198 -2345 C
-ATOM 5010 CD2 PHE M 281 -9.862 -40.181-118.073 1.00 73.48 C
-ANISOU 5010 CD2 PHE M 281 9499 10877 7543 1458 -1172 -2466 C
-ATOM 5011 CE1 PHE M 281 -11.724 -40.248-116.044 1.00 79.73 C
-ANISOU 5011 CE1 PHE M 281 11184 11253 7858 1517 -794 -2282 C
-ATOM 5012 CE2 PHE M 281 -10.981 -39.373-118.137 1.00 74.91 C
-ANISOU 5012 CE2 PHE M 281 9813 10948 7701 1389 -824 -2384 C
-ATOM 5013 CZ PHE M 281 -11.911 -39.405-117.122 1.00 77.60 C
-ANISOU 5013 CZ PHE M 281 10569 11093 7823 1440 -632 -2306 C
-ATOM 5014 N CYS M 282 -9.202 -44.419-115.401 1.00 85.64 N
-ANISOU 5014 N CYS M 282 12047 11938 8554 2003 -2055 -2330 N
-ATOM 5015 CA CYS M 282 -9.981 -45.131-114.402 1.00 98.76 C
-ANISOU 5015 CA CYS M 282 14281 13329 9912 1995 -1996 -2158 C
-ATOM 5016 C CYS M 282 -10.423 -44.158-113.318 1.00 94.99 C
-ANISOU 5016 C CYS M 282 14220 12748 9125 1849 -1803 -2127 C
-ATOM 5017 O CYS M 282 -9.839 -43.086-113.144 1.00104.15 O
-ANISOU 5017 O CYS M 282 15309 13986 10276 1796 -1889 -2257 O
-ATOM 5018 CB CYS M 282 -9.154 -46.265-113.788 1.00123.18 C
-ANISOU 5018 CB CYS M 282 17652 16267 12885 2185 -2513 -2171 C
-ATOM 5019 SG CYS M 282 -10.062 -47.764-113.373 1.00151.39 S
-ANISOU 5019 SG CYS M 282 21742 19525 16253 2193 -2483 -1934 S
-ATOM 5020 N SER M 283 -11.460 -44.540-112.575 1.00 97.93 N
-ANISOU 5020 N SER M 283 15045 12940 9222 1769 -1532 -1959 N
-ATOM 5021 CA SER M 283 -11.979 -43.691-111.500 1.00104.30 C
-ANISOU 5021 CA SER M 283 16292 13650 9686 1656 -1287 -1946 C
-ATOM 5022 C SER M 283 -12.311 -44.571-110.299 1.00101.26 C
-ANISOU 5022 C SER M 283 16568 13031 8874 1613 -1331 -1794 C
-ATOM 5023 O SER M 283 -13.342 -45.250-110.286 1.00102.32 O
-ANISOU 5023 O SER M 283 16823 13110 8944 1517 -1004 -1620 O
-ATOM 5024 CB SER M 283 -13.196 -42.898-111.959 1.00107.01 C
-ANISOU 5024 CB SER M 283 16425 14088 10144 1566 -709 -1916 C
-ATOM 5025 N ILE M 284 -11.439 -44.554-109.296 1.00102.33 N
-ANISOU 5025 N ILE M 284 17144 13027 8708 1656 -1751 -1850 N
-ATOM 5026 CA ILE M 284 -11.630 -45.310-108.064 1.00110.48 C
-ANISOU 5026 CA ILE M 284 18912 13807 9259 1599 -1856 -1702 C
-ATOM 5027 C ILE M 284 -11.776 -44.310-106.926 1.00120.18 C
-ANISOU 5027 C ILE M 284 20638 14963 10061 1504 -1707 -1768 C
-ATOM 5028 O ILE M 284 -10.853 -43.529-106.660 1.00119.32 O
-ANISOU 5028 O ILE M 284 20542 14864 9928 1557 -2049 -1941 O
-ATOM 5029 CB ILE M 284 -10.471 -46.283-107.800 1.00 99.52 C
-ANISOU 5029 CB ILE M 284 17716 12265 7834 1764 -2563 -1705 C
-ATOM 5030 N ASN M 285 -12.932 -44.335-106.261 1.00121.62 N
-ANISOU 5030 N ASN M 285 21226 15083 9903 1353 -1190 -1641 N
-ATOM 5031 CA ASN M 285 -13.256 -43.396-105.186 1.00120.02 C
-ANISOU 5031 CA ASN M 285 21529 14818 9254 1278 -935 -1721 C
-ATOM 5032 C ASN M 285 -13.082 -41.952-105.655 1.00113.12 C
-ANISOU 5032 C ASN M 285 20271 14083 8626 1347 -826 -1949 C
-ATOM 5033 O ASN M 285 -12.475 -41.117-104.981 1.00110.32 O
-ANISOU 5033 O ASN M 285 20241 13640 8035 1358 -1054 -2104 O
-ATOM 5034 CB ASN M 285 -12.420 -43.677-103.933 1.00105.93 C
-ANISOU 5034 CB ASN M 285 20496 12791 6962 1271 -1447 -1715 C
-ATOM 5035 N SER M 286 -13.624 -41.668-106.842 1.00111.27 N
-ANISOU 5035 N SER M 286 19375 14041 8862 1378 -509 -1962 N
-ATOM 5036 CA SER M 286 -13.591 -40.342-107.461 1.00106.88 C
-ANISOU 5036 CA SER M 286 18440 13593 8576 1428 -381 -2143 C
-ATOM 5037 C SER M 286 -12.152 -39.827-107.580 1.00 98.86 C
-ANISOU 5037 C SER M 286 17331 12562 7670 1452 -979 -2299 C
-ATOM 5038 O SER M 286 -11.732 -38.879-106.914 1.00100.83 O
-ANISOU 5038 O SER M 286 17908 12710 7692 1426 -1118 -2446 O
-ATOM 5039 CB SER M 286 -14.470 -39.355-106.685 1.00113.21 C
-ANISOU 5039 CB SER M 286 19613 14339 9061 1426 101 -2235 C
-ATOM 5040 OG SER M 286 -14.369 -38.052-107.232 1.00119.59 O
-ANISOU 5040 OG SER M 286 20150 15180 10108 1488 146 -2413 O
-ATOM 5041 N GLY M 287 -11.404 -40.489-108.464 1.00 95.08 N
-ANISOU 5041 N GLY M 287 16378 12198 7551 1496 -1328 -2274 N
-ATOM 5042 CA GLY M 287 -10.034 -40.107-108.728 1.00 79.76 C
-ANISOU 5042 CA GLY M 287 14195 10323 5789 1504 -1864 -2421 C
-ATOM 5043 C GLY M 287 -9.705 -40.291-110.195 1.00 95.81 C
-ANISOU 5043 C GLY M 287 15476 12587 8340 1537 -1897 -2437 C
-ATOM 5044 O GLY M 287 -10.464 -40.900-110.952 1.00103.83 O
-ANISOU 5044 O GLY M 287 16221 13675 9553 1575 -1595 -2324 O
-ATOM 5045 N LEU M 288 -8.557 -39.747-110.585 1.00 91.88 N
-ANISOU 5045 N LEU M 288 14651 12215 8045 1497 -2266 -2584 N
-ATOM 5046 CA LEU M 288 -8.056 -39.847-111.955 1.00 84.50 C
-ANISOU 5046 CA LEU M 288 13010 11536 7561 1504 -2316 -2629 C
-ATOM 5047 C LEU M 288 -6.812 -40.730-111.940 1.00 81.24 C
-ANISOU 5047 C LEU M 288 12391 11222 7253 1628 -2863 -2700 C
-ATOM 5048 O LEU M 288 -5.713 -40.264-111.624 1.00 79.44 O
-ANISOU 5048 O LEU M 288 12086 11062 7035 1570 -3273 -2838 O
-ATOM 5049 CB LEU M 288 -7.758 -38.465-112.526 1.00 78.27 C
-ANISOU 5049 CB LEU M 288 11951 10850 6938 1322 -2246 -2741 C
-ATOM 5050 CG LEU M 288 -8.704 -37.988-113.627 1.00 79.40 C
-ANISOU 5050 CG LEU M 288 11796 11063 7309 1277 -1769 -2678 C
-ATOM 5051 CD1 LEU M 288 -10.155 -38.264-113.269 1.00 70.93 C
-ANISOU 5051 CD1 LEU M 288 11037 9837 6075 1370 -1327 -2547 C
-ATOM 5052 CD2 LEU M 288 -8.483 -36.512-113.926 1.00 90.22 C
-ANISOU 5052 CD2 LEU M 288 13112 12426 8740 1081 -1735 -2770 C
-ATOM 5053 N HIS M 289 -6.988 -42.001-112.290 1.00 74.60 N
-ANISOU 5053 N HIS M 289 11454 10384 6505 1804 -2889 -2617 N
-ATOM 5054 CA HIS M 289 -5.917 -42.982-112.228 1.00 90.39 C
-ANISOU 5054 CA HIS M 289 13313 12433 8599 2006 -3415 -2692 C
-ATOM 5055 C HIS M 289 -5.703 -43.617-113.593 1.00100.57 C
-ANISOU 5055 C HIS M 289 13978 13953 10282 2135 -3355 -2742 C
-ATOM 5056 O HIS M 289 -6.650 -43.807-114.362 1.00 98.55 O
-ANISOU 5056 O HIS M 289 13608 13707 10128 2104 -2936 -2640 O
-ATOM 5057 CB HIS M 289 -6.228 -44.066-111.196 1.00 93.37 C
-ANISOU 5057 CB HIS M 289 14320 12510 8646 2140 -3610 -2555 C
-ATOM 5058 CG HIS M 289 -6.772 -43.527-109.913 1.00 94.66 C
-ANISOU 5058 CG HIS M 289 15182 12434 8350 1995 -3508 -2473 C
-ATOM 5059 ND1 HIS M 289 -5.986 -42.868-108.991 1.00106.07 N
-ANISOU 5059 ND1 HIS M 289 16904 13820 9580 1940 -3889 -2582 N
-ATOM 5060 CD2 HIS M 289 -8.024 -43.545-109.399 1.00 86.92 C
-ANISOU 5060 CD2 HIS M 289 14675 11278 7073 1888 -3055 -2310 C
-ATOM 5061 CE1 HIS M 289 -6.732 -42.502-107.964 1.00106.57 C
-ANISOU 5061 CE1 HIS M 289 17631 13660 9202 1822 -3668 -2496 C
-ATOM 5062 NE2 HIS M 289 -7.972 -42.901-108.186 1.00103.88 N
-ANISOU 5062 NE2 HIS M 289 17398 13263 8808 1792 -3139 -2334 N
-ATOM 5063 N SER M 290 -4.441 -43.949-113.878 1.00100.80 N
-ANISOU 5063 N SER M 290 13596 14179 10525 2289 -3788 -2915 N
-ATOM 5064 CA SER M 290 -4.054 -44.578-115.140 1.00 95.27 C
-ANISOU 5064 CA SER M 290 12296 13728 10176 2452 -3764 -3018 C
-ATOM 5065 C SER M 290 -4.508 -43.735-116.330 1.00 91.06 C
-ANISOU 5065 C SER M 290 11346 13416 9837 2230 -3275 -3017 C
-ATOM 5066 O SER M 290 -5.014 -44.247-117.331 1.00 69.74 O
-ANISOU 5066 O SER M 290 8428 10780 7291 2295 -3014 -2984 O
-ATOM 5067 CB SER M 290 -4.594 -46.006-115.226 1.00 91.44 C
-ANISOU 5067 CB SER M 290 12055 13030 9658 2703 -3796 -2916 C
-ATOM 5068 OG SER M 290 -4.141 -46.767-114.119 1.00 92.50 O
-ANISOU 5068 OG SER M 290 12638 12921 9588 2901 -4295 -2901 O
-ATOM 5069 N TYR M 291 -4.331 -42.423-116.207 1.00 86.98 N
-ANISOU 5069 N TYR M 291 10772 12984 9293 1957 -3184 -3049 N
-ATOM 5070 CA TYR M 291 -4.699 -41.502-117.270 1.00 74.60 C
-ANISOU 5070 CA TYR M 291 8883 11585 7878 1722 -2779 -3037 C
-ATOM 5071 C TYR M 291 -3.735 -41.648-118.438 1.00 75.63 C
-ANISOU 5071 C TYR M 291 8328 12099 8309 1738 -2832 -3200 C
-ATOM 5072 O TYR M 291 -2.515 -41.577-118.260 1.00 89.00 O
-ANISOU 5072 O TYR M 291 9707 14006 10103 1747 -3175 -3368 O
-ATOM 5073 CB TYR M 291 -4.683 -40.071-116.739 1.00 69.96 C
-ANISOU 5073 CB TYR M 291 8498 10928 7157 1429 -2739 -3036 C
-ATOM 5074 CG TYR M 291 -5.078 -39.011-117.739 1.00 70.34 C
-ANISOU 5074 CG TYR M 291 8324 11077 7326 1173 -2374 -3004 C
-ATOM 5075 CD1 TYR M 291 -6.376 -38.525-117.786 1.00 71.16 C
-ANISOU 5075 CD1 TYR M 291 8743 10964 7329 1123 -1994 -2861 C
-ATOM 5076 CD2 TYR M 291 -4.151 -38.486-118.631 1.00 68.64 C
-ANISOU 5076 CD2 TYR M 291 7586 11174 7318 977 -2416 -3115 C
-ATOM 5077 CE1 TYR M 291 -6.739 -37.545-118.688 1.00 72.67 C
-ANISOU 5077 CE1 TYR M 291 8782 11203 7626 917 -1722 -2826 C
-ATOM 5078 CE2 TYR M 291 -4.508 -37.514-119.543 1.00 70.52 C
-ANISOU 5078 CE2 TYR M 291 7702 11465 7628 716 -2111 -3061 C
-ATOM 5079 CZ TYR M 291 -5.801 -37.045-119.566 1.00 76.27 C
-ANISOU 5079 CZ TYR M 291 8795 11929 8254 703 -1793 -2913 C
-ATOM 5080 OH TYR M 291 -6.155 -36.074-120.473 1.00 91.96 O
-ANISOU 5080 OH TYR M 291 10703 13928 10309 471 -1550 -2854 O
-ATOM 5081 N MET M 292 -4.281 -41.855-119.635 1.00 80.76 N
-ANISOU 5081 N MET M 292 8734 12855 9097 1736 -2490 -3161 N
-ATOM 5082 CA MET M 292 -3.477 -41.998-120.841 1.00 75.77 C
-ANISOU 5082 CA MET M 292 7483 12602 8703 1739 -2450 -3318 C
-ATOM 5083 C MET M 292 -4.170 -41.314-122.011 1.00 87.10 C
-ANISOU 5083 C MET M 292 8792 14115 10188 1500 -2013 -3227 C
-ATOM 5084 O MET M 292 -5.395 -41.395-122.154 1.00 87.90 O
-ANISOU 5084 O MET M 292 9197 13985 10217 1508 -1764 -3060 O
-ATOM 5085 CB MET M 292 -3.227 -43.474-121.185 1.00 68.73 C
-ANISOU 5085 CB MET M 292 6437 11758 7918 2128 -2602 -3419 C
-ATOM 5086 CG MET M 292 -2.478 -44.254-120.118 1.00 92.68 C
-ANISOU 5086 CG MET M 292 9598 14698 10919 2418 -3101 -3516 C
-ATOM 5087 SD MET M 292 -2.135 -45.961-120.590 1.00106.44 S
-ANISOU 5087 SD MET M 292 11190 16452 12803 2919 -3323 -3661 S
-ATOM 5088 CE MET M 292 -1.307 -46.568-119.120 1.00113.68 C
-ANISOU 5088 CE MET M 292 12375 17181 13636 3209 -3981 -3731 C
-ATOM 5089 N GLU M 293 -3.379 -40.642-122.843 1.00 86.98 N
-ANISOU 5089 N GLU M 293 8322 14433 10292 1271 -1934 -3333 N
-ATOM 5090 CA GLU M 293 -3.846 -40.057-124.092 1.00 77.80 C
-ANISOU 5090 CA GLU M 293 7019 13378 9164 1040 -1567 -3260 C
-ATOM 5091 C GLU M 293 -3.175 -40.775-125.255 1.00 85.91 C
-ANISOU 5091 C GLU M 293 7537 14774 10331 1150 -1486 -3426 C
-ATOM 5092 O GLU M 293 -1.956 -40.970-125.246 1.00109.49 O
-ANISOU 5092 O GLU M 293 10093 18081 13428 1194 -1664 -3630 O
-ATOM 5093 CB GLU M 293 -3.542 -38.559-124.154 1.00 81.25 C
-ANISOU 5093 CB GLU M 293 7441 13869 9562 605 -1500 -3221 C
-ATOM 5094 CG GLU M 293 -4.265 -37.720-123.116 1.00 93.80 C
-ANISOU 5094 CG GLU M 293 9570 15076 10993 504 -1538 -3084 C
-ATOM 5095 CD GLU M 293 -4.150 -36.232-123.395 1.00104.19 C
-ANISOU 5095 CD GLU M 293 10949 16372 12267 80 -1449 -3028 C
-ATOM 5096 OE1 GLU M 293 -3.434 -35.861-124.351 1.00104.96 O
-ANISOU 5096 OE1 GLU M 293 10659 16772 12447 -185 -1366 -3080 O
-ATOM 5097 OE2 GLU M 293 -4.783 -35.436-122.666 1.00106.98 O1-
-ANISOU 5097 OE2 GLU M 293 11762 16396 12488 8 -1453 -2937 O1-
-ATOM 5098 N MET M 294 -3.968 -41.160-126.252 1.00 86.61 N
-ANISOU 5098 N MET M 294 7665 14829 10415 1202 -1224 -3354 N
-ATOM 5099 CA MET M 294 -3.464 -41.885-127.409 1.00 85.99 C
-ANISOU 5099 CA MET M 294 7186 15066 10421 1331 -1111 -3521 C
-ATOM 5100 C MET M 294 -4.029 -41.260-128.678 1.00 74.75 C
-ANISOU 5100 C MET M 294 5757 13710 8933 1050 -763 -3413 C
-ATOM 5101 O MET M 294 -5.249 -41.072-128.781 1.00 66.27 O
-ANISOU 5101 O MET M 294 5055 12332 7793 1007 -647 -3210 O
-ATOM 5102 CB MET M 294 -3.847 -43.365-127.327 1.00 93.98 C
-ANISOU 5102 CB MET M 294 8337 15911 11461 1772 -1237 -3572 C
-ATOM 5103 CG MET M 294 -3.463 -44.178-128.541 1.00100.45 C
-ANISOU 5103 CG MET M 294 8832 16996 12340 1956 -1116 -3762 C
-ATOM 5104 SD MET M 294 -3.990 -45.886-128.357 1.00110.31 S
-ANISOU 5104 SD MET M 294 10369 17940 13606 2453 -1324 -3805 S
-ATOM 5105 CE MET M 294 -5.767 -45.692-128.348 1.00 89.39 C
-ANISOU 5105 CE MET M 294 8259 14861 10844 2263 -1148 -3466 C
-ATOM 5106 N PRO M 295 -3.194 -40.931-129.659 1.00 84.19 N
-ANISOU 5106 N PRO M 295 6544 15304 10140 849 -593 -3541 N
-ATOM 5107 CA PRO M 295 -3.717 -40.325-130.892 1.00 83.64 C
-ANISOU 5107 CA PRO M 295 6541 15278 9960 558 -285 -3421 C
-ATOM 5108 C PRO M 295 -4.431 -41.339-131.780 1.00 79.67 C
-ANISOU 5108 C PRO M 295 6137 14710 9424 813 -171 -3433 C
-ATOM 5109 O PRO M 295 -4.019 -42.497-131.900 1.00 99.44 O
-ANISOU 5109 O PRO M 295 8455 17337 11990 1163 -246 -3634 O
-ATOM 5110 CB PRO M 295 -2.461 -39.766-131.571 1.00 84.82 C
-ANISOU 5110 CB PRO M 295 6211 15915 10103 247 -136 -3573 C
-ATOM 5111 CG PRO M 295 -1.337 -40.593-131.028 1.00 88.60 C
-ANISOU 5111 CG PRO M 295 6302 16635 10728 548 -332 -3830 C
-ATOM 5112 CD PRO M 295 -1.722 -40.942-129.619 1.00 86.79 C
-ANISOU 5112 CD PRO M 295 6334 16071 10570 823 -678 -3786 C
-ATOM 5113 N LEU M 296 -5.520 -40.887-132.400 1.00 73.51 N
-ANISOU 5113 N LEU M 296 5672 13710 8549 646 -26 -3223 N
-ATOM 5114 CA LEU M 296 -6.277 -41.669-133.369 1.00 69.25 C
-ANISOU 5114 CA LEU M 296 5261 13097 7956 798 70 -3207 C
-ATOM 5115 C LEU M 296 -6.056 -41.111-134.767 1.00 78.33 C
-ANISOU 5115 C LEU M 296 6317 14497 8949 494 324 -3208 C
-ATOM 5116 O LEU M 296 -5.956 -39.894-134.950 1.00 83.85 O
-ANISOU 5116 O LEU M 296 7065 15227 9569 109 420 -3078 O
-ATOM 5117 CB LEU M 296 -7.776 -41.657-133.056 1.00 64.03 C
-ANISOU 5117 CB LEU M 296 5020 11998 7310 848 9 -2963 C
-ATOM 5118 CG LEU M 296 -8.266 -42.430-131.834 1.00 65.17 C
-ANISOU 5118 CG LEU M 296 5343 11863 7554 1140 -191 -2932 C
-ATOM 5119 CD1 LEU M 296 -9.790 -42.461-131.807 1.00 62.79 C
-ANISOU 5119 CD1 LEU M 296 5370 11219 7269 1146 -173 -2707 C
-ATOM 5120 CD2 LEU M 296 -7.697 -43.837-131.831 1.00 71.52 C
-ANISOU 5120 CD2 LEU M 296 6010 12758 8404 1486 -320 -3146 C
-ATOM 5121 N GLU M 297 -5.991 -42.000-135.755 1.00 95.69 N
-ANISOU 5121 N GLU M 297 8436 16847 11074 657 425 -3353 N
-ATOM 5122 CA GLU M 297 -5.796 -41.589-137.140 1.00 95.26 C
-ANISOU 5122 CA GLU M 297 8345 17038 10811 379 684 -3366 C
-ATOM 5123 C GLU M 297 -6.751 -42.358-138.040 1.00 87.11 C
-ANISOU 5123 C GLU M 297 7595 15823 9679 537 685 -3333 C
-ATOM 5124 O GLU M 297 -6.782 -43.593-138.014 1.00 91.33 O
-ANISOU 5124 O GLU M 297 8107 16320 10273 911 589 -3502 O
-ATOM 5125 CB GLU M 297 -4.344 -41.812-137.588 1.00 90.70 C
-ANISOU 5125 CB GLU M 297 7277 16995 10189 364 874 -3665 C
-ATOM 5126 N CYS M 298 -7.531 -41.621-138.827 1.00 87.00 N
-ANISOU 5126 N CYS M 298 7876 15667 9513 249 753 -3114 N
-ATOM 5127 CA CYS M 298 -8.468 -42.187-139.793 1.00 87.37 C
-ANISOU 5127 CA CYS M 298 8211 15543 9441 325 724 -3059 C
-ATOM 5128 C CYS M 298 -7.980 -41.819-141.190 1.00 89.34 C
-ANISOU 5128 C CYS M 298 8475 16090 9381 42 976 -3116 C
-ATOM 5129 O CYS M 298 -8.091 -40.660-141.608 1.00 90.43 O
-ANISOU 5129 O CYS M 298 8770 16216 9375 -349 1055 -2919 O
-ATOM 5130 CB CYS M 298 -9.882 -41.669-139.535 1.00 85.99 C
-ANISOU 5130 CB CYS M 298 8383 14938 9352 256 543 -2752 C
-ATOM 5131 SG CYS M 298 -11.187 -42.375-140.572 1.00101.76 S
-ANISOU 5131 SG CYS M 298 10714 16683 11268 344 410 -2659 S
-ATOM 5132 N ILE M 299 -7.441 -42.800-141.910 1.00 85.46 N
-ANISOU 5132 N ILE M 299 7857 15849 8763 239 1100 -3389 N
-ATOM 5133 CA ILE M 299 -6.779 -42.546-143.181 1.00 96.62 C
-ANISOU 5133 CA ILE M 299 9236 17631 9845 -14 1409 -3503 C
-ATOM 5134 C ILE M 299 -7.650 -43.041-144.328 1.00102.28 C
-ANISOU 5134 C ILE M 299 10365 18170 10326 16 1363 -3466 C
-ATOM 5135 O ILE M 299 -8.502 -43.923-144.174 1.00 88.36 O
-ANISOU 5135 O ILE M 299 8798 16091 8685 317 1112 -3461 O
-ATOM 5136 CB ILE M 299 -5.383 -43.201-143.247 1.00100.56 C
-ANISOU 5136 CB ILE M 299 9277 18570 10360 171 1611 -3855 C
-ATOM 5137 CG1 ILE M 299 -5.509 -44.714-143.440 1.00 92.90 C
-ANISOU 5137 CG1 ILE M 299 8393 17436 9469 660 1449 -4050 C
-ATOM 5138 CG2 ILE M 299 -4.598 -42.893-141.987 1.00 99.25 C
-ANISOU 5138 CG2 ILE M 299 8747 18468 10495 199 1510 -3866 C
-ATOM 5139 N LEU M 300 -7.416 -42.456-145.500 1.00105.65 N
-ANISOU 5139 N LEU M 300 10948 18804 10389 -338 1598 -3432 N
-ATOM 5140 CA LEU M 300 -8.016 -42.900-146.753 1.00 99.72 C
-ANISOU 5140 CA LEU M 300 10598 17966 9324 -350 1590 -3442 C
-ATOM 5141 C LEU M 300 -6.876 -43.252-147.697 1.00106.29 C
-ANISOU 5141 C LEU M 300 11252 19312 9822 -389 1996 -3766 C
-ATOM 5142 O LEU M 300 -6.211 -42.359-148.232 1.00104.22 O
-ANISOU 5142 O LEU M 300 10943 19333 9324 -813 2285 -3699 O
-ATOM 5143 CB LEU M 300 -8.916 -41.823-147.352 1.00 98.52 C
-ANISOU 5143 CB LEU M 300 10905 17543 8986 -749 1466 -3074 C
-ATOM 5144 CG LEU M 300 -9.548 -42.193-148.695 1.00 99.97 C
-ANISOU 5144 CG LEU M 300 11553 17625 8807 -804 1409 -3060 C
-ATOM 5145 CD1 LEU M 300 -10.441 -43.418-148.539 1.00 84.08 C
-ANISOU 5145 CD1 LEU M 300 9662 15299 6986 -386 1089 -3142 C
-ATOM 5146 CD2 LEU M 300 -10.320 -41.015-149.272 1.00105.79 C
-ANISOU 5146 CD2 LEU M 300 12739 18104 9353 -1207 1256 -2689 C
-ATOM 5147 N THR M 301 -6.654 -44.552-147.900 1.00118.68 N
-ANISOU 5147 N THR M 301 12769 20855 11468 40 1952 -4023 N
-ATOM 5148 CA THR M 301 -5.511 -45.023-148.674 1.00132.16 C
-ANISOU 5148 CA THR M 301 14300 22843 13071 97 2229 -4236 C
-ATOM 5149 C THR M 301 -5.601 -44.684-150.158 1.00132.58 C
-ANISOU 5149 C THR M 301 14743 23003 12629 -231 2465 -4191 C
-ATOM 5150 O THR M 301 -4.630 -44.921-150.884 1.00131.65 O
-ANISOU 5150 O THR M 301 14489 23160 12374 -243 2763 -4357 O
-ATOM 5151 CB THR M 301 -5.352 -46.536-148.493 1.00130.66 C
-ANISOU 5151 CB THR M 301 14049 22508 13086 666 2062 -4501 C
-ATOM 5152 OG1 THR M 301 -6.621 -47.179-148.672 1.00126.99 O
-ANISOU 5152 OG1 THR M 301 14037 21666 12546 843 1771 -4474 O
-ATOM 5153 CG2 THR M 301 -4.819 -46.855-147.103 1.00120.03 C
-ANISOU 5153 CG2 THR M 301 12276 21140 12192 954 1882 -4564 C
-ATOM 5154 N GLU M 302 -6.722 -44.136-150.622 1.00132.45 N
-ANISOU 5154 N GLU M 302 15219 22777 12329 -495 2323 -3971 N
-ATOM 5155 CA GLU M 302 -6.881 -43.774-152.028 1.00139.15 C
-ANISOU 5155 CA GLU M 302 16535 23669 12667 -833 2480 -3885 C
-ATOM 5156 C GLU M 302 -6.369 -42.362-152.299 1.00137.05 C
-ANISOU 5156 C GLU M 302 16262 23627 12186 -1423 2743 -3654 C
-ATOM 5157 O GLU M 302 -7.100 -41.513-152.810 1.00129.05 O
-ANISOU 5157 O GLU M 302 15727 22457 10849 -1813 2641 -3380 O
-ATOM 5158 CB GLU M 302 -8.348 -43.887-152.451 1.00136.09 C
-ANISOU 5158 CB GLU M 302 16737 22911 12059 -848 2104 -3743 C
-ATOM 5159 N LYS M 310 0.065 -39.676-150.980 1.00165.01 N
-ANISOU 5159 N LYS M 310 17329 29026 16341 -2649 4107 -3921 N
-ATOM 5160 CA LYS M 310 -0.246 -41.093-150.837 1.00150.83 C
-ANISOU 5160 CA LYS M 310 15489 27085 14733 -1954 3936 -4170 C
-ATOM 5161 C LYS M 310 -1.570 -41.289-150.108 1.00134.13 C
-ANISOU 5161 C LYS M 310 13676 24520 12767 -1703 3533 -4036 C
-ATOM 5162 O LYS M 310 -2.632 -41.368-150.730 1.00120.42 O
-ANISOU 5162 O LYS M 310 12473 22519 10762 -1719 3439 -3913 O
-ATOM 5163 CB LYS M 310 0.878 -41.816-150.088 1.00142.52 C
-ANISOU 5163 CB LYS M 310 13793 26278 14081 -1555 3922 -4468 C
-ATOM 5164 N LYS M 311 -1.497 -41.364-148.784 1.00132.54 N
-ANISOU 5164 N LYS M 311 13143 24236 12981 -1475 3285 -4061 N
-ATOM 5165 CA LYS M 311 -2.658 -41.587-147.933 1.00122.58 C
-ANISOU 5165 CA LYS M 311 12087 22580 11909 -1206 2922 -3958 C
-ATOM 5166 C LYS M 311 -2.963 -40.304-147.173 1.00123.60 C
-ANISOU 5166 C LYS M 311 12244 22635 12084 -1614 2846 -3693 C
-ATOM 5167 O LYS M 311 -2.111 -39.801-146.434 1.00119.83 O
-ANISOU 5167 O LYS M 311 11376 22340 11815 -1763 2873 -3709 O
-ATOM 5168 CB LYS M 311 -2.409 -42.743-146.964 1.00113.69 C
-ANISOU 5168 CB LYS M 311 10643 21356 11197 -601 2672 -4181 C
-ATOM 5169 N GLU M 312 -4.171 -39.779-147.360 1.00128.33 N
-ANISOU 5169 N GLU M 312 13329 22961 12470 -1792 2730 -3459 N
-ATOM 5170 CA GLU M 312 -4.615 -38.589-146.650 1.00128.75 C
-ANISOU 5170 CA GLU M 312 13530 22790 12598 -2123 2574 -3160 C
-ATOM 5171 C GLU M 312 -5.239 -38.971-145.314 1.00116.37 C
-ANISOU 5171 C GLU M 312 11883 20841 11493 -1684 2189 -3125 C
-ATOM 5172 O GLU M 312 -5.870 -40.023-145.177 1.00106.36 O
-ANISOU 5172 O GLU M 312 10683 19371 10360 -1219 2000 -3227 O
-ATOM 5173 CB GLU M 312 -5.620 -37.796-147.490 1.00134.01 C
-ANISOU 5173 CB GLU M 312 14872 23078 12966 -2459 2439 -2808 C
-ATOM 5174 CG GLU M 312 -5.003 -37.068-148.673 1.00147.78 C
-ANISOU 5174 CG GLU M 312 16800 25136 14211 -3047 2798 -2741 C
-ATOM 5175 CD GLU M 312 -5.961 -36.086-149.320 1.00159.09 C
-ANISOU 5175 CD GLU M 312 18944 26122 15379 -3409 2575 -2342 C
-ATOM 5176 OE1 GLU M 312 -6.561 -35.268-148.591 1.00163.10 O
-ANISOU 5176 OE1 GLU M 312 19642 26207 16120 -3469 2256 -2076 O
-ATOM 5177 OE2 GLU M 312 -6.113 -36.131-150.559 1.00161.90 O1-
-ANISOU 5177 OE2 GLU M 312 19692 26540 15283 -3613 2704 -2305 O1-
-ATOM 5178 N VAL M 313 -5.056 -38.103-144.323 1.00117.33 N
-ANISOU 5178 N VAL M 313 11893 20857 11831 -1865 2075 -2978 N
-ATOM 5179 CA VAL M 313 -5.557 -38.327-142.973 1.00109.92 C
-ANISOU 5179 CA VAL M 313 10894 19585 11285 -1511 1751 -2939 C
-ATOM 5180 C VAL M 313 -6.620 -37.285-142.660 1.00 93.70 C
-ANISOU 5180 C VAL M 313 9301 17029 9274 -1695 1499 -2581 C
-ATOM 5181 O VAL M 313 -6.471 -36.103-142.992 1.00 97.36 O
-ANISOU 5181 O VAL M 313 9972 17459 9561 -2165 1558 -2386 O
-ATOM 5182 CB VAL M 313 -4.423 -38.287-141.928 1.00114.12 C
-ANISOU 5182 CB VAL M 313 10899 20408 12053 -1482 1790 -3120 C
-ATOM 5183 CG1 VAL M 313 -3.453 -39.429-142.164 1.00125.51 C
-ANISOU 5183 CG1 VAL M 313 11852 22320 13515 -1174 1984 -3507 C
-ATOM 5184 CG2 VAL M 313 -3.697 -36.950-141.964 1.00116.94 C
-ANISOU 5184 CG2 VAL M 313 11197 20940 12293 -2080 1935 -2989 C
-ATOM 5185 N PHE M 314 -7.699 -37.731-142.031 1.00 80.50 N
-ANISOU 5185 N PHE M 314 7795 14962 7832 -1325 1219 -2501 N
-ATOM 5186 CA PHE M 314 -8.771 -36.861-141.559 1.00 82.89 C
-ANISOU 5186 CA PHE M 314 8457 14792 8244 -1376 972 -2212 C
-ATOM 5187 C PHE M 314 -8.611 -36.772-140.045 1.00 79.20 C
-ANISOU 5187 C PHE M 314 7792 14222 8078 -1197 850 -2249 C
-ATOM 5188 O PHE M 314 -9.052 -37.659-139.308 1.00 79.99 O
-ANISOU 5188 O PHE M 314 7798 14202 8393 -800 724 -2327 O
-ATOM 5189 CB PHE M 314 -10.137 -37.403-141.973 1.00 94.14 C
-ANISOU 5189 CB PHE M 314 10174 15890 9704 -1118 770 -2101 C
-ATOM 5190 CG PHE M 314 -10.303 -37.565-143.464 1.00101.83 C
-ANISOU 5190 CG PHE M 314 11391 16949 10352 -1279 844 -2078 C
-ATOM 5191 CD1 PHE M 314 -10.903 -36.571-144.219 1.00105.74 C
-ANISOU 5191 CD1 PHE M 314 12314 17214 10650 -1575 741 -1818 C
-ATOM 5192 CD2 PHE M 314 -9.855 -38.708-144.110 1.00100.03 C
-ANISOU 5192 CD2 PHE M 314 11010 17004 9992 -1118 994 -2325 C
-ATOM 5193 CE1 PHE M 314 -11.057 -36.713-145.587 1.00100.79 C
-ANISOU 5193 CE1 PHE M 314 11969 16648 9678 -1738 784 -1787 C
-ATOM 5194 CE2 PHE M 314 -10.006 -38.856-145.478 1.00 94.31 C
-ANISOU 5194 CE2 PHE M 314 10561 16352 8921 -1269 1067 -2318 C
-ATOM 5195 CZ PHE M 314 -10.608 -37.857-146.216 1.00 97.30 C
-ANISOU 5195 CZ PHE M 314 11378 16508 9082 -1595 960 -2041 C
-ATOM 5196 N ASN M 315 -7.975 -35.694-139.584 1.00 77.20 N
-ANISOU 5196 N ASN M 315 7518 14002 7813 -1520 878 -2186 N
-ATOM 5197 CA ASN M 315 -7.422 -35.629-138.239 1.00 84.59 C
-ANISOU 5197 CA ASN M 315 8214 14961 8966 -1420 798 -2283 C
-ATOM 5198 C ASN M 315 -8.260 -34.789-137.280 1.00 79.50 C
-ANISOU 5198 C ASN M 315 7888 13862 8456 -1382 583 -2095 C
-ATOM 5199 O ASN M 315 -7.749 -34.363-136.240 1.00 91.20 O
-ANISOU 5199 O ASN M 315 9285 15327 10042 -1429 510 -2138 O
-ATOM 5200 CB ASN M 315 -5.999 -35.075-138.295 1.00 97.08 C
-ANISOU 5200 CB ASN M 315 9493 16936 10457 -1816 963 -2390 C
-ATOM 5201 CG ASN M 315 -5.929 -33.721-138.977 1.00102.63 C
-ANISOU 5201 CG ASN M 315 10507 17556 10930 -2372 1027 -2172 C
-ATOM 5202 OD1 ASN M 315 -6.836 -33.335-139.716 1.00 70.30 O
-ANISOU 5202 OD1 ASN M 315 6838 13180 6692 -2443 978 -1971 O
-ATOM 5203 ND2 ASN M 315 -4.844 -32.993-138.734 1.00105.98 N
-ANISOU 5203 ND2 ASN M 315 10736 18213 11318 -2785 1107 -2206 N
-ATOM 5204 N ILE M 316 -9.526 -34.533-137.599 1.00 65.28 N
-ANISOU 5204 N ILE M 316 6445 11701 6656 -1284 469 -1905 N
-ATOM 5205 CA ILE M 316 -10.380 -33.713-136.745 1.00 67.40 C
-ANISOU 5205 CA ILE M 316 7005 11550 7055 -1199 292 -1755 C
-ATOM 5206 C ILE M 316 -11.730 -34.404-136.608 1.00 72.23 C
-ANISOU 5206 C ILE M 316 7697 11922 7826 -798 189 -1700 C
-ATOM 5207 O ILE M 316 -12.519 -34.430-137.561 1.00 75.88 O
-ANISOU 5207 O ILE M 316 8330 12272 8230 -792 139 -1583 O
-ATOM 5208 CB ILE M 316 -10.555 -32.285-137.277 1.00 67.50 C
-ANISOU 5208 CB ILE M 316 7410 11323 6915 -1561 227 -1551 C
-ATOM 5209 CG1 ILE M 316 -9.219 -31.545-137.238 1.00 66.21 C
-ANISOU 5209 CG1 ILE M 316 7167 11379 6612 -2022 320 -1591 C
-ATOM 5210 CG2 ILE M 316 -11.603 -31.535-136.467 1.00 69.04 C
-ANISOU 5210 CG2 ILE M 316 7916 11055 7260 -1361 34 -1428 C
-ATOM 5211 CD1 ILE M 316 -9.317 -30.130-137.698 1.00 75.86 C
-ANISOU 5211 CD1 ILE M 316 8837 12323 7663 -2426 232 -1379 C
-ATOM 5212 N LEU M 317 -12.001 -34.949-135.426 1.00 56.64 N
-ANISOU 5212 N LEU M 317 5610 9872 6040 -495 146 -1775 N
-ATOM 5213 CA LEU M 317 -13.258 -35.638-135.180 1.00 62.15 C
-ANISOU 5213 CA LEU M 317 6340 10374 6898 -162 78 -1723 C
-ATOM 5214 C LEU M 317 -14.395 -34.631-135.057 1.00 65.56 C
-ANISOU 5214 C LEU M 317 7051 10451 7407 -119 -26 -1548 C
-ATOM 5215 O LEU M 317 -14.277 -33.627-134.349 1.00 77.56 O
-ANISOU 5215 O LEU M 317 8735 11804 8931 -182 -55 -1522 O
-ATOM 5216 CB LEU M 317 -13.148 -36.483-133.912 1.00 67.96 C
-ANISOU 5216 CB LEU M 317 6918 11138 7768 98 82 -1842 C
-ATOM 5217 CG LEU M 317 -14.368 -37.306-133.507 1.00 72.75 C
-ANISOU 5217 CG LEU M 317 7531 11577 8533 391 47 -1790 C
-ATOM 5218 CD1 LEU M 317 -14.621 -38.406-134.520 1.00 68.03 C
-ANISOU 5218 CD1 LEU M 317 6837 11087 7925 449 30 -1812 C
-ATOM 5219 CD2 LEU M 317 -14.163 -37.891-132.119 1.00 75.81 C
-ANISOU 5219 CD2 LEU M 317 7863 11953 8988 574 53 -1879 C
-ATOM 5220 N GLN M 318 -15.495 -34.896-135.756 1.00 61.39 N
-ANISOU 5220 N GLN M 318 6580 9801 6946 3 -105 -1443 N
-ATOM 5221 CA GLN M 318 -16.661 -34.024-135.723 1.00 55.47 C
-ANISOU 5221 CA GLN M 318 6036 8730 6310 111 -232 -1296 C
-ATOM 5222 C GLN M 318 -17.795 -34.575-134.875 1.00 57.56 C
-ANISOU 5222 C GLN M 318 6165 8886 6821 445 -227 -1298 C
-ATOM 5223 O GLN M 318 -18.597 -33.792-134.356 1.00 63.95 O
-ANISOU 5223 O GLN M 318 7082 9461 7755 599 -270 -1242 O
-ATOM 5224 CB GLN M 318 -17.181 -33.776-137.144 1.00 54.43 C
-ANISOU 5224 CB GLN M 318 6068 8522 6091 1 -377 -1158 C
-ATOM 5225 CG GLN M 318 -16.176 -33.125-138.074 1.00 65.71 C
-ANISOU 5225 CG GLN M 318 7693 10044 7229 -383 -359 -1120 C
-ATOM 5226 CD GLN M 318 -15.869 -31.691-137.689 1.00 72.84 C
-ANISOU 5226 CD GLN M 318 8883 10723 8071 -559 -414 -1046 C
-ATOM 5227 OE1 GLN M 318 -14.707 -31.287-137.632 1.00 75.49 O
-ANISOU 5227 OE1 GLN M 318 9243 11202 8238 -870 -311 -1091 O
-ATOM 5228 NE2 GLN M 318 -16.915 -30.909-137.434 1.00 62.66 N
-ANISOU 5228 NE2 GLN M 318 7805 9075 6925 -361 -591 -940 N
-ATOM 5229 N ALA M 319 -17.881 -35.895-134.730 1.00 53.70 N
-ANISOU 5229 N ALA M 319 5452 8556 6394 555 -168 -1366 N
-ATOM 5230 CA ALA M 319 -18.929 -36.544-133.954 1.00 55.04 C
-ANISOU 5230 CA ALA M 319 5483 8655 6773 798 -135 -1354 C
-ATOM 5231 C ALA M 319 -18.594 -38.024-133.847 1.00 61.65 C
-ANISOU 5231 C ALA M 319 6158 9667 7599 829 -91 -1440 C
-ATOM 5232 O ALA M 319 -17.878 -38.579-134.688 1.00 63.19 O
-ANISOU 5232 O ALA M 319 6330 10016 7665 721 -123 -1502 O
-ATOM 5233 CB ALA M 319 -20.312 -36.351-134.585 1.00 53.22 C
-ANISOU 5233 CB ALA M 319 5228 8279 6716 903 -266 -1224 C
-ATOM 5234 N ALA M 320 -19.130 -38.658-132.807 1.00 60.61 N
-ANISOU 5234 N ALA M 320 5942 9498 7588 980 -14 -1449 N
-ATOM 5235 CA ALA M 320 -18.894 -40.075-132.580 1.00 54.38 C
-ANISOU 5235 CA ALA M 320 5070 8802 6790 1018 -9 -1513 C
-ATOM 5236 C ALA M 320 -20.123 -40.697-131.935 1.00 46.89 C
-ANISOU 5236 C ALA M 320 4040 7760 6014 1117 38 -1429 C
-ATOM 5237 O ALA M 320 -21.038 -40.004-131.483 1.00 54.51 O
-ANISOU 5237 O ALA M 320 4969 8635 7107 1188 115 -1355 O
-ATOM 5238 CB ALA M 320 -17.656 -40.302-131.710 1.00 46.55 C
-ANISOU 5238 CB ALA M 320 4114 7903 5669 1032 42 -1646 C
-ATOM 5239 N TYR M 321 -20.125 -42.028-131.886 1.00 51.55 N
-ANISOU 5239 N TYR M 321 4606 8375 6606 1118 -3 -1449 N
-ATOM 5240 CA TYR M 321 -21.227 -42.782-131.302 1.00 50.09 C
-ANISOU 5240 CA TYR M 321 4353 8117 6563 1132 46 -1356 C
-ATOM 5241 C TYR M 321 -20.775 -44.211-131.040 1.00 55.70 C
-ANISOU 5241 C TYR M 321 5156 8812 7194 1120 -23 -1404 C
-ATOM 5242 O TYR M 321 -20.273 -44.880-131.950 1.00 61.46 O
-ANISOU 5242 O TYR M 321 5920 9569 7862 1104 -177 -1477 O
-ATOM 5243 CB TYR M 321 -22.443 -42.755-132.229 1.00 48.41 C
-ANISOU 5243 CB TYR M 321 3982 7874 6538 1084 -52 -1244 C
-ATOM 5244 CG TYR M 321 -23.700 -43.367-131.658 1.00 57.96 C
-ANISOU 5244 CG TYR M 321 5038 9048 7935 1051 23 -1136 C
-ATOM 5245 CD1 TYR M 321 -24.619 -42.592-130.961 1.00 70.66 C
-ANISOU 5245 CD1 TYR M 321 6490 10662 9696 1128 201 -1078 C
-ATOM 5246 CD2 TYR M 321 -23.973 -44.715-131.821 1.00 61.93 C
-ANISOU 5246 CD2 TYR M 321 5553 9517 8461 935 -77 -1101 C
-ATOM 5247 CE1 TYR M 321 -25.774 -43.146-130.443 1.00 70.14 C
-ANISOU 5247 CE1 TYR M 321 6223 10621 9805 1067 317 -985 C
-ATOM 5248 CE2 TYR M 321 -25.119 -45.277-131.304 1.00 68.62 C
-ANISOU 5248 CE2 TYR M 321 6247 10348 9475 833 4 -985 C
-ATOM 5249 CZ TYR M 321 -26.017 -44.489-130.616 1.00 63.87 C
-ANISOU 5249 CZ TYR M 321 5432 9807 9029 889 221 -927 C
-ATOM 5250 OH TYR M 321 -27.161 -45.055-130.103 1.00 65.53 O
-ANISOU 5250 OH TYR M 321 5434 10057 9409 757 346 -818 O
-ATOM 5251 N VAL M 322 -20.933 -44.689-129.811 1.00 53.23 N
-ANISOU 5251 N VAL M 322 4928 8439 6858 1136 81 -1373 N
-ATOM 5252 CA VAL M 322 -20.545 -46.051-129.471 1.00 51.99 C
-ANISOU 5252 CA VAL M 322 4932 8206 6615 1131 -26 -1399 C
-ATOM 5253 C VAL M 322 -21.771 -46.943-129.585 1.00 56.86 C
-ANISOU 5253 C VAL M 322 5510 8728 7366 989 -45 -1259 C
-ATOM 5254 O VAL M 322 -22.860 -46.580-129.126 1.00 66.47 O
-ANISOU 5254 O VAL M 322 6589 9958 8710 912 126 -1137 O
-ATOM 5255 CB VAL M 322 -19.930 -46.120-128.066 1.00 57.78 C
-ANISOU 5255 CB VAL M 322 5859 8898 7198 1198 49 -1430 C
-ATOM 5256 CG1 VAL M 322 -19.319 -47.493-127.828 1.00 52.20 C
-ANISOU 5256 CG1 VAL M 322 5368 8080 6387 1238 -141 -1477 C
-ATOM 5257 CG2 VAL M 322 -18.886 -45.028-127.891 1.00 58.65 C
-ANISOU 5257 CG2 VAL M 322 5961 9110 7212 1289 71 -1552 C
-ATOM 5258 N SER M 323 -21.599 -48.101-130.217 1.00 61.96 N
-ANISOU 5258 N SER M 323 6266 9287 7990 953 -256 -1289 N
-ATOM 5259 CA SER M 323 -22.718 -48.983-130.515 1.00 65.11 C
-ANISOU 5259 CA SER M 323 6640 9580 8519 766 -335 -1159 C
-ATOM 5260 C SER M 323 -22.194 -50.397-130.696 1.00 59.45 C
-ANISOU 5260 C SER M 323 6209 8686 7694 767 -573 -1222 C
-ATOM 5261 O SER M 323 -20.996 -50.615-130.889 1.00 65.11 O
-ANISOU 5261 O SER M 323 7067 9403 8267 957 -688 -1394 O
-ATOM 5262 CB SER M 323 -23.470 -48.521-131.770 1.00 79.40 C
-ANISOU 5262 CB SER M 323 8217 11459 10493 698 -422 -1124 C
-ATOM 5263 OG SER M 323 -24.303 -49.547-132.282 1.00 93.41 O
-ANISOU 5263 OG SER M 323 10002 13118 12370 510 -599 -1040 O
-ATOM 5264 N LYS M 324 -23.094 -51.342-130.628 1.00 60.76 N
-ANISOU 5264 N LYS M 324 6450 8701 7936 555 -651 -1090 N
-ATOM 5265 CA LYS M 324 -22.615 -52.667-130.984 1.00 67.19 C
-ANISOU 5265 CA LYS M 324 7586 9296 8648 573 -934 -1167 C
-ATOM 5266 C LYS M 324 -22.884 -52.945-132.463 1.00 69.02 C
-ANISOU 5266 C LYS M 324 7770 9510 8945 532 -1151 -1233 C
-ATOM 5267 O LYS M 324 -23.832 -52.405-133.041 1.00 69.19 O
-ANISOU 5267 O LYS M 324 7528 9631 9130 382 -1121 -1135 O
-ATOM 5268 CB LYS M 324 -23.283 -53.726-130.110 1.00 69.22 C
-ANISOU 5268 CB LYS M 324 8081 9325 8895 332 -964 -992 C
-ATOM 5269 CG LYS M 324 -22.933 -53.576-128.632 1.00 66.16 C
-ANISOU 5269 CG LYS M 324 7850 8921 8366 370 -778 -932 C
-ATOM 5270 CD LYS M 324 -23.457 -54.727-127.790 1.00 67.27 C
-ANISOU 5270 CD LYS M 324 8332 8802 8426 107 -831 -752 C
-ATOM 5271 N PRO M 325 -22.058 -53.758-133.115 1.00 66.92 N
-ANISOU 5271 N PRO M 325 7761 9119 8546 688 -1386 -1415 N
-ATOM 5272 CA PRO M 325 -22.173 -53.930-134.564 1.00 57.42 C
-ANISOU 5272 CA PRO M 325 6561 7917 7338 681 -1575 -1518 C
-ATOM 5273 C PRO M 325 -23.164 -55.016-134.958 1.00 65.42 C
-ANISOU 5273 C PRO M 325 7751 8677 8430 418 -1826 -1413 C
-ATOM 5274 O PRO M 325 -23.495 -55.915-134.182 1.00 75.87 O
-ANISOU 5274 O PRO M 325 9290 9772 9766 270 -1899 -1302 O
-ATOM 5275 CB PRO M 325 -20.749 -54.337-134.965 1.00 67.51 C
-ANISOU 5275 CB PRO M 325 8040 9195 8416 1005 -1671 -1800 C
-ATOM 5276 CG PRO M 325 -20.272 -55.118-133.793 1.00 58.33 C
-ANISOU 5276 CG PRO M 325 7124 7841 7198 1106 -1726 -1801 C
-ATOM 5277 CD PRO M 325 -20.894 -54.482-132.571 1.00 63.89 C
-ANISOU 5277 CD PRO M 325 7676 8605 7995 930 -1494 -1568 C
-ATOM 5278 N GLY M 326 -23.645 -54.902-136.200 1.00 70.66 N
-ANISOU 5278 N GLY M 326 8347 9371 9129 329 -1979 -1439 N
-ATOM 5279 CA GLY M 326 -24.347 -56.001-136.823 1.00 75.78 C
-ANISOU 5279 CA GLY M 326 9227 9759 9806 110 -2296 -1407 C
-ATOM 5280 C GLY M 326 -23.391 -57.092-137.264 1.00 81.80 C
-ANISOU 5280 C GLY M 326 10444 10289 10347 329 -2527 -1652 C
-ATOM 5281 O GLY M 326 -22.183 -56.884-137.351 1.00 84.61 O
-ANISOU 5281 O GLY M 326 10851 10757 10541 671 -2434 -1874 O
-ATOM 5282 N ALA M 327 -23.957 -58.266-137.557 1.00 78.70 N
-ANISOU 5282 N ALA M 327 10373 9569 9960 126 -2840 -1621 N
-ATOM 5283 CA ALA M 327 -23.142 -59.461-137.769 1.00 77.85 C
-ANISOU 5283 CA ALA M 327 10770 9153 9658 348 -3092 -1848 C
-ATOM 5284 C ALA M 327 -22.126 -59.264-138.891 1.00 87.36 C
-ANISOU 5284 C ALA M 327 12044 10496 10653 712 -3103 -2178 C
-ATOM 5285 O ALA M 327 -20.947 -59.614-138.744 1.00 93.55 O
-ANISOU 5285 O ALA M 327 13000 11259 11286 1094 -3088 -2425 O
-ATOM 5286 CB ALA M 327 -24.044 -60.658-138.062 1.00 82.20 C
-ANISOU 5286 CB ALA M 327 11678 9306 10247 14 -3461 -1753 C
-ATOM 5287 N GLN M 328 -22.564 -58.697-140.017 1.00 86.09 N
-ANISOU 5287 N GLN M 328 11743 10494 10471 601 -3128 -2191 N
-ATOM 5288 CA GLN M 328 -21.682 -58.539-141.171 1.00 79.25 C
-ANISOU 5288 CA GLN M 328 10987 9770 9356 884 -3115 -2495 C
-ATOM 5289 C GLN M 328 -20.472 -57.675-140.826 1.00 80.00 C
-ANISOU 5289 C GLN M 328 10816 10210 9370 1204 -2764 -2636 C
-ATOM 5290 O GLN M 328 -19.322 -58.130-140.886 1.00 85.86 O
-ANISOU 5290 O GLN M 328 11706 10965 9951 1561 -2736 -2923 O
-ATOM 5291 CB GLN M 328 -22.461 -57.935-142.340 1.00 70.09 C
-ANISOU 5291 CB GLN M 328 9734 8725 8173 653 -3202 -2423 C
-ATOM 5292 CG GLN M 328 -21.715 -57.969-143.659 1.00 84.14 C
-ANISOU 5292 CG GLN M 328 11748 10592 9628 866 -3229 -2726 C
-ATOM 5293 CD GLN M 328 -22.353 -57.086-144.711 1.00 95.84 C
-ANISOU 5293 CD GLN M 328 13121 12241 11052 654 -3270 -2625 C
-ATOM 5294 OE1 GLN M 328 -23.166 -56.217-144.400 1.00101.86 O
-ANISOU 5294 OE1 GLN M 328 13541 13120 12039 432 -3222 -2350 O
-ATOM 5295 NE2 GLN M 328 -21.995 -57.314-145.969 1.00 99.31 N
-ANISOU 5295 NE2 GLN M 328 13879 12680 11174 739 -3374 -2856 N
-ATOM 5296 N LEU M 329 -20.717 -56.415-140.458 1.00 65.44 N
-ANISOU 5296 N LEU M 329 8568 8648 7649 1084 -2508 -2448 N
-ATOM 5297 CA LEU M 329 -19.618 -55.539-140.071 1.00 64.92 C
-ANISOU 5297 CA LEU M 329 8250 8896 7522 1319 -2196 -2555 C
-ATOM 5298 C LEU M 329 -18.802 -56.133-138.930 1.00 77.21 C
-ANISOU 5298 C LEU M 329 9878 10361 9099 1564 -2176 -2646 C
-ATOM 5299 O LEU M 329 -17.581 -55.946-138.879 1.00 70.04 O
-ANISOU 5299 O LEU M 329 8880 9651 8083 1862 -2038 -2874 O
-ATOM 5300 CB LEU M 329 -20.156 -54.160-139.685 1.00 59.66 C
-ANISOU 5300 CB LEU M 329 7211 8452 7006 1129 -1977 -2311 C
-ATOM 5301 CG LEU M 329 -19.127 -53.166-139.148 1.00 66.30 C
-ANISOU 5301 CG LEU M 329 7800 9585 7807 1297 -1677 -2378 C
-ATOM 5302 CD1 LEU M 329 -18.038 -52.900-140.175 1.00 58.37 C
-ANISOU 5302 CD1 LEU M 329 6802 8818 6556 1464 -1572 -2642 C
-ATOM 5303 CD2 LEU M 329 -19.802 -51.873-138.729 1.00 71.27 C
-ANISOU 5303 CD2 LEU M 329 8141 10347 8591 1111 -1511 -2134 C
-ATOM 5304 N ALA M 330 -19.453 -56.866-138.020 1.00 83.03 N
-ANISOU 5304 N ALA M 330 10781 10801 9967 1430 -2328 -2470 N
-ATOM 5305 CA ALA M 330 -18.741 -57.469-136.896 1.00 72.03 C
-ANISOU 5305 CA ALA M 330 9535 9265 8568 1647 -2367 -2525 C
-ATOM 5306 C ALA M 330 -17.679 -58.445-137.379 1.00 73.52 C
-ANISOU 5306 C ALA M 330 10012 9327 8593 2038 -2556 -2872 C
-ATOM 5307 O ALA M 330 -16.519 -58.375-136.959 1.00 76.30 O
-ANISOU 5307 O ALA M 330 10275 9818 8899 2380 -2485 -3067 O
-ATOM 5308 CB ALA M 330 -19.726 -58.169-135.960 1.00 68.89 C
-ANISOU 5308 CB ALA M 330 9351 8537 8288 1366 -2510 -2254 C
-ATOM 5309 N ARG M 331 -18.057 -59.369-138.267 1.00 78.38 N
-ANISOU 5309 N ARG M 331 10972 9680 9129 2009 -2816 -2971 N
-ATOM 5310 CA ARG M 331 -17.061 -60.276-138.823 1.00 86.64 C
-ANISOU 5310 CA ARG M 331 12305 10607 10008 2432 -2983 -3348 C
-ATOM 5311 C ARG M 331 -16.093 -59.556-139.754 1.00 82.07 C
-ANISOU 5311 C ARG M 331 11439 10463 9280 2685 -2723 -3638 C
-ATOM 5312 O ARG M 331 -15.026 -60.101-140.057 1.00 88.17 O
-ANISOU 5312 O ARG M 331 12301 11269 9931 3113 -2756 -3993 O
-ATOM 5313 CB ARG M 331 -17.743 -61.434-139.558 1.00 91.48 C
-ANISOU 5313 CB ARG M 331 13418 10795 10547 2322 -3341 -3394 C
-ATOM 5314 CG ARG M 331 -18.235 -61.091-140.952 1.00 98.00 C
-ANISOU 5314 CG ARG M 331 14226 11752 11257 2147 -3323 -3449 C
-ATOM 5315 CD ARG M 331 -19.354 -62.019-141.393 1.00102.41 C
-ANISOU 5315 CD ARG M 331 15210 11876 11824 1829 -3701 -3334 C
-ATOM 5316 NE ARG M 331 -20.056 -61.495-142.562 1.00109.84 N
-ANISOU 5316 NE ARG M 331 16078 12960 12697 1566 -3709 -3290 N
-ATOM 5317 CZ ARG M 331 -21.235 -61.937-142.987 1.00118.38 C
-ANISOU 5317 CZ ARG M 331 17370 13772 13837 1175 -4011 -3118 C
-ATOM 5318 NH1 ARG M 331 -21.855 -62.909-142.332 1.00125.61 N1+
-ANISOU 5318 NH1 ARG M 331 18577 14269 14880 959 -4295 -2962 N1+
-ATOM 5319 NH2 ARG M 331 -21.798 -61.402-144.063 1.00112.40 N
-ANISOU 5319 NH2 ARG M 331 16543 13159 13006 973 -4050 -3089 N
-ATOM 5320 N GLN M 332 -16.433 -58.343-140.204 1.00 79.05 N
-ANISOU 5320 N GLN M 332 10718 10418 8901 2431 -2463 -3498 N
-ATOM 5321 CA GLN M 332 -15.536 -57.583-141.071 1.00 81.54 C
-ANISOU 5321 CA GLN M 332 10781 11156 9044 2586 -2186 -3731 C
-ATOM 5322 C GLN M 332 -14.461 -56.816-140.305 1.00 86.35 C
-ANISOU 5322 C GLN M 332 10988 12110 9712 2772 -1921 -3797 C
-ATOM 5323 O GLN M 332 -13.477 -56.389-140.917 1.00 91.08 O
-ANISOU 5323 O GLN M 332 11371 13069 10168 2946 -1694 -4046 O
-ATOM 5324 CB GLN M 332 -16.338 -56.603-141.933 1.00 88.96 C
-ANISOU 5324 CB GLN M 332 11605 12265 9932 2222 -2070 -3542 C
-ATOM 5325 CG GLN M 332 -17.110 -57.250-143.074 1.00 96.06 C
-ANISOU 5325 CG GLN M 332 12877 12931 10692 2083 -2321 -3578 C
-ATOM 5326 CD GLN M 332 -17.936 -56.252-143.863 1.00101.73 C
-ANISOU 5326 CD GLN M 332 13489 13792 11370 1734 -2271 -3367 C
-ATOM 5327 OE1 GLN M 332 -17.498 -55.736-144.891 1.00104.59 O
-ANISOU 5327 OE1 GLN M 332 13856 14400 11484 1749 -2120 -3508 O
-ATOM 5328 NE2 GLN M 332 -19.139 -55.971-143.381 1.00107.98 N
-ANISOU 5328 NE2 GLN M 332 14188 14437 12403 1422 -2398 -3029 N
-ATOM 5329 N ILE M 333 -14.621 -56.618-138.997 1.00 83.44 N
-ANISOU 5329 N ILE M 333 10516 11656 9530 2712 -1938 -3584 N
-ATOM 5330 CA ILE M 333 -13.642 -55.879-138.211 1.00 83.31 C
-ANISOU 5330 CA ILE M 333 10146 11938 9570 2857 -1738 -3634 C
-ATOM 5331 C ILE M 333 -13.099 -56.716-137.054 1.00 88.56 C
-ANISOU 5331 C ILE M 333 10946 12382 10320 3148 -1952 -3702 C
-ATOM 5332 O ILE M 333 -12.559 -56.171-136.096 1.00 77.30 O
-ANISOU 5332 O ILE M 333 9297 11102 8974 3202 -1872 -3656 O
-ATOM 5333 CB ILE M 333 -14.223 -54.546-137.701 1.00 76.43 C
-ANISOU 5333 CB ILE M 333 9010 11228 8803 2513 -1528 -3322 C
-ATOM 5334 CG1 ILE M 333 -15.417 -54.799-136.781 1.00 80.37 C
-ANISOU 5334 CG1 ILE M 333 9685 11399 9454 2281 -1664 -3002 C
-ATOM 5335 CG2 ILE M 333 -14.628 -53.660-138.867 1.00 65.63 C
-ANISOU 5335 CG2 ILE M 333 7531 10069 7336 2268 -1356 -3267 C
-ATOM 5336 CD1 ILE M 333 -16.057 -53.533-136.268 1.00 73.68 C
-ANISOU 5336 CD1 ILE M 333 8591 10691 8715 1999 -1456 -2728 C
-ATOM 5337 N GLY M 334 -13.235 -58.037-137.135 1.00103.11 N
-ANISOU 5337 N GLY M 334 13201 13843 12132 3331 -2261 -3808 N
-ATOM 5338 CA GLY M 334 -12.696 -58.911-136.107 1.00104.75 C
-ANISOU 5338 CA GLY M 334 13623 13784 12393 3636 -2527 -3878 C
-ATOM 5339 C GLY M 334 -13.323 -58.725-134.745 1.00 97.94 C
-ANISOU 5339 C GLY M 334 12850 12727 11635 3382 -2577 -3525 C
-ATOM 5340 O GLY M 334 -12.652 -58.921-133.726 1.00101.41 O
-ANISOU 5340 O GLY M 334 13323 13106 12104 3606 -2702 -3555 O
-ATOM 5341 N ALA M 335 -14.595 -58.348-134.697 1.00 85.79 N
-ANISOU 5341 N ALA M 335 11347 11104 10144 2929 -2484 -3200 N
-ATOM 5342 CA ALA M 335 -15.291 -58.111-133.444 1.00 80.46 C
-ANISOU 5342 CA ALA M 335 10734 10291 9545 2655 -2456 -2868 C
-ATOM 5343 C ALA M 335 -16.384 -59.151-133.240 1.00 88.36 C
-ANISOU 5343 C ALA M 335 12180 10837 10554 2395 -2690 -2658 C
-ATOM 5344 O ALA M 335 -16.724 -59.927-134.137 1.00 93.99 O
-ANISOU 5344 O ALA M 335 13134 11343 11234 2377 -2879 -2744 O
-ATOM 5345 CB ALA M 335 -15.886 -56.698-133.411 1.00 72.23 C
-ANISOU 5345 CB ALA M 335 9299 9569 8577 2341 -2111 -2662 C
-ATOM 5346 N SER M 336 -16.925 -59.159-132.029 1.00 93.10 N
-ANISOU 5346 N SER M 336 12908 11284 11181 2168 -2671 -2380 N
-ATOM 5347 CA SER M 336 -18.045 -60.011-131.669 1.00 99.70 C
-ANISOU 5347 CA SER M 336 14119 11735 12027 1810 -2826 -2120 C
-ATOM 5348 C SER M 336 -19.322 -59.182-131.591 1.00 90.74 C
-ANISOU 5348 C SER M 336 12676 10785 11014 1346 -2534 -1829 C
-ATOM 5349 O SER M 336 -19.297 -57.949-131.602 1.00 82.44 O
-ANISOU 5349 O SER M 336 11196 10102 10025 1339 -2235 -1813 O
-ATOM 5350 CB SER M 336 -17.777 -60.722-130.338 1.00113.20 C
-ANISOU 5350 CB SER M 336 16249 13123 13641 1856 -3013 -2006 C
-ATOM 5351 OG SER M 336 -16.570 -61.465-130.389 1.00119.31 O
-ANISOU 5351 OG SER M 336 17280 13722 14330 2349 -3326 -2294 O
-ATOM 5352 N LEU M 337 -20.454 -59.882-131.509 1.00 93.88 N
-ANISOU 5352 N LEU M 337 13300 10913 11458 955 -2639 -1602 N
-ATOM 5353 CA LEU M 337 -21.743 -59.202-131.554 1.00 89.62 C
-ANISOU 5353 CA LEU M 337 12416 10561 11075 532 -2392 -1354 C
-ATOM 5354 C LEU M 337 -21.985 -58.352-130.314 1.00107.75 C
-ANISOU 5354 C LEU M 337 14498 13055 13386 416 -2053 -1164 C
-ATOM 5355 O LEU M 337 -22.729 -57.368-130.378 1.00112.89 O
-ANISOU 5355 O LEU M 337 14727 13989 14177 242 -1774 -1050 O
-ATOM 5356 CB LEU M 337 -22.867 -60.221-131.724 1.00 78.43 C
-ANISOU 5356 CB LEU M 337 11259 8824 9715 107 -2598 -1162 C
-ATOM 5357 CG LEU M 337 -23.045 -60.765-133.140 1.00 76.55 C
-ANISOU 5357 CG LEU M 337 11125 8458 9504 104 -2886 -1313 C
-ATOM 5358 CD1 LEU M 337 -24.022 -61.929-133.153 1.00 78.95 C
-ANISOU 5358 CD1 LEU M 337 11787 8369 9841 -333 -3159 -1127 C
-ATOM 5359 CD2 LEU M 337 -23.507 -59.659-134.069 1.00 70.04 C
-ANISOU 5359 CD2 LEU M 337 9787 8009 8815 55 -2706 -1332 C
-ATOM 5360 N ASN M 338 -21.369 -58.706-129.187 1.00113.19 N
-ANISOU 5360 N ASN M 338 15498 13587 13921 532 -2092 -1139 N
-ATOM 5361 CA ASN M 338 -21.578 -57.997-127.933 1.00109.08 C
-ANISOU 5361 CA ASN M 338 14879 13215 13354 417 -1786 -968 C
-ATOM 5362 C ASN M 338 -20.524 -56.932-127.665 1.00 97.85 C
-ANISOU 5362 C ASN M 338 13224 12072 11884 775 -1644 -1144 C
-ATOM 5363 O ASN M 338 -20.632 -56.215-126.666 1.00 99.52 O
-ANISOU 5363 O ASN M 338 13358 12417 12038 713 -1391 -1038 O
-ATOM 5364 CB ASN M 338 -21.613 -58.992-126.771 1.00117.78 C
-ANISOU 5364 CB ASN M 338 16524 13958 14267 265 -1922 -797 C
-ATOM 5365 CG ASN M 338 -22.600 -60.117-127.002 1.00133.64 C
-ANISOU 5365 CG ASN M 338 18821 15650 16306 -145 -2093 -611 C
-ATOM 5366 OD1 ASN M 338 -22.258 -61.147-127.585 1.00136.80 O
-ANISOU 5366 OD1 ASN M 338 19589 15720 16671 -44 -2479 -716 O
-ATOM 5367 ND2 ASN M 338 -23.833 -59.926-126.547 1.00141.45 N
-ANISOU 5367 ND2 ASN M 338 19638 16741 17366 -614 -1807 -344 N
-ATOM 5368 N ASP M 339 -19.522 -56.804-128.530 1.00 87.05 N
-ANISOU 5368 N ASP M 339 11745 10804 10525 1123 -1788 -1416 N
-ATOM 5369 CA ASP M 339 -18.447 -55.849-128.311 1.00 91.54 C
-ANISOU 5369 CA ASP M 339 12083 11643 11055 1420 -1681 -1588 C
-ATOM 5370 C ASP M 339 -18.893 -54.429-128.641 1.00 88.17 C
-ANISOU 5370 C ASP M 339 11196 11563 10743 1306 -1348 -1546 C
-ATOM 5371 O ASP M 339 -19.714 -54.200-129.532 1.00 92.84 O
-ANISOU 5371 O ASP M 339 11584 12230 11462 1135 -1277 -1492 O
-ATOM 5372 CB ASP M 339 -17.224 -56.220-129.150 1.00 94.34 C
-ANISOU 5372 CB ASP M 339 12432 12029 11384 1806 -1913 -1902 C
-ATOM 5373 CG ASP M 339 -16.795 -57.660-128.949 1.00112.88 C
-ANISOU 5373 CG ASP M 339 15258 13991 13639 1987 -2293 -1979 C
-ATOM 5374 OD1 ASP M 339 -17.102 -58.229-127.880 1.00121.41 O
-ANISOU 5374 OD1 ASP M 339 16708 14795 14629 1856 -2392 -1790 O
-ATOM 5375 OD2 ASP M 339 -16.149 -58.226-129.856 1.00118.42 O1-
-ANISOU 5375 OD2 ASP M 339 15998 14654 14340 2264 -2493 -2232 O1-
-ATOM 5376 N ASP M 340 -18.340 -53.470-127.903 1.00 86.71 N
-ANISOU 5376 N ASP M 340 10880 11561 10505 1407 -1183 -1575 N
-ATOM 5377 CA ASP M 340 -18.610 -52.060-128.136 1.00 76.93 C
-ANISOU 5377 CA ASP M 340 9271 10606 9354 1344 -905 -1557 C
-ATOM 5378 C ASP M 340 -17.657 -51.522-129.193 1.00 74.00 C
-ANISOU 5378 C ASP M 340 8666 10451 8998 1538 -947 -1782 C
-ATOM 5379 O ASP M 340 -16.438 -51.694-129.085 1.00 79.84 O
-ANISOU 5379 O ASP M 340 9438 11242 9657 1776 -1078 -1971 O
-ATOM 5380 CB ASP M 340 -18.466 -51.253-126.845 1.00 81.50 C
-ANISOU 5380 CB ASP M 340 9874 11250 9843 1340 -719 -1493 C
-ATOM 5381 CG ASP M 340 -19.618 -51.472-125.888 1.00101.13 C
-ANISOU 5381 CG ASP M 340 12510 13612 12303 1091 -544 -1257 C
-ATOM 5382 OD1 ASP M 340 -20.732 -51.789-126.358 1.00105.56 O
-ANISOU 5382 OD1 ASP M 340 12976 14139 12994 873 -479 -1126 O
-ATOM 5383 OD2 ASP M 340 -19.412 -51.315-124.666 1.00113.15 O1-
-ANISOU 5383 OD2 ASP M 340 14239 15089 13665 1096 -466 -1208 O1-
-ATOM 5384 N ILE M 341 -18.218 -50.872-130.209 1.00 70.06 N
-ANISOU 5384 N ILE M 341 7928 10091 8600 1426 -840 -1759 N
-ATOM 5385 CA ILE M 341 -17.454 -50.241-131.278 1.00 75.55 C
-ANISOU 5385 CA ILE M 341 8421 11008 9275 1529 -826 -1933 C
-ATOM 5386 C ILE M 341 -17.665 -48.735-131.191 1.00 66.75 C
-ANISOU 5386 C ILE M 341 7085 10073 8205 1431 -603 -1859 C
-ATOM 5387 O ILE M 341 -18.783 -48.267-130.947 1.00 52.02 O
-ANISOU 5387 O ILE M 341 5160 8163 6443 1280 -483 -1680 O
-ATOM 5388 CB ILE M 341 -17.858 -50.777-132.669 1.00 72.56 C
-ANISOU 5388 CB ILE M 341 8051 10598 8919 1480 -944 -1978 C
-ATOM 5389 CG1 ILE M 341 -17.122 -52.079-132.992 1.00 74.73 C
-ANISOU 5389 CG1 ILE M 341 8544 10747 9104 1683 -1176 -2172 C
-ATOM 5390 CG2 ILE M 341 -17.552 -49.760-133.752 1.00 66.41 C
-ANISOU 5390 CG2 ILE M 341 7062 10060 8109 1457 -840 -2054 C
-ATOM 5391 CD1 ILE M 341 -17.587 -53.273-132.210 1.00 80.69 C
-ANISOU 5391 CD1 ILE M 341 9613 11178 9868 1655 -1353 -2071 C
-ATOM 5392 N LEU M 342 -16.584 -47.982-131.375 1.00 66.43 N
-ANISOU 5392 N LEU M 342 6918 10231 8091 1517 -555 -2003 N
-ATOM 5393 CA LEU M 342 -16.625 -46.527-131.432 1.00 61.25 C
-ANISOU 5393 CA LEU M 342 6110 9712 7450 1416 -388 -1952 C
-ATOM 5394 C LEU M 342 -16.671 -46.105-132.896 1.00 61.03 C
-ANISOU 5394 C LEU M 342 5977 9802 7408 1332 -383 -1983 C
-ATOM 5395 O LEU M 342 -15.686 -46.261-133.623 1.00 65.29 O
-ANISOU 5395 O LEU M 342 6463 10502 7843 1387 -410 -2155 O
-ATOM 5396 CB LEU M 342 -15.411 -45.920-130.734 1.00 60.90 C
-ANISOU 5396 CB LEU M 342 6019 9801 7321 1488 -358 -2073 C
-ATOM 5397 CG LEU M 342 -15.230 -44.415-130.941 1.00 56.90 C
-ANISOU 5397 CG LEU M 342 5400 9420 6801 1359 -225 -2049 C
-ATOM 5398 CD1 LEU M 342 -16.351 -43.642-130.265 1.00 71.40 C
-ANISOU 5398 CD1 LEU M 342 7304 11111 8712 1288 -106 -1872 C
-ATOM 5399 CD2 LEU M 342 -13.873 -43.954-130.447 1.00 48.28 C
-ANISOU 5399 CD2 LEU M 342 4232 8488 5626 1388 -243 -2197 C
-ATOM 5400 N PHE M 343 -17.808 -45.571-133.327 1.00 61.45 N
-ANISOU 5400 N PHE M 343 6001 9789 7558 1205 -351 -1822 N
-ATOM 5401 CA PHE M 343 -17.942 -45.044-134.678 1.00 50.22 C
-ANISOU 5401 CA PHE M 343 4542 8445 6095 1106 -379 -1816 C
-ATOM 5402 C PHE M 343 -17.617 -43.555-134.677 1.00 63.75 C
-ANISOU 5402 C PHE M 343 6207 10245 7768 1024 -265 -1781 C
-ATOM 5403 O PHE M 343 -18.181 -42.791-133.888 1.00 74.21 O
-ANISOU 5403 O PHE M 343 7522 11482 9193 1022 -193 -1673 O
-ATOM 5404 CB PHE M 343 -19.352 -45.284-135.211 1.00 49.70 C
-ANISOU 5404 CB PHE M 343 4478 8239 6166 1022 -482 -1661 C
-ATOM 5405 CG PHE M 343 -19.713 -46.735-135.338 1.00 59.06 C
-ANISOU 5405 CG PHE M 343 5754 9306 7381 1038 -629 -1682 C
-ATOM 5406 CD1 PHE M 343 -20.568 -47.332-134.426 1.00 55.45 C
-ANISOU 5406 CD1 PHE M 343 5297 8705 7068 1005 -631 -1562 C
-ATOM 5407 CD2 PHE M 343 -19.203 -47.501-136.375 1.00 70.35 C
-ANISOU 5407 CD2 PHE M 343 7297 10760 8673 1068 -758 -1826 C
-ATOM 5408 CE1 PHE M 343 -20.904 -48.667-134.542 1.00 63.76 C
-ANISOU 5408 CE1 PHE M 343 6482 9608 8136 970 -792 -1564 C
-ATOM 5409 CE2 PHE M 343 -19.537 -48.837-136.502 1.00 70.12 C
-ANISOU 5409 CE2 PHE M 343 7413 10568 8661 1083 -931 -1856 C
-ATOM 5410 CZ PHE M 343 -20.390 -49.421-135.583 1.00 74.29 C
-ANISOU 5410 CZ PHE M 343 7961 10921 9343 1017 -965 -1713 C
-ATOM 5411 N GLY M 344 -16.711 -43.151-135.549 1.00 67.73 N
-ANISOU 5411 N GLY M 344 6705 10917 8113 948 -240 -1880 N
-ATOM 5412 CA GLY M 344 -16.248 -41.773-135.584 1.00 72.91 C
-ANISOU 5412 CA GLY M 344 7361 11643 8699 814 -150 -1848 C
-ATOM 5413 C GLY M 344 -16.311 -41.183-136.974 1.00 77.93 C
-ANISOU 5413 C GLY M 344 8081 12327 9201 641 -176 -1798 C
-ATOM 5414 O GLY M 344 -16.009 -41.853-137.962 1.00 92.64 O
-ANISOU 5414 O GLY M 344 9966 14302 10932 619 -200 -1890 O
-ATOM 5415 N VAL M 345 -16.706 -39.914-137.039 1.00 77.38 N
-ANISOU 5415 N VAL M 345 8108 12150 9144 526 -183 -1657 N
-ATOM 5416 CA VAL M 345 -16.761 -39.160-138.286 1.00 69.10 C
-ANISOU 5416 CA VAL M 345 7219 11099 7935 329 -236 -1571 C
-ATOM 5417 C VAL M 345 -15.675 -38.094-138.241 1.00 76.63 C
-ANISOU 5417 C VAL M 345 8224 12165 8728 115 -117 -1595 C
-ATOM 5418 O VAL M 345 -15.705 -37.202-137.384 1.00 83.13 O
-ANISOU 5418 O VAL M 345 9090 12863 9633 107 -107 -1538 O
-ATOM 5419 CB VAL M 345 -18.142 -38.530-138.505 1.00 68.53 C
-ANISOU 5419 CB VAL M 345 7261 10769 8008 367 -407 -1375 C
-ATOM 5420 CG1 VAL M 345 -18.037 -37.392-139.491 1.00 86.03 C
-ANISOU 5420 CG1 VAL M 345 9724 12924 10041 152 -484 -1262 C
-ATOM 5421 CG2 VAL M 345 -19.118 -39.579-139.007 1.00 64.75 C
-ANISOU 5421 CG2 VAL M 345 6732 10233 7636 468 -558 -1347 C
-ATOM 5422 N PHE M 346 -14.724 -38.179-139.165 1.00 74.76 N
-ANISOU 5422 N PHE M 346 7991 12166 8250 -76 -20 -1685 N
-ATOM 5423 CA PHE M 346 -13.563 -37.304-139.183 1.00 70.27 C
-ANISOU 5423 CA PHE M 346 7413 11771 7517 -345 122 -1722 C
-ATOM 5424 C PHE M 346 -13.593 -36.382-140.395 1.00 69.36 C
-ANISOU 5424 C PHE M 346 7579 11621 7154 -665 107 -1578 C
-ATOM 5425 O PHE M 346 -14.334 -36.600-141.357 1.00 64.65 O
-ANISOU 5425 O PHE M 346 7165 10925 6472 -658 -7 -1491 O
-ATOM 5426 CB PHE M 346 -12.268 -38.120-139.183 1.00 63.48 C
-ANISOU 5426 CB PHE M 346 6266 11284 6571 -336 296 -1969 C
-ATOM 5427 CG PHE M 346 -12.067 -38.941-137.944 1.00 63.42 C
-ANISOU 5427 CG PHE M 346 6035 11290 6772 -43 269 -2104 C
-ATOM 5428 CD1 PHE M 346 -11.362 -38.430-136.868 1.00 69.99 C
-ANISOU 5428 CD1 PHE M 346 6748 12169 7678 -81 293 -2150 C
-ATOM 5429 CD2 PHE M 346 -12.602 -40.214-137.845 1.00 69.95 C
-ANISOU 5429 CD2 PHE M 346 6823 12051 7703 246 187 -2172 C
-ATOM 5430 CE1 PHE M 346 -11.175 -39.182-135.725 1.00 71.80 C
-ANISOU 5430 CE1 PHE M 346 6831 12388 8061 182 233 -2261 C
-ATOM 5431 CE2 PHE M 346 -12.421 -40.970-136.703 1.00 68.42 C
-ANISOU 5431 CE2 PHE M 346 6497 11832 7666 491 139 -2271 C
-ATOM 5432 CZ PHE M 346 -11.704 -40.455-135.644 1.00 68.90 C
-ANISOU 5432 CZ PHE M 346 6451 11947 7779 468 160 -2314 C
-ATOM 5433 N ALA M 347 -12.766 -35.340-140.331 1.00 67.79 N
-ANISOU 5433 N ALA M 347 7443 11489 6824 -974 200 -1544 N
-ATOM 5434 CA ALA M 347 -12.646 -34.366-141.405 1.00 74.06 C
-ANISOU 5434 CA ALA M 347 8561 12239 7339 -1352 197 -1386 C
-ATOM 5435 C ALA M 347 -11.193 -33.929-141.521 1.00 78.61 C
-ANISOU 5435 C ALA M 347 9006 13148 7713 -1737 438 -1476 C
-ATOM 5436 O ALA M 347 -10.396 -34.098-140.595 1.00 87.87 O
-ANISOU 5436 O ALA M 347 9862 14507 9020 -1696 536 -1629 O
-ATOM 5437 CB ALA M 347 -13.549 -33.148-141.171 1.00 61.96 C
-ANISOU 5437 CB ALA M 347 7389 10266 5887 -1378 -40 -1153 C
-ATOM 5438 N GLN M 348 -10.853 -33.360-142.675 1.00 78.30 N
-ANISOU 5438 N GLN M 348 9217 13194 7342 -2135 524 -1374 N
-ATOM 5439 CA GLN M 348 -9.491 -32.921-142.938 1.00 86.92 C
-ANISOU 5439 CA GLN M 348 10167 14648 8211 -2581 794 -1444 C
-ATOM 5440 C GLN M 348 -9.325 -31.453-142.565 1.00 86.59 C
-ANISOU 5440 C GLN M 348 10415 14354 8133 -2957 692 -1245 C
-ATOM 5441 O GLN M 348 -10.192 -30.624-142.850 1.00 87.28 O
-ANISOU 5441 O GLN M 348 10985 14012 8165 -3017 455 -1007 O
-ATOM 5442 CB GLN M 348 -9.128 -33.134-144.407 1.00 98.16 C
-ANISOU 5442 CB GLN M 348 11719 16342 9236 -2866 1001 -1451 C
-ATOM 5443 CG GLN M 348 -7.668 -32.862-144.710 1.00106.41 C
-ANISOU 5443 CG GLN M 348 12503 17873 10056 -3323 1360 -1567 C
-ATOM 5444 CD GLN M 348 -7.363 -32.914-146.187 1.00103.87 C
-ANISOU 5444 CD GLN M 348 12388 17803 9273 -3662 1603 -1548 C
-ATOM 5445 OE1 GLN M 348 -8.207 -33.302-146.995 1.00107.16 O
-ANISOU 5445 OE1 GLN M 348 13138 18041 9536 -3509 1481 -1479 O
-ATOM 5446 NE2 GLN M 348 -6.149 -32.521-146.553 1.00109.48 N
-ANISOU 5446 NE2 GLN M 348 12906 18946 9748 -4149 1950 -1613 N
-ATOM 5447 N SER M 349 -8.199 -31.140-141.931 1.00 85.55 N
-ANISOU 5447 N SER M 349 9993 14473 8038 -3202 840 -1353 N
-ATOM 5448 CA SER M 349 -7.966 -29.803-141.407 1.00 94.60 C
-ANISOU 5448 CA SER M 349 11405 15361 9177 -3558 717 -1195 C
-ATOM 5449 C SER M 349 -7.438 -28.869-142.486 1.00103.52 C
-ANISOU 5449 C SER M 349 12867 16545 9921 -4210 832 -1013 C
-ATOM 5450 O SER M 349 -6.617 -29.260-143.321 1.00100.70 O
-ANISOU 5450 O SER M 349 12283 16655 9322 -4496 1144 -1105 O
-ATOM 5451 CB SER M 349 -6.964 -29.852-140.254 1.00 99.47 C
-ANISOU 5451 CB SER M 349 11583 16219 9993 -3590 781 -1384 C
-ATOM 5452 OG SER M 349 -5.699 -30.297-140.708 1.00115.32 O
-ANISOU 5452 OG SER M 349 13128 18813 11876 -3869 1093 -1562 O
-ATOM 5453 N LYS M 350 -7.912 -27.628-142.462 1.00109.11 N
-ANISOU 5453 N LYS M 350 14137 16765 10554 -4444 585 -759 N
-ATOM 5454 CA LYS M 350 -7.230 -26.580-143.201 1.00114.92 C
-ANISOU 5454 CA LYS M 350 15216 17512 10936 -5160 669 -571 C
-ATOM 5455 C LYS M 350 -5.809 -26.449-142.660 1.00124.24 C
-ANISOU 5455 C LYS M 350 15926 19133 12146 -5566 909 -725 C
-ATOM 5456 O LYS M 350 -5.605 -26.507-141.441 1.00136.69 O
-ANISOU 5456 O LYS M 350 17222 20683 14032 -5343 804 -864 O
-ATOM 5457 CB LYS M 350 -7.975 -25.249-143.079 1.00112.53 C
-ANISOU 5457 CB LYS M 350 15631 16531 10593 -5288 293 -288 C
-ATOM 5458 CG LYS M 350 -9.269 -25.182-143.874 1.00 88.59 C
-ANISOU 5458 CG LYS M 350 13106 13085 7469 -5015 33 -97 C
-ATOM 5459 N PRO M 351 -4.811 -26.285-143.527 1.00119.58 N
-ANISOU 5459 N PRO M 351 15226 18973 11237 -6168 1231 -710 N
-ATOM 5460 CA PRO M 351 -3.414 -26.432-143.097 1.00123.99 C
-ANISOU 5460 CA PRO M 351 15145 20098 11868 -6493 1507 -918 C
-ATOM 5461 C PRO M 351 -3.058 -25.544-141.910 1.00135.03 C
-ANISOU 5461 C PRO M 351 16581 21245 13479 -6692 1263 -885 C
-ATOM 5462 O PRO M 351 -3.429 -24.370-141.850 1.00142.31 O
-ANISOU 5462 O PRO M 351 18135 21641 14293 -7004 1006 -630 O
-ATOM 5463 CB PRO M 351 -2.623 -26.043-144.349 1.00115.85 C
-ANISOU 5463 CB PRO M 351 14189 19441 10388 -7227 1866 -813 C
-ATOM 5464 CG PRO M 351 -3.542 -26.376-145.475 1.00115.18 C
-ANISOU 5464 CG PRO M 351 14559 19180 10024 -7040 1868 -687 C
-ATOM 5465 CD PRO M 351 -4.923 -26.055-144.977 1.00112.78 C
-ANISOU 5465 CD PRO M 351 14784 18145 9921 -6560 1378 -520 C
-ATOM 5466 N ASP M 352 -2.336 -26.137-140.955 1.00134.61 N
-ANISOU 5466 N ASP M 352 15873 21547 13724 -6486 1312 -1157 N
-ATOM 5467 CA ASP M 352 -1.887 -25.462-139.736 1.00140.70 C
-ANISOU 5467 CA ASP M 352 16601 22150 14709 -6639 1072 -1183 C
-ATOM 5468 C ASP M 352 -3.051 -24.850-138.963 1.00134.42 C
-ANISOU 5468 C ASP M 352 16433 20601 14039 -6286 659 -1038 C
-ATOM 5469 O ASP M 352 -2.907 -23.804-138.326 1.00143.06 O
-ANISOU 5469 O ASP M 352 17869 21339 15147 -6591 420 -938 O
-ATOM 5470 CB ASP M 352 -0.826 -24.401-140.045 1.00160.17 C
-ANISOU 5470 CB ASP M 352 19111 24783 16965 -7544 1175 -1058 C
-ATOM 5471 CG ASP M 352 0.487 -25.007-140.509 1.00175.49 C
-ANISOU 5471 CG ASP M 352 20251 27560 18865 -7871 1599 -1272 C
-ATOM 5472 OD1 ASP M 352 0.689 -26.223-140.301 1.00174.49 O
-ANISOU 5472 OD1 ASP M 352 19504 27848 18945 -7333 1736 -1560 O
-ATOM 5473 OD2 ASP M 352 1.319 -24.269-141.078 1.00185.79 O1-
-ANISOU 5473 OD2 ASP M 352 21548 29111 19934 -8668 1796 -1157 O1-
-ATOM 5474 N SER M 353 -4.210 -25.501-139.008 1.00119.47 N
-ANISOU 5474 N SER M 353 14685 18465 12242 -5640 574 -1043 N
-ATOM 5475 CA SER M 353 -5.381 -25.020-138.294 1.00118.25 C
-ANISOU 5475 CA SER M 353 15040 17659 12230 -5233 231 -941 C
-ATOM 5476 C SER M 353 -6.208 -26.212-137.841 1.00107.90 C
-ANISOU 5476 C SER M 353 13461 16369 11166 -4468 220 -1098 C
-ATOM 5477 O SER M 353 -5.983 -27.351-138.258 1.00101.39 O
-ANISOU 5477 O SER M 353 12182 15979 10363 -4268 438 -1246 O
-ATOM 5478 CB SER M 353 -6.221 -24.076-139.162 1.00122.57 C
-ANISOU 5478 CB SER M 353 16325 17702 12546 -5420 68 -645 C
-ATOM 5479 OG SER M 353 -7.434 -23.737-138.513 1.00123.29 O
-ANISOU 5479 OG SER M 353 16820 17209 12814 -4914 -242 -590 O
-ATOM 5480 N ALA M 354 -7.171 -25.933-136.965 1.00104.54 N
-ANISOU 5480 N ALA M 354 13339 15463 10919 -4050 -33 -1073 N
-ATOM 5481 CA ALA M 354 -8.133 -26.925-136.514 1.00 95.41 C
-ANISOU 5481 CA ALA M 354 12018 14250 9983 -3372 -58 -1174 C
-ATOM 5482 C ALA M 354 -9.497 -26.741-137.164 1.00 92.16 C
-ANISOU 5482 C ALA M 354 12016 13449 9553 -3106 -188 -998 C
-ATOM 5483 O ALA M 354 -10.469 -27.370-136.735 1.00 86.64 O
-ANISOU 5483 O ALA M 354 11241 12624 9054 -2574 -244 -1050 O
-ATOM 5484 CB ALA M 354 -8.264 -26.884-134.990 1.00 93.45 C
-ANISOU 5484 CB ALA M 354 11743 13812 9952 -3056 -202 -1302 C
-ATOM 5485 N GLU M 355 -9.592 -25.885-138.184 1.00 96.64 N
-ANISOU 5485 N GLU M 355 13017 13820 9882 -3484 -256 -784 N
-ATOM 5486 CA GLU M 355 -10.837 -25.713-138.924 1.00 91.65 C
-ANISOU 5486 CA GLU M 355 12767 12833 9221 -3244 -430 -612 C
-ATOM 5487 C GLU M 355 -10.924 -26.756-140.030 1.00 90.25 C
-ANISOU 5487 C GLU M 355 12352 13009 8930 -3200 -259 -626 C
-ATOM 5488 O GLU M 355 -10.000 -26.862-140.846 1.00 93.55 O
-ANISOU 5488 O GLU M 355 12675 13783 9088 -3645 -45 -622 O
-ATOM 5489 CB GLU M 355 -10.926 -24.316-139.526 1.00 98.50 C
-ANISOU 5489 CB GLU M 355 14298 13271 9858 -3653 -644 -363 C
-ATOM 5490 CG GLU M 355 -11.006 -23.196-138.502 1.00101.64 C
-ANISOU 5490 CG GLU M 355 15060 13204 10354 -3653 -875 -346 C
-ATOM 5491 N PRO M 356 -11.994 -27.542-140.087 1.00 86.33 N
-ANISOU 5491 N PRO M 356 11753 12440 8609 -2694 -336 -653 N
-ATOM 5492 CA PRO M 356 -12.097 -28.588-141.104 1.00 92.08 C
-ANISOU 5492 CA PRO M 356 12291 13472 9223 -2638 -207 -688 C
-ATOM 5493 C PRO M 356 -12.704 -28.088-142.405 1.00105.89 C
-ANISOU 5493 C PRO M 356 14527 14987 10719 -2814 -376 -458 C
-ATOM 5494 O PRO M 356 -13.575 -27.216-142.433 1.00106.76 O
-ANISOU 5494 O PRO M 356 15069 14622 10874 -2719 -681 -280 O
-ATOM 5495 CB PRO M 356 -13.019 -29.615-140.434 1.00 86.85 C
-ANISOU 5495 CB PRO M 356 11326 12787 8888 -2043 -261 -810 C
-ATOM 5496 CG PRO M 356 -13.938 -28.770-139.615 1.00 82.18 C
-ANISOU 5496 CG PRO M 356 10989 11725 8509 -1789 -503 -722 C
-ATOM 5497 CD PRO M 356 -13.120 -27.585-139.137 1.00 84.71 C
-ANISOU 5497 CD PRO M 356 11554 11909 8722 -2154 -518 -684 C
-ATOM 5498 N MET M 357 -12.219 -28.662-143.498 1.00113.44 N
-ANISOU 5498 N MET M 357 15427 16283 11390 -3056 -186 -477 N
-ATOM 5499 CA MET M 357 -12.804 -28.428-144.806 1.00113.21 C
-ANISOU 5499 CA MET M 357 15857 16080 11078 -3198 -345 -278 C
-ATOM 5500 C MET M 357 -13.857 -29.494-145.098 1.00105.90 C
-ANISOU 5500 C MET M 357 14787 15138 10313 -2718 -480 -337 C
-ATOM 5501 O MET M 357 -13.998 -30.482-144.375 1.00101.69 O
-ANISOU 5501 O MET M 357 13793 14778 10067 -2342 -392 -534 O
-ATOM 5502 CB MET M 357 -11.718 -28.411-145.883 1.00124.48 C
-ANISOU 5502 CB MET M 357 17370 17881 12044 -3764 -47 -264 C
-ATOM 5503 CG MET M 357 -10.707 -29.543-145.774 1.00130.13 C
-ANISOU 5503 CG MET M 357 17474 19207 12761 -3750 363 -560 C
-ATOM 5504 SD MET M 357 -9.365 -29.417-146.976 1.00133.03 S
-ANISOU 5504 SD MET M 357 17878 20079 12589 -4433 792 -576 S
-ATOM 5505 CE MET M 357 -8.652 -27.836-146.533 1.00135.43 C
-ANISOU 5505 CE MET M 357 18451 20201 12806 -5042 769 -375 C
-ATOM 5506 N ASP M 358 -14.611 -29.280-146.177 1.00109.58 N
-ANISOU 5506 N ASP M 358 15686 15372 10580 -2759 -730 -152 N
-ATOM 5507 CA ASP M 358 -15.696 -30.182-146.563 1.00103.48 C
-ANISOU 5507 CA ASP M 358 14832 14538 9948 -2360 -934 -176 C
-ATOM 5508 C ASP M 358 -15.141 -31.467-147.186 1.00 94.34 C
-ANISOU 5508 C ASP M 358 13408 13835 8601 -2395 -654 -374 C
-ATOM 5509 O ASP M 358 -15.352 -31.777-148.358 1.00104.19 O
-ANISOU 5509 O ASP M 358 14929 15115 9544 -2512 -724 -321 O
-ATOM 5510 CB ASP M 358 -16.655 -29.472-147.510 1.00115.00 C
-ANISOU 5510 CB ASP M 358 16862 15580 11252 -2396 -1356 86 C
-ATOM 5511 CG ASP M 358 -17.417 -28.345-146.835 1.00129.88 C
-ANISOU 5511 CG ASP M 358 18971 16971 13405 -2198 -1692 238 C
-ATOM 5512 OD1 ASP M 358 -16.931 -27.820-145.810 1.00137.46 O
-ANISOU 5512 OD1 ASP M 358 19808 17901 14521 -2218 -1555 179 O
-ATOM 5513 OD2 ASP M 358 -18.504 -27.981-147.333 1.00130.44 O1-
-ANISOU 5513 OD2 ASP M 358 19351 16679 13532 -2003 -2114 401 O1-
-ATOM 5514 N ARG M 359 -14.402 -32.215-146.368 1.00 81.30 N
-ANISOU 5514 N ARG M 359 11244 12523 7122 -2274 -351 -619 N
-ATOM 5515 CA ARG M 359 -13.858 -33.517-146.746 1.00 77.82 C
-ANISOU 5515 CA ARG M 359 10496 12495 6578 -2198 -94 -862 C
-ATOM 5516 C ARG M 359 -13.960 -34.409-145.516 1.00 78.71 C
-ANISOU 5516 C ARG M 359 10112 12683 7111 -1775 -53 -1058 C
-ATOM 5517 O ARG M 359 -13.281 -34.159-144.517 1.00 89.06 O
-ANISOU 5517 O ARG M 359 11162 14098 8579 -1786 95 -1141 O
-ATOM 5518 CB ARG M 359 -12.406 -33.411-147.219 1.00 90.15 C
-ANISOU 5518 CB ARG M 359 11977 14491 7784 -2619 310 -976 C
-ATOM 5519 CG ARG M 359 -12.114 -32.286-148.208 1.00107.30 C
-ANISOU 5519 CG ARG M 359 14663 16589 9516 -3159 325 -747 C
-ATOM 5520 CD ARG M 359 -11.713 -32.834-149.564 1.00119.38 C
-ANISOU 5520 CD ARG M 359 16365 18421 10572 -3383 540 -819 C
-ATOM 5521 NE ARG M 359 -10.708 -33.884-149.450 1.00122.10 N
-ANISOU 5521 NE ARG M 359 16184 19299 10910 -3286 947 -1162 N
-ATOM 5522 CZ ARG M 359 -10.268 -34.610-150.472 1.00132.08 C
-ANISOU 5522 CZ ARG M 359 17477 20899 11807 -3364 1203 -1329 C
-ATOM 5523 NH1 ARG M 359 -10.744 -34.398-151.693 1.00138.69 N1+
-ANISOU 5523 NH1 ARG M 359 18879 21596 12222 -3581 1092 -1169 N1+
-ATOM 5524 NH2 ARG M 359 -9.353 -35.549-150.273 1.00131.55 N
-ANISOU 5524 NH2 ARG M 359 16899 21298 11785 -3201 1552 -1670 N
-ATOM 5525 N SER M 360 -14.798 -35.439-145.577 1.00 72.52 N
-ANISOU 5525 N SER M 360 9229 11833 6492 -1433 -204 -1122 N
-ATOM 5526 CA SER M 360 -15.110 -36.243-144.405 1.00 67.33 C
-ANISOU 5526 CA SER M 360 8194 11164 6225 -1053 -218 -1252 C
-ATOM 5527 C SER M 360 -14.695 -37.696-144.604 1.00 65.19 C
-ANISOU 5527 C SER M 360 7684 11166 5918 -881 -78 -1500 C
-ATOM 5528 O SER M 360 -14.273 -38.113-145.685 1.00 77.26 O
-ANISOU 5528 O SER M 360 9336 12888 7132 -1011 25 -1591 O
-ATOM 5529 CB SER M 360 -16.606 -36.170-144.067 1.00 79.34 C
-ANISOU 5529 CB SER M 360 9779 12317 8050 -787 -546 -1096 C
-ATOM 5530 OG SER M 360 -16.972 -34.877-143.614 1.00 88.61 O
-ANISOU 5530 OG SER M 360 11122 13220 9327 -835 -671 -919 O
-ATOM 5531 N ALA M 361 -14.831 -38.461-143.523 1.00 66.23 N
-ANISOU 5531 N ALA M 361 7514 11290 6361 -576 -81 -1615 N
-ATOM 5532 CA ALA M 361 -14.473 -39.872-143.485 1.00 69.03 C
-ANISOU 5532 CA ALA M 361 7663 11827 6738 -354 -2 -1854 C
-ATOM 5533 C ALA M 361 -15.136 -40.497-142.264 1.00 79.42 C
-ANISOU 5533 C ALA M 361 8792 12965 8420 -51 -125 -1856 C
-ATOM 5534 O ALA M 361 -15.657 -39.799-141.389 1.00 92.34 O
-ANISOU 5534 O ALA M 361 10402 14414 10267 -19 -193 -1714 O
-ATOM 5535 CB ALA M 361 -12.955 -40.070-143.443 1.00 71.48 C
-ANISOU 5535 CB ALA M 361 7737 12530 6893 -423 303 -2091 C
-ATOM 5536 N MET M 362 -15.087 -41.826-142.206 1.00 71.29 N
-ANISOU 5536 N MET M 362 7662 11985 7439 167 -145 -2027 N
-ATOM 5537 CA MET M 362 -15.813 -42.586-141.191 1.00 71.12 C
-ANISOU 5537 CA MET M 362 7533 11773 7715 406 -276 -2008 C
-ATOM 5538 C MET M 362 -15.000 -43.808-140.801 1.00 76.81 C
-ANISOU 5538 C MET M 362 8112 12632 8441 619 -209 -2257 C
-ATOM 5539 O MET M 362 -14.673 -44.633-141.660 1.00 93.17 O
-ANISOU 5539 O MET M 362 10258 14800 10343 677 -209 -2425 O
-ATOM 5540 CB MET M 362 -17.184 -42.992-141.724 1.00 90.19 C
-ANISOU 5540 CB MET M 362 10101 13948 10221 425 -527 -1870 C
-ATOM 5541 CG MET M 362 -17.756 -44.261-141.137 1.00 94.97 C
-ANISOU 5541 CG MET M 362 10640 14419 11026 614 -649 -1915 C
-ATOM 5542 SD MET M 362 -18.311 -44.069-139.452 1.00 84.33 S
-ANISOU 5542 SD MET M 362 9104 12933 10006 724 -617 -1795 S
-ATOM 5543 CE MET M 362 -19.314 -45.543-139.294 1.00 85.63 C
-ANISOU 5543 CE MET M 362 9293 12903 10338 806 -815 -1776 C
-ATOM 5544 N CYS M 363 -14.683 -43.931-139.514 1.00 74.97 N
-ANISOU 5544 N CYS M 363 7713 12387 8386 756 -174 -2290 N
-ATOM 5545 CA CYS M 363 -13.804 -44.985-139.030 1.00 78.63 C
-ANISOU 5545 CA CYS M 363 8050 12962 8863 986 -153 -2524 C
-ATOM 5546 C CYS M 363 -14.417 -45.679-137.822 1.00 78.72 C
-ANISOU 5546 C CYS M 363 8081 12733 9097 1158 -290 -2456 C
-ATOM 5547 O CYS M 363 -15.095 -45.056-137.001 1.00 76.38 O
-ANISOU 5547 O CYS M 363 7786 12292 8942 1096 -296 -2271 O
-ATOM 5548 CB CYS M 363 -12.421 -44.431-138.667 1.00 83.47 C
-ANISOU 5548 CB CYS M 363 8431 13871 9413 958 26 -2671 C
-ATOM 5549 SG CYS M 363 -11.260 -44.341-140.051 1.00105.17 S
-ANISOU 5549 SG CYS M 363 11078 17018 11864 841 246 -2894 S
-ATOM 5550 N ALA M 364 -14.165 -46.981-137.720 1.00 75.13 N
-ANISOU 5550 N ALA M 364 7671 12227 8650 1376 -395 -2616 N
-ATOM 5551 CA ALA M 364 -14.669 -47.803-136.629 1.00 65.80 C
-ANISOU 5551 CA ALA M 364 6575 10799 7627 1511 -538 -2553 C
-ATOM 5552 C ALA M 364 -13.505 -48.277-135.770 1.00 67.15 C
-ANISOU 5552 C ALA M 364 6653 11060 7801 1741 -555 -2742 C
-ATOM 5553 O ALA M 364 -12.515 -48.799-136.290 1.00 74.89 O
-ANISOU 5553 O ALA M 364 7554 12214 8686 1914 -553 -2995 O
-ATOM 5554 CB ALA M 364 -15.460 -49.000-137.162 1.00 60.51 C
-ANISOU 5554 CB ALA M 364 6120 9903 6968 1555 -728 -2550 C
-ATOM 5555 N PHE M 365 -13.631 -48.094-134.459 1.00 74.82 N
-ANISOU 5555 N PHE M 365 7635 11919 8875 1758 -579 -2632 N
-ATOM 5556 CA PHE M 365 -12.598 -48.474-133.498 1.00 67.58 C
-ANISOU 5556 CA PHE M 365 6662 11049 7966 1969 -658 -2779 C
-ATOM 5557 C PHE M 365 -13.221 -49.381-132.446 1.00 68.08 C
-ANISOU 5557 C PHE M 365 6983 10792 8092 2057 -828 -2664 C
-ATOM 5558 O PHE M 365 -13.858 -48.886-131.499 1.00 73.99 O
-ANISOU 5558 O PHE M 365 7804 11423 8884 1931 -773 -2469 O
-ATOM 5559 CB PHE M 365 -11.975 -47.248-132.840 1.00 60.17 C
-ANISOU 5559 CB PHE M 365 5541 10292 7030 1864 -539 -2758 C
-ATOM 5560 CG PHE M 365 -11.308 -46.308-133.803 1.00 68.76 C
-ANISOU 5560 CG PHE M 365 6400 11689 8036 1707 -365 -2845 C
-ATOM 5561 CD1 PHE M 365 -12.028 -45.300-134.419 1.00 73.03 C
-ANISOU 5561 CD1 PHE M 365 6982 12219 8548 1444 -236 -2672 C
-ATOM 5562 CD2 PHE M 365 -9.954 -46.418-134.074 1.00 76.53 C
-ANISOU 5562 CD2 PHE M 365 7126 12979 8973 1815 -336 -3098 C
-ATOM 5563 CE1 PHE M 365 -11.413 -44.427-135.299 1.00 75.96 C
-ANISOU 5563 CE1 PHE M 365 7212 12844 8803 1252 -84 -2723 C
-ATOM 5564 CE2 PHE M 365 -9.334 -45.548-134.952 1.00 81.08 C
-ANISOU 5564 CE2 PHE M 365 7494 13865 9449 1606 -138 -3163 C
-ATOM 5565 CZ PHE M 365 -10.066 -44.553-135.565 1.00 79.85 C
-ANISOU 5565 CZ PHE M 365 7453 13661 9225 1304 -13 -2962 C
-ATOM 5566 N PRO M 366 -13.078 -50.698-132.574 1.00 62.26 N
-ANISOU 5566 N PRO M 366 6421 9894 7340 2262 -1029 -2780 N
-ATOM 5567 CA PRO M 366 -13.571 -51.595-131.522 1.00 69.35 C
-ANISOU 5567 CA PRO M 366 7624 10465 8263 2311 -1210 -2658 C
-ATOM 5568 C PRO M 366 -12.868 -51.310-130.202 1.00 73.70 C
-ANISOU 5568 C PRO M 366 8176 11031 8795 2411 -1260 -2663 C
-ATOM 5569 O PRO M 366 -11.640 -51.216-130.138 1.00 72.77 O
-ANISOU 5569 O PRO M 366 7878 11108 8663 2621 -1328 -2878 O
-ATOM 5570 CB PRO M 366 -13.234 -52.992-132.059 1.00 72.28 C
-ANISOU 5570 CB PRO M 366 8193 10671 8599 2558 -1454 -2845 C
-ATOM 5571 CG PRO M 366 -13.108 -52.811-133.527 1.00 71.74 C
-ANISOU 5571 CG PRO M 366 7964 10804 8489 2549 -1349 -2995 C
-ATOM 5572 CD PRO M 366 -12.529 -51.440-133.718 1.00 66.19 C
-ANISOU 5572 CD PRO M 366 6903 10473 7772 2445 -1098 -3025 C
-ATOM 5573 N ILE M 367 -13.664 -51.170-129.140 1.00 74.06 N
-ANISOU 5573 N ILE M 367 8418 10888 8834 2252 -1224 -2430 N
-ATOM 5574 CA ILE M 367 -13.120 -50.705-127.868 1.00 69.12 C
-ANISOU 5574 CA ILE M 367 7836 10276 8149 2296 -1249 -2411 C
-ATOM 5575 C ILE M 367 -12.145 -51.725-127.293 1.00 69.34 C
-ANISOU 5575 C ILE M 367 8043 10179 8124 2598 -1575 -2563 C
-ATOM 5576 O ILE M 367 -11.125 -51.358-126.693 1.00 79.22 O
-ANISOU 5576 O ILE M 367 9186 11562 9350 2742 -1678 -2685 O
-ATOM 5577 CB ILE M 367 -14.266 -50.372-126.893 1.00 62.51 C
-ANISOU 5577 CB ILE M 367 7203 9270 7276 2060 -1095 -2142 C
-ATOM 5578 CG1 ILE M 367 -14.798 -48.968-127.181 1.00 51.27 C
-ANISOU 5578 CG1 ILE M 367 5535 8032 5912 1864 -804 -2061 C
-ATOM 5579 CG2 ILE M 367 -13.815 -50.484-125.444 1.00 71.66 C
-ANISOU 5579 CG2 ILE M 367 8621 10306 8302 2133 -1218 -2110 C
-ATOM 5580 N LYS M 368 -12.418 -53.018-127.490 1.00 71.14 N
-ANISOU 5580 N LYS M 368 8555 10136 8340 2708 -1783 -2567 N
-ATOM 5581 CA LYS M 368 -11.489 -54.034-127.005 1.00 78.54 C
-ANISOU 5581 CA LYS M 368 9701 10907 9234 3051 -2148 -2725 C
-ATOM 5582 C LYS M 368 -10.136 -53.914-127.697 1.00 82.53 C
-ANISOU 5582 C LYS M 368 9817 11727 9813 3372 -2223 -3066 C
-ATOM 5583 O LYS M 368 -9.086 -54.120-127.072 1.00 87.45 O
-ANISOU 5583 O LYS M 368 10405 12383 10439 3654 -2471 -3223 O
-ATOM 5584 CB LYS M 368 -12.079 -55.432-127.195 1.00 75.24 C
-ANISOU 5584 CB LYS M 368 9708 10095 8786 3094 -2372 -2669 C
-ATOM 5585 CG LYS M 368 -12.557 -55.746-128.598 1.00 81.28 C
-ANISOU 5585 CG LYS M 368 10377 10887 9618 3045 -2288 -2744 C
-ATOM 5586 CD LYS M 368 -12.518 -57.248-128.855 1.00 95.18 C
-ANISOU 5586 CD LYS M 368 12546 12272 11346 3260 -2637 -2838 C
-ATOM 5587 CE LYS M 368 -13.209 -57.608-130.161 1.00102.02 C
-ANISOU 5587 CE LYS M 368 13422 13098 12245 3140 -2577 -2872 C
-ATOM 5588 NZ LYS M 368 -12.868 -58.983-130.621 1.00105.33 N1+
-ANISOU 5588 NZ LYS M 368 14197 13196 12627 3446 -2930 -3073 N1+
-ATOM 5589 N TYR M 369 -10.139 -53.557-128.985 1.00 83.70 N
-ANISOU 5589 N TYR M 369 9659 12128 10016 3323 -2008 -3185 N
-ATOM 5590 CA TYR M 369 -8.884 -53.325-129.690 1.00 84.92 C
-ANISOU 5590 CA TYR M 369 9389 12656 10220 3564 -1984 -3507 C
-ATOM 5591 C TYR M 369 -8.188 -52.067-129.186 1.00 77.01 C
-ANISOU 5591 C TYR M 369 8034 11981 9244 3444 -1852 -3517 C
-ATOM 5592 O TYR M 369 -6.954 -51.993-129.204 1.00 87.87 O
-ANISOU 5592 O TYR M 369 9078 13632 10676 3672 -1940 -3770 O
-ATOM 5593 CB TYR M 369 -9.132 -53.233-131.198 1.00 91.63 C
-ANISOU 5593 CB TYR M 369 10070 13686 11058 3484 -1757 -3607 C
-ATOM 5594 CG TYR M 369 -9.348 -54.569-131.881 1.00110.97 C
-ANISOU 5594 CG TYR M 369 12802 15882 13480 3716 -1945 -3739 C
-ATOM 5595 CD1 TYR M 369 -8.745 -54.853-133.099 1.00121.33 C
-ANISOU 5595 CD1 TYR M 369 13922 17419 14760 3921 -1870 -4040 C
-ATOM 5596 CD2 TYR M 369 -10.154 -55.547-131.310 1.00124.69 C
-ANISOU 5596 CD2 TYR M 369 15031 17147 15198 3708 -2193 -3567 C
-ATOM 5597 CE1 TYR M 369 -8.940 -56.072-133.727 1.00131.52 C
-ANISOU 5597 CE1 TYR M 369 15524 18444 16004 4151 -2060 -4187 C
-ATOM 5598 CE2 TYR M 369 -10.353 -56.767-131.930 1.00131.30 C
-ANISOU 5598 CE2 TYR M 369 16183 17704 16002 3896 -2403 -3688 C
-ATOM 5599 CZ TYR M 369 -9.745 -57.025-133.138 1.00133.18 C
-ANISOU 5599 CZ TYR M 369 16244 18146 16212 4137 -2348 -4008 C
-ATOM 5600 OH TYR M 369 -9.943 -58.239-133.756 1.00138.64 O
-ANISOU 5600 OH TYR M 369 17300 18526 16851 4342 -2574 -4153 O
-ATOM 5601 N VAL M 370 -8.956 -51.074-128.730 1.00 66.40 N
-ANISOU 5601 N VAL M 370 6748 10613 7868 3093 -1654 -3259 N
-ATOM 5602 CA VAL M 370 -8.357 -49.879-128.143 1.00 65.21 C
-ANISOU 5602 CA VAL M 370 6360 10696 7722 2956 -1571 -3255 C
-ATOM 5603 C VAL M 370 -7.642 -50.229-126.845 1.00 69.57 C
-ANISOU 5603 C VAL M 370 7042 11137 8255 3164 -1893 -3302 C
-ATOM 5604 O VAL M 370 -6.482 -49.855-126.633 1.00 70.03 O
-ANISOU 5604 O VAL M 370 6786 11456 8366 3273 -2003 -3487 O
-ATOM 5605 CB VAL M 370 -9.429 -48.797-127.917 1.00 65.67 C
-ANISOU 5605 CB VAL M 370 6525 10687 7740 2586 -1312 -2984 C
-ATOM 5606 CG1 VAL M 370 -8.801 -47.538-127.341 1.00 56.13 C
-ANISOU 5606 CG1 VAL M 370 5132 9675 6520 2436 -1251 -2993 C
-ATOM 5607 CG2 VAL M 370 -10.164 -48.494-129.214 1.00 63.20 C
-ANISOU 5607 CG2 VAL M 370 6114 10451 7448 2405 -1067 -2928 C
-ATOM 5608 N ASN M 371 -8.330 -50.954-125.958 1.00 69.35 N
-ANISOU 5608 N ASN M 371 7485 10722 8142 3196 -2060 -3126 N
-ATOM 5609 CA ASN M 371 -7.729 -51.359-124.692 1.00 71.05 C
-ANISOU 5609 CA ASN M 371 7934 10772 8290 3387 -2409 -3141 C
-ATOM 5610 C ASN M 371 -6.487 -52.211-124.923 1.00 81.52 C
-ANISOU 5610 C ASN M 371 9071 12188 9715 3825 -2753 -3445 C
-ATOM 5611 O ASN M 371 -5.437 -51.979-124.311 1.00 91.79 O
-ANISOU 5611 O ASN M 371 10187 13636 11051 3988 -2990 -3588 O
-ATOM 5612 CB ASN M 371 -8.754 -52.118-123.848 1.00 80.15 C
-ANISOU 5612 CB ASN M 371 9681 11478 9295 3310 -2502 -2885 C
-ATOM 5613 CG ASN M 371 -9.976 -51.278-123.515 1.00 80.09 C
-ANISOU 5613 CG ASN M 371 9809 11418 9203 2917 -2145 -2613 C
-ATOM 5614 OD1 ASN M 371 -9.865 -50.089-123.214 1.00 73.20 O
-ANISOU 5614 OD1 ASN M 371 8767 10731 8314 2755 -1972 -2594 O
-ATOM 5615 ND2 ASN M 371 -11.151 -51.900-123.558 1.00 74.57 N
-ANISOU 5615 ND2 ASN M 371 9413 10461 8459 2764 -2045 -2413 N
-ATOM 5616 N ASP M 372 -6.589 -53.206-125.811 1.00 92.79 N
-ANISOU 5616 N ASP M 372 10535 13527 11194 4039 -2802 -3565 N
-ATOM 5617 CA ASP M 372 -5.426 -54.029-126.130 1.00111.98 C
-ANISOU 5617 CA ASP M 372 12760 16055 13733 4520 -3105 -3900 C
-ATOM 5618 C ASP M 372 -4.290 -53.201-126.718 1.00107.18 C
-ANISOU 5618 C ASP M 372 11490 15985 13246 4532 -2934 -4155 C
-ATOM 5619 O ASP M 372 -3.115 -53.498-126.473 1.00121.63 O
-ANISOU 5619 O ASP M 372 13175 17908 15131 4718 -3125 -4346 O
-ATOM 5620 CB ASP M 372 -5.823 -55.154-127.087 1.00132.50 C
-ANISOU 5620 CB ASP M 372 15552 18453 16340 4717 -3136 -3998 C
-ATOM 5621 CG ASP M 372 -6.510 -56.307-126.376 1.00153.74 C
-ANISOU 5621 CG ASP M 372 18926 20566 18923 4794 -3462 -3815 C
-ATOM 5622 OD1 ASP M 372 -5.853 -57.348-126.159 1.00165.37 O
-ANISOU 5622 OD1 ASP M 372 20584 21826 20422 5237 -3878 -3999 O
-ATOM 5623 OD2 ASP M 372 -7.700 -56.165-126.022 1.00155.12 O1-
-ANISOU 5623 OD2 ASP M 372 19451 20501 18987 4408 -3307 -3488 O1-
-ATOM 5624 N PHE M 373 -4.614 -52.160-127.488 1.00 96.46 N
-ANISOU 5624 N PHE M 373 9833 14928 11891 4190 -2519 -4101 N
-ATOM 5625 CA PHE M 373 -3.570 -51.278-127.998 1.00 93.25 C
-ANISOU 5625 CA PHE M 373 8946 14958 11527 3988 -2290 -4237 C
-ATOM 5626 C PHE M 373 -2.912 -50.489-126.875 1.00 91.11 C
-ANISOU 5626 C PHE M 373 8539 14789 11291 3902 -2446 -4211 C
-ATOM 5627 O PHE M 373 -1.708 -50.215-126.935 1.00 99.67 O
-ANISOU 5627 O PHE M 373 9279 16142 12449 3893 -2451 -4379 O
-ATOM 5628 CB PHE M 373 -4.144 -50.329-129.052 1.00 97.18 C
-ANISOU 5628 CB PHE M 373 9260 15682 11980 3613 -1853 -4144 C
-ATOM 5629 CG PHE M 373 -3.105 -49.722-129.955 1.00 98.98 C
-ANISOU 5629 CG PHE M 373 9062 16330 12215 3427 -1605 -4295 C
-ATOM 5630 CD1 PHE M 373 -2.830 -50.283-131.193 1.00117.09 C
-ANISOU 5630 CD1 PHE M 373 11265 18755 14467 3498 -1458 -4444 C
-ATOM 5631 CD2 PHE M 373 -2.407 -48.589-129.569 1.00 89.95 C
-ANISOU 5631 CD2 PHE M 373 7620 15450 11108 3175 -1529 -4287 C
-ATOM 5632 CE1 PHE M 373 -1.876 -49.727-132.028 1.00128.46 C
-ANISOU 5632 CE1 PHE M 373 12314 20601 15894 3321 -1214 -4576 C
-ATOM 5633 CE2 PHE M 373 -1.454 -48.027-130.397 1.00105.56 C
-ANISOU 5633 CE2 PHE M 373 9205 17816 13088 2977 -1295 -4413 C
-ATOM 5634 CZ PHE M 373 -1.188 -48.596-131.629 1.00126.37 C
-ANISOU 5634 CZ PHE M 373 11744 20598 15672 3051 -1124 -4555 C
-ATOM 5635 N PHE M 374 -3.680 -50.115-125.849 1.00 94.93 N
-ANISOU 5635 N PHE M 374 9306 15058 11706 3816 -2577 -3997 N
-ATOM 5636 CA PHE M 374 -3.087 -49.468-124.682 1.00 93.42 C
-ANISOU 5636 CA PHE M 374 9096 14900 11499 3742 -2802 -3971 C
-ATOM 5637 C PHE M 374 -2.166 -50.417-123.928 1.00101.02 C
-ANISOU 5637 C PHE M 374 10172 15706 12505 4112 -3242 -4110 C
-ATOM 5638 O PHE M 374 -1.092 -50.013-123.466 1.00104.64 O
-ANISOU 5638 O PHE M 374 10390 16329 13038 4093 -3374 -4216 O
-ATOM 5639 CB PHE M 374 -4.181 -48.953-123.749 1.00 87.90 C
-ANISOU 5639 CB PHE M 374 8927 13857 10613 3441 -2722 -3644 C
-ATOM 5640 CG PHE M 374 -4.718 -47.605-124.123 1.00 84.57 C
-ANISOU 5640 CG PHE M 374 8397 13579 10158 3008 -2323 -3505 C
-ATOM 5641 CD1 PHE M 374 -6.008 -47.467-124.599 1.00 76.81 C
-ANISOU 5641 CD1 PHE M 374 7647 12426 9111 2809 -2005 -3299 C
-ATOM 5642 CD2 PHE M 374 -3.939 -46.470-123.980 1.00 87.50 C
-ANISOU 5642 CD2 PHE M 374 8446 14234 10567 2798 -2302 -3580 C
-ATOM 5643 CE1 PHE M 374 -6.508 -46.226-124.934 1.00 71.14 C
-ANISOU 5643 CE1 PHE M 374 6858 11801 8370 2461 -1689 -3178 C
-ATOM 5644 CE2 PHE M 374 -4.434 -45.227-124.315 1.00 84.01 C
-ANISOU 5644 CE2 PHE M 374 7978 13862 10082 2410 -1977 -3449 C
-ATOM 5645 CZ PHE M 374 -5.720 -45.106-124.794 1.00 76.40 C
-ANISOU 5645 CZ PHE M 374 7264 12708 9056 2267 -1677 -3251 C
-ATOM 5646 N ASN M 375 -2.565 -51.681-123.793 1.00107.04 N
-ANISOU 5646 N ASN M 375 11335 16112 13224 4426 -3481 -4096 N
-ATOM 5647 CA ASN M 375 -1.846 -52.612-122.933 1.00115.53 C
-ANISOU 5647 CA ASN M 375 12669 16923 14304 4761 -3938 -4177 C
-ATOM 5648 C ASN M 375 -0.672 -53.303-123.615 1.00122.66 C
-ANISOU 5648 C ASN M 375 13256 17985 15366 5031 -3977 -4484 C
-ATOM 5649 O ASN M 375 0.234 -53.772-122.916 1.00141.35 O
-ANISOU 5649 O ASN M 375 15662 20255 17790 5276 -4334 -4599 O
-ATOM 5650 CB ASN M 375 -2.812 -53.668-122.384 1.00123.31 C
-ANISOU 5650 CB ASN M 375 14328 17394 15131 4944 -4229 -3995 C
-ATOM 5651 CG ASN M 375 -3.805 -53.091-121.387 1.00131.86 C
-ANISOU 5651 CG ASN M 375 15880 18244 15978 4590 -4170 -3656 C
-ATOM 5652 OD1 ASN M 375 -3.475 -52.192-120.611 1.00132.72 O
-ANISOU 5652 OD1 ASN M 375 15933 18468 16025 4416 -4211 -3611 O
-ATOM 5653 ND2 ASN M 375 -5.030 -53.604-121.407 1.00133.98 N
-ANISOU 5653 ND2 ASN M 375 16642 18159 16103 4420 -4006 -3412 N
-ATOM 5654 N LYS M 376 -0.649 -53.376-124.944 1.00115.41 N
-ANISOU 5654 N LYS M 376 12042 17312 14497 4991 -3637 -4620 N
-ATOM 5655 CA LYS M 376 0.390 -54.123-125.650 1.00121.84 C
-ANISOU 5655 CA LYS M 376 12598 18286 15409 5264 -3677 -4918 C
-ATOM 5656 C LYS M 376 1.441 -53.250-126.317 1.00130.01 C
-ANISOU 5656 C LYS M 376 12984 19862 16552 5070 -3376 -5083 C
-ATOM 5657 O LYS M 376 2.631 -53.573-126.251 1.00137.79 O
-ANISOU 5657 O LYS M 376 13683 21014 17658 5291 -3534 -5310 O
-ATOM 5658 CB LYS M 376 -0.239 -55.044-126.703 1.00116.66 C
-ANISOU 5658 CB LYS M 376 12143 17492 14689 5402 -3573 -4974 C
-ATOM 5659 CG LYS M 376 -0.972 -56.235-126.110 1.00110.49 C
-ANISOU 5659 CG LYS M 376 12011 16145 13826 5680 -3962 -4877 C
-ATOM 5660 CD LYS M 376 -1.214 -57.325-127.139 1.00103.93 C
-ANISOU 5660 CD LYS M 376 11349 15179 12960 5895 -3965 -5015 C
-ATOM 5661 CE LYS M 376 -1.779 -58.573-126.476 1.00111.47 C
-ANISOU 5661 CE LYS M 376 12993 15526 13835 6170 -4421 -4928 C
-ATOM 5662 NZ LYS M 376 -1.919 -59.714-127.421 1.00115.66 N1+
-ANISOU 5662 NZ LYS M 376 13733 15884 14329 6406 -4497 -5082 N1+
-ATOM 5663 N ILE M 377 1.037 -52.152-126.962 1.00131.45 N
-ANISOU 5663 N ILE M 377 12638 20583 16724 4518 -1479 -4059 N
-ATOM 5664 CA ILE M 377 1.983 -51.326-127.706 1.00137.35 C
-ANISOU 5664 CA ILE M 377 12838 21868 17480 4309 -1305 -4198 C
-ATOM 5665 C ILE M 377 2.994 -50.649-126.783 1.00140.49 C
-ANISOU 5665 C ILE M 377 12871 22605 17904 4203 -1536 -4185 C
-ATOM 5666 O ILE M 377 4.105 -50.320-127.220 1.00139.29 O
-ANISOU 5666 O ILE M 377 12153 22962 17808 4170 -1478 -4323 O
-ATOM 5667 CB ILE M 377 1.196 -50.314-128.565 1.00127.13 C
-ANISOU 5667 CB ILE M 377 11671 20542 16091 3809 -998 -4124 C
-ATOM 5668 CG1 ILE M 377 0.631 -51.011-129.803 1.00118.65 C
-ANISOU 5668 CG1 ILE M 377 10749 19335 14998 3962 -756 -4228 C
-ATOM 5669 CG2 ILE M 377 2.054 -49.128-128.991 1.00133.14 C
-ANISOU 5669 CG2 ILE M 377 11953 21797 16836 3424 -868 -4158 C
-ATOM 5670 N VAL M 378 2.649 -50.478-125.504 1.00141.59 N
-ANISOU 5670 N VAL M 378 13309 22495 17995 4162 -1805 -4028 N
-ATOM 5671 CA VAL M 378 3.532 -49.819-124.546 1.00148.08 C
-ANISOU 5671 CA VAL M 378 13846 23596 18822 4052 -2076 -4023 C
-ATOM 5672 C VAL M 378 4.910 -50.470-124.555 1.00155.02 C
-ANISOU 5672 C VAL M 378 14176 24895 19828 4451 -2237 -4208 C
-ATOM 5673 O VAL M 378 5.044 -51.693-124.444 1.00152.22 O
-ANISOU 5673 O VAL M 378 13899 24411 19527 4976 -2361 -4269 O
-ATOM 5674 CB VAL M 378 2.896 -49.841-123.143 1.00141.34 C
-ANISOU 5674 CB VAL M 378 13470 22378 17854 4087 -2358 -3843 C
-ATOM 5675 CG1 VAL M 378 2.502 -51.257-122.745 1.00141.65 C
-ANISOU 5675 CG1 VAL M 378 13852 22068 17900 4583 -2491 -3783 C
-ATOM 5676 CG2 VAL M 378 3.851 -49.255-122.115 1.00143.65 C
-ANISOU 5676 CG2 VAL M 378 13491 22954 18137 4027 -2694 -3867 C
-ATOM 5677 N ASN M 379 5.943 -49.641-124.716 1.00160.41 N
-ANISOU 5677 N ASN M 379 14290 26088 20569 4196 -2241 -4296 N
-ATOM 5678 CA ASN M 379 7.330 -50.085-124.646 1.00163.24 C
-ANISOU 5678 CA ASN M 379 14166 26834 21022 4448 -2367 -4413 C
-ATOM 5679 C ASN M 379 8.216 -48.947-124.150 1.00167.76 C
-ANISOU 5679 C ASN M 379 14315 27796 21632 4035 -2528 -4402 C
-ATOM 5680 O ASN M 379 7.755 -48.082-123.398 1.00168.36 O
-ANISOU 5680 O ASN M 379 14537 27776 21656 3738 -2730 -4331 O
-ATOM 5681 CB ASN M 379 7.810 -50.598-126.008 1.00163.25 C
-ANISOU 5681 CB ASN M 379 13938 27042 21049 4555 -2008 -4527 C
-ATOM 5682 CG ASN M 379 7.818 -49.518-127.071 1.00160.69 C
-ANISOU 5682 CG ASN M 379 13319 27038 20698 4039 -1654 -4529 C
-ATOM 5683 OD1 ASN M 379 7.067 -48.550-126.991 1.00158.91 O
-ANISOU 5683 OD1 ASN M 379 13205 26735 20437 3641 -1621 -4452 O
-ATOM 5684 ND2 ASN M 379 8.676 -49.678-128.072 1.00165.25 N
-ANISOU 5684 ND2 ASN M 379 13529 27981 21276 4046 -1394 -4609 N
-ATOM 5685 N LYS M 380 9.486 -48.934-124.559 1.00163.58 N
-ANISOU 5685 N LYS M 380 13273 27694 21184 4002 -2455 -4471 N
-ATOM 5686 CA LYS M 380 10.446 -47.935-124.106 1.00160.07 C
-ANISOU 5686 CA LYS M 380 12395 27617 20806 3602 -2623 -4449 C
-ATOM 5687 C LYS M 380 10.710 -46.856-125.153 1.00162.67 C
-ANISOU 5687 C LYS M 380 12349 28295 21162 3025 -2293 -4426 C
-ATOM 5688 O LYS M 380 11.834 -46.352-125.254 1.00170.98 O
-ANISOU 5688 O LYS M 380 12900 29760 22305 2765 -2302 -4420 O
-ATOM 5689 CB LYS M 380 11.756 -48.609-123.699 1.00162.59 C
-ANISOU 5689 CB LYS M 380 12364 28198 21215 3940 -2816 -4512 C
-ATOM 5690 N ASN M 381 9.694 -46.487-125.935 1.00152.52 N
-ANISOU 5690 N ASN M 381 11299 26850 19800 2804 -2008 -4395 N
-ATOM 5691 CA ASN M 381 9.864 -45.453-126.949 1.00148.94 C
-ANISOU 5691 CA ASN M 381 10554 26692 19344 2234 -1691 -4340 C
-ATOM 5692 C ASN M 381 8.529 -44.829-127.338 1.00147.66 C
-ANISOU 5692 C ASN M 381 10782 26234 19087 1939 -1536 -4281 C
-ATOM 5693 O ASN M 381 8.476 -43.655-127.719 1.00149.85 O
-ANISOU 5693 O ASN M 381 11038 26556 19342 1334 -1418 -4162 O
-ATOM 5694 CB ASN M 381 10.560 -46.025-128.185 1.00148.91 C
-ANISOU 5694 CB ASN M 381 10225 27027 19325 2397 -1310 -4392 C
-ATOM 5695 N ASN M 382 7.445 -45.603-127.248 1.00143.29 N
-ANISOU 5695 N ASN M 382 10819 25179 18446 2300 -1502 -4265 N
-ATOM 5696 CA ASN M 382 6.135 -45.084-127.628 1.00131.26 C
-ANISOU 5696 CA ASN M 382 9895 23181 16795 2011 -1308 -4122 C
-ATOM 5697 C ASN M 382 5.522 -44.228-126.526 1.00131.27 C
-ANISOU 5697 C ASN M 382 10346 22788 16742 1716 -1585 -3991 C
-ATOM 5698 O ASN M 382 4.844 -43.237-126.818 1.00127.07 O
-ANISOU 5698 O ASN M 382 10110 22035 16136 1273 -1470 -3874 O
-ATOM 5699 CB ASN M 382 5.190 -46.233-127.989 1.00123.92 C
-ANISOU 5699 CB ASN M 382 9390 21889 15804 2472 -1168 -4153 C
-ATOM 5700 CG ASN M 382 5.636 -46.990-129.226 1.00126.45 C
-ANISOU 5700 CG ASN M 382 9365 22544 16136 2750 -866 -4307 C
-ATOM 5701 N VAL M 383 5.742 -44.591-125.257 1.00139.15 N
-ANISOU 5701 N VAL M 383 11420 23694 17755 1980 -1959 -4017 N
-ATOM 5702 CA VAL M 383 5.134 -43.865-124.147 1.00133.34 C
-ANISOU 5702 CA VAL M 383 11146 22596 16923 1776 -2226 -3920 C
-ATOM 5703 C VAL M 383 5.935 -42.609-123.837 1.00125.63 C
-ANISOU 5703 C VAL M 383 9873 21860 16002 1268 -2423 -3927 C
-ATOM 5704 O VAL M 383 7.163 -42.568-123.962 1.00131.92 O
-ANISOU 5704 O VAL M 383 10049 23140 16933 1201 -2507 -4012 O
-ATOM 5705 CB VAL M 383 4.992 -44.762-122.901 1.00132.26 C
-ANISOU 5705 CB VAL M 383 11266 22257 16730 2261 -2545 -3925 C
-ATOM 5706 CG1 VAL M 383 3.989 -45.868-123.158 1.00118.18 C
-ANISOU 5706 CG1 VAL M 383 9894 20122 14888 2655 -2365 -3871 C
-ATOM 5707 CG2 VAL M 383 6.342 -45.345-122.496 1.00143.00 C
-ANISOU 5707 CG2 VAL M 383 12072 24047 18214 2558 -2807 -4054 C
-ATOM 5708 N ARG M 384 5.215 -41.577-123.411 1.00114.37 N
-ANISOU 5708 N ARG M 384 8895 20085 14473 911 -2512 -3842 N
-ATOM 5709 CA ARG M 384 5.750 -40.248-123.171 1.00114.30 C
-ANISOU 5709 CA ARG M 384 8755 20165 14508 359 -2708 -3835 C
-ATOM 5710 C ARG M 384 5.039 -39.684-121.951 1.00123.24 C
-ANISOU 5710 C ARG M 384 10466 20873 15487 334 -3019 -3822 C
-ATOM 5711 O ARG M 384 4.023 -40.217-121.502 1.00131.62 O
-ANISOU 5711 O ARG M 384 12015 21594 16399 674 -2985 -3782 O
-ATOM 5712 CB ARG M 384 5.537 -39.348-124.396 1.00114.12 C
-ANISOU 5712 CB ARG M 384 8708 20144 14509 -149 -2385 -3738 C
-ATOM 5713 CG ARG M 384 6.358 -38.074-124.458 1.00107.23 C
-ANISOU 5713 CG ARG M 384 7547 19459 13737 -782 -2538 -3711 C
-ATOM 5714 CD ARG M 384 6.097 -37.372-125.786 1.00115.15 C
-ANISOU 5714 CD ARG M 384 8554 20459 14737 -1227 -2172 -3575 C
-ATOM 5715 NE ARG M 384 6.677 -36.034-125.861 1.00130.28 N
-ANISOU 5715 NE ARG M 384 10337 22427 16738 -1906 -2321 -3497 N
-ATOM 5716 CZ ARG M 384 6.675 -35.281-126.958 1.00134.29 C
-ANISOU 5716 CZ ARG M 384 10793 22978 17252 -2392 -2056 -3345 C
-ATOM 5717 NH1 ARG M 384 6.111 -35.730-128.073 1.00128.15 N1+
-ANISOU 5717 NH1 ARG M 384 10089 22221 16383 -2247 -1629 -3273 N1+
-ATOM 5718 NH2 ARG M 384 7.225 -34.074-126.941 1.00140.05 N
-ANISOU 5718 NH2 ARG M 384 11429 23712 18072 -3036 -2238 -3256 N
-ATOM 5719 N CYS M 385 5.577 -38.607-121.400 1.00123.36 N
-ANISOU 5719 N CYS M 385 10423 20918 15531 -72 -3328 -3860 N
-ATOM 5720 CA CYS M 385 4.886 -37.912-120.327 1.00122.97 C
-ANISOU 5720 CA CYS M 385 10954 20463 15308 -122 -3613 -3878 C
-ATOM 5721 C CYS M 385 3.890 -36.923-120.919 1.00116.04 C
-ANISOU 5721 C CYS M 385 10526 19204 14360 -466 -3409 -3793 C
-ATOM 5722 O CYS M 385 4.046 -36.452-122.048 1.00120.68 O
-ANISOU 5722 O CYS M 385 10914 19881 15059 -832 -3159 -3718 O
-ATOM 5723 CB CYS M 385 5.874 -37.179-119.423 1.00135.82 C
-ANISOU 5723 CB CYS M 385 12380 22242 16984 -387 -4093 -3988 C
-ATOM 5724 SG CYS M 385 6.319 -35.537-120.021 1.00160.75 S
-ANISOU 5724 SG CYS M 385 15427 25370 20282 -1205 -4159 -3963 S
-ATOM 5725 N LEU M 386 2.856 -36.611-120.142 1.00107.18 N
-ANISOU 5725 N LEU M 386 10018 17672 13035 -327 -3516 -3800 N
-ATOM 5726 CA LEU M 386 1.854 -35.646-120.579 1.00101.86 C
-ANISOU 5726 CA LEU M 386 9810 16612 12282 -584 -3375 -3742 C
-ATOM 5727 C LEU M 386 2.507 -34.274-120.702 1.00106.52 C
-ANISOU 5727 C LEU M 386 10332 17167 12975 -1177 -3604 -3772 C
-ATOM 5728 O LEU M 386 2.950 -33.693-119.706 1.00102.68 O
-ANISOU 5728 O LEU M 386 9934 16627 12452 -1289 -4019 -3890 O
-ATOM 5729 CB LEU M 386 0.683 -35.623-119.603 1.00 98.84 C
-ANISOU 5729 CB LEU M 386 10046 15864 11647 -261 -3462 -3770 C
-ATOM 5730 CG LEU M 386 -0.632 -35.110-120.186 1.00 89.48 C
-ANISOU 5730 CG LEU M 386 9316 14315 10367 -307 -3200 -3694 C
-ATOM 5731 CD1 LEU M 386 -0.883 -35.728-121.550 1.00 86.91 C
-ANISOU 5731 CD1 LEU M 386 8770 14093 10160 -304 -2774 -3568 C
-ATOM 5732 CD2 LEU M 386 -1.784 -35.411-119.244 1.00 98.16 C
-ANISOU 5732 CD2 LEU M 386 10908 15174 11213 110 -3211 -3707 C
-ATOM 5733 N GLN M 387 2.572 -33.755-121.930 1.00108.73 N
-ANISOU 5733 N GLN M 387 10471 17468 13374 -1572 -3349 -3658 N
-ATOM 5734 CA GLN M 387 3.349 -32.548-122.189 1.00109.40 C
-ANISOU 5734 CA GLN M 387 10406 17567 13595 -2202 -3543 -3638 C
-ATOM 5735 C GLN M 387 2.672 -31.295-121.648 1.00106.96 C
-ANISOU 5735 C GLN M 387 10732 16732 13177 -2418 -3815 -3687 C
-ATOM 5736 O GLN M 387 3.359 -30.359-121.229 1.00108.70 O
-ANISOU 5736 O GLN M 387 10934 16890 13478 -2838 -4182 -3748 O
-ATOM 5737 CB GLN M 387 3.602 -32.406-123.689 1.00118.91 C
-ANISOU 5737 CB GLN M 387 11291 18966 14922 -2557 -3164 -3467 C
-ATOM 5738 CG GLN M 387 4.623 -33.386-124.253 1.00121.29 C
-ANISOU 5738 CG GLN M 387 10857 19869 15360 -2462 -2956 -3454 C
-ATOM 5739 CD GLN M 387 6.034 -33.124-123.754 1.00125.53 C
-ANISOU 5739 CD GLN M 387 10842 20786 16066 -2762 -3280 -3523 C
-ATOM 5740 OE1 GLN M 387 6.633 -32.092-124.062 1.00134.64 O
-ANISOU 5740 OE1 GLN M 387 11843 21977 17338 -3377 -3393 -3447 O
-ATOM 5741 NE2 GLN M 387 6.573 -34.061-122.983 1.00119.53 N
-ANISOU 5741 NE2 GLN M 387 9779 20310 15327 -2338 -3450 -3657 N
-ATOM 5742 N HIS M 388 1.340 -31.246-121.653 1.00115.45 N
-ANISOU 5742 N HIS M 388 12364 17427 14075 -2136 -3660 -3672 N
-ATOM 5743 CA HIS M 388 0.638 -30.063-121.172 1.00118.46 C
-ANISOU 5743 CA HIS M 388 13365 17308 14338 -2267 -3907 -3743 C
-ATOM 5744 C HIS M 388 0.320 -30.113-119.682 1.00114.61 C
-ANISOU 5744 C HIS M 388 13229 16672 13646 -1889 -4239 -3940 C
-ATOM 5745 O HIS M 388 0.092 -29.058-119.079 1.00115.71 O
-ANISOU 5745 O HIS M 388 13813 16454 13697 -2028 -4563 -4064 O
-ATOM 5746 CB HIS M 388 -0.654 -29.846-121.973 1.00113.58 C
-ANISOU 5746 CB HIS M 388 13159 16369 13627 -2163 -3586 -3634 C
-ATOM 5747 CG HIS M 388 -1.613 -30.994-121.909 1.00110.32 C
-ANISOU 5747 CG HIS M 388 12826 16015 13076 -1588 -3284 -3617 C
-ATOM 5748 ND1 HIS M 388 -2.700 -31.012-121.060 1.00108.72 N
-ANISOU 5748 ND1 HIS M 388 13103 15551 12654 -1181 -3339 -3708 N
-ATOM 5749 CD2 HIS M 388 -1.656 -32.158-122.599 1.00 98.39 C
-ANISOU 5749 CD2 HIS M 388 10980 14790 11615 -1368 -2929 -3518 C
-ATOM 5750 CE1 HIS M 388 -3.367 -32.140-121.225 1.00 95.71 C
-ANISOU 5750 CE1 HIS M 388 11394 14028 10945 -778 -3031 -3638 C
-ATOM 5751 NE2 HIS M 388 -2.754 -32.853-122.153 1.00 94.37 N
-ANISOU 5751 NE2 HIS M 388 10755 14160 10941 -878 -2797 -3533 N
-ATOM 5752 N PHE M 389 0.308 -31.300-119.073 1.00109.27 N
-ANISOU 5752 N PHE M 389 12391 16250 12877 -1412 -4179 -3973 N
-ATOM 5753 CA PHE M 389 0.057 -31.401-117.634 1.00112.38 C
-ANISOU 5753 CA PHE M 389 13109 16556 13035 -1050 -4484 -4136 C
-ATOM 5754 C PHE M 389 1.322 -31.065-116.849 1.00115.54 C
-ANISOU 5754 C PHE M 389 13264 17132 13505 -1278 -4962 -4277 C
-ATOM 5755 O PHE M 389 1.401 -30.022-116.192 1.00112.63 O
-ANISOU 5755 O PHE M 389 13231 16502 13061 -1478 -5347 -4431 O
-ATOM 5756 CB PHE M 389 -0.467 -32.798-117.288 1.00109.15 C
-ANISOU 5756 CB PHE M 389 12660 16325 12488 -481 -4247 -4075 C
-ATOM 5757 CG PHE M 389 -0.578 -33.064-115.813 1.00107.65 C
-ANISOU 5757 CG PHE M 389 12734 16135 12033 -105 -4540 -4201 C
-ATOM 5758 CD1 PHE M 389 -1.473 -32.353-115.034 1.00101.20 C
-ANISOU 5758 CD1 PHE M 389 12502 15005 10945 46 -4670 -4316 C
-ATOM 5759 CD2 PHE M 389 0.192 -34.044-115.210 1.00108.33 C
-ANISOU 5759 CD2 PHE M 389 12496 16547 12116 134 -4680 -4205 C
-ATOM 5760 CE1 PHE M 389 -1.587 -32.602-113.682 1.00105.81 C
-ANISOU 5760 CE1 PHE M 389 13343 15626 11236 403 -4916 -4427 C
-ATOM 5761 CE2 PHE M 389 0.083 -34.297-113.858 1.00105.06 C
-ANISOU 5761 CE2 PHE M 389 12355 16142 11422 482 -4952 -4297 C
-ATOM 5762 CZ PHE M 389 -0.808 -33.576-113.093 1.00108.60 C
-ANISOU 5762 CZ PHE M 389 13386 16302 11575 608 -5058 -4405 C
-ATOM 5763 N TYR M 390 2.323 -31.942-116.905 1.00122.64 N
-ANISOU 5763 N TYR M 390 13578 18471 14550 -1235 -4967 -4243 N
-ATOM 5764 CA TYR M 390 3.650 -31.581-116.433 1.00124.06 C
-ANISOU 5764 CA TYR M 390 13383 18885 14869 -1548 -5397 -4352 C
-ATOM 5765 C TYR M 390 4.276 -30.569-117.391 1.00145.67 C
-ANISOU 5765 C TYR M 390 15876 21604 17869 -2237 -5407 -4284 C
-ATOM 5766 O TYR M 390 3.706 -30.211-118.426 1.00155.44 O
-ANISOU 5766 O TYR M 390 17240 22659 19161 -2435 -5074 -4143 O
-ATOM 5767 CB TYR M 390 4.546 -32.814-116.317 1.00114.20 C
-ANISOU 5767 CB TYR M 390 11530 18141 13719 -1281 -5385 -4331 C
-ATOM 5768 CG TYR M 390 3.900 -34.040-115.709 1.00116.42 C
-ANISOU 5768 CG TYR M 390 11997 18454 13783 -616 -5253 -4307 C
-ATOM 5769 CD1 TYR M 390 3.869 -34.222-114.333 1.00128.54 C
-ANISOU 5769 CD1 TYR M 390 13812 19955 15071 -286 -5614 -4428 C
-ATOM 5770 CD2 TYR M 390 3.346 -35.028-116.512 1.00114.50 C
-ANISOU 5770 CD2 TYR M 390 11657 18275 13572 -335 -4784 -4156 C
-ATOM 5771 CE1 TYR M 390 3.293 -35.346-113.772 1.00128.55 C
-ANISOU 5771 CE1 TYR M 390 13995 19984 14864 284 -5492 -4364 C
-ATOM 5772 CE2 TYR M 390 2.766 -36.155-115.960 1.00119.81 C
-ANISOU 5772 CE2 TYR M 390 12512 18946 14066 222 -4684 -4108 C
-ATOM 5773 CZ TYR M 390 2.741 -36.308-114.590 1.00129.03 C
-ANISOU 5773 CZ TYR M 390 13957 20079 14990 518 -5029 -4194 C
-ATOM 5774 OH TYR M 390 2.165 -37.428-114.035 1.00133.83 O
-ANISOU 5774 OH TYR M 390 14764 20680 15407 1037 -4925 -4105 O
-ATOM 5775 N GLY M 391 5.472 -30.106-117.048 1.00153.88 N
-ANISOU 5775 N GLY M 391 16553 22845 19069 -2625 -5803 -4367 N
-ATOM 5776 CA GLY M 391 6.235 -29.282-117.951 1.00171.79 C
-ANISOU 5776 CA GLY M 391 18472 25193 21609 -3322 -5804 -4262 C
-ATOM 5777 C GLY M 391 6.904 -30.127-119.015 1.00183.79 C
-ANISOU 5777 C GLY M 391 19254 27249 23328 -3363 -5399 -4097 C
-ATOM 5778 O GLY M 391 7.007 -31.352-118.887 1.00186.03 O
-ANISOU 5778 O GLY M 391 19247 27862 23576 -2856 -5237 -4111 O
-ATOM 5779 N PRO M 392 7.354 -29.497-120.103 1.00189.83 N
-ANISOU 5779 N PRO M 392 19727 28107 24292 -3954 -5222 -3932 N
-ATOM 5780 CA PRO M 392 8.166 -30.241-121.080 1.00190.34 C
-ANISOU 5780 CA PRO M 392 19015 28771 24532 -4019 -4862 -3802 C
-ATOM 5781 C PRO M 392 9.472 -30.743-120.493 1.00192.68 C
-ANISOU 5781 C PRO M 392 18614 29616 24979 -3990 -5148 -3915 C
-ATOM 5782 O PRO M 392 10.034 -31.725-120.993 1.00196.86 O
-ANISOU 5782 O PRO M 392 18533 30672 25594 -3745 -4877 -3883 O
-ATOM 5783 CB PRO M 392 8.402 -29.215-122.198 1.00193.16 C
-ANISOU 5783 CB PRO M 392 19279 29078 25035 -4752 -4695 -3594 C
-ATOM 5784 CG PRO M 392 7.317 -28.201-122.029 1.00190.53 C
-ANISOU 5784 CG PRO M 392 19799 28031 24564 -4881 -4825 -3590 C
-ATOM 5785 CD PRO M 392 7.061 -28.127-120.555 1.00192.06 C
-ANISOU 5785 CD PRO M 392 20411 27943 24618 -4549 -5303 -3842 C
-ATOM 5786 N ASN M 393 9.966 -30.099-119.434 1.00192.94 N
-ANISOU 5786 N ASN M 393 18750 29517 25041 -4195 -5702 -4047 N
-ATOM 5787 CA ASN M 393 11.200 -30.485-118.746 1.00198.47 C
-ANISOU 5787 CA ASN M 393 18961 30560 25886 -4104 -5985 -4050 C
-ATOM 5788 C ASN M 393 10.887 -30.625-117.255 1.00193.20 C
-ANISOU 5788 C ASN M 393 18791 29619 24997 -3677 -6435 -4237 C
-ATOM 5789 O ASN M 393 11.224 -29.758-116.446 1.00186.49 O
-ANISOU 5789 O ASN M 393 18199 28511 24149 -3976 -6901 -4285 O
-ATOM 5790 CB ASN M 393 12.307 -29.466-119.018 1.00205.49 C
-ANISOU 5790 CB ASN M 393 19497 31509 27071 -4839 -6184 -3904 C
-ATOM 5791 CG ASN M 393 11.792 -28.039-119.044 1.00207.65 C
-ANISOU 5791 CG ASN M 393 20366 31189 27344 -5407 -6406 -3892 C
-ATOM 5792 OD1 ASN M 393 10.918 -27.666-118.262 1.00206.91 O
-ANISOU 5792 OD1 ASN M 393 20982 30614 27022 -5232 -6676 -4058 O
-ATOM 5793 ND2 ASN M 393 12.329 -27.234-119.954 1.00210.75 N
-ANISOU 5793 ND2 ASN M 393 20497 31595 27983 -6057 -6276 -3692 N
-ATOM 5794 N HIS M 394 10.241 -31.732-116.898 1.00188.32 N
-ANISOU 5794 N HIS M 394 18328 29053 24172 -2979 -6287 -4323 N
-ATOM 5795 CA HIS M 394 9.818 -32.018-115.536 1.00179.56 C
-ANISOU 5795 CA HIS M 394 17725 27708 22793 -2497 -6611 -4457 C
-ATOM 5796 C HIS M 394 10.611 -33.195-114.978 1.00172.43 C
-ANISOU 5796 C HIS M 394 16396 27212 21909 -2017 -6693 -4449 C
-ATOM 5797 O HIS M 394 11.199 -33.986-115.721 1.00178.77 O
-ANISOU 5797 O HIS M 394 16589 28438 22895 -1899 -6416 -4369 O
-ATOM 5798 CB HIS M 394 8.314 -32.319-115.493 1.00173.02 C
-ANISOU 5798 CB HIS M 394 17519 26537 21684 -2066 -6389 -4526 C
-ATOM 5799 CG HIS M 394 7.721 -32.277-114.118 1.00166.73 C
-ANISOU 5799 CG HIS M 394 17378 25410 20564 -1683 -6688 -4632 C
-ATOM 5800 ND1 HIS M 394 7.664 -33.383-113.297 1.00164.25 N
-ANISOU 5800 ND1 HIS M 394 17105 25237 20067 -1073 -6730 -4639 N
-ATOM 5801 CD2 HIS M 394 7.149 -31.265-113.424 1.00167.74 C
-ANISOU 5801 CD2 HIS M 394 18165 25075 20495 -1814 -6930 -4720 C
-ATOM 5802 CE1 HIS M 394 7.089 -33.053-112.155 1.00165.85 C
-ANISOU 5802 CE1 HIS M 394 17940 25115 19961 -865 -6962 -4714 C
-ATOM 5803 NE2 HIS M 394 6.766 -31.773-112.206 1.00168.56 N
-ANISOU 5803 NE2 HIS M 394 18662 25097 20286 -1287 -7075 -4775 N
-ATOM 5804 N GLU M 395 10.625 -33.300-113.646 1.00173.28 N
-ANISOU 5804 N GLU M 395 16859 27177 21804 -1721 -7072 -4532 N
-ATOM 5805 CA GLU M 395 11.339 -34.396-112.997 1.00170.35 C
-ANISOU 5805 CA GLU M 395 16169 27136 21420 -1243 -7201 -4522 C
-ATOM 5806 C GLU M 395 10.702 -35.742-113.320 1.00175.08 C
-ANISOU 5806 C GLU M 395 16763 27835 21925 -611 -6839 -4491 C
-ATOM 5807 O GLU M 395 11.404 -36.744-113.502 1.00157.94 O
-ANISOU 5807 O GLU M 395 14102 26025 19883 -300 -6755 -4444 O
-ATOM 5808 CB GLU M 395 11.381 -34.173-111.485 1.00143.86 C
-ANISOU 5808 CB GLU M 395 13275 23582 17805 -1072 -7668 -4608 C
-ATOM 5809 N HIS M 396 9.369 -35.785-113.393 1.00191.76 N
-ANISOU 5809 N HIS M 396 19431 29616 23814 -407 -6634 -4513 N
-ATOM 5810 CA HIS M 396 8.682 -37.030-113.721 1.00191.93 C
-ANISOU 5810 CA HIS M 396 19489 29690 23744 149 -6310 -4466 C
-ATOM 5811 C HIS M 396 8.853 -37.394-115.188 1.00185.91 C
-ANISOU 5811 C HIS M 396 18196 29204 23237 31 -5883 -4411 C
-ATOM 5812 O HIS M 396 8.885 -38.580-115.533 1.00183.63 O
-ANISOU 5812 O HIS M 396 17677 29111 22985 476 -5669 -4368 O
-ATOM 5813 CB HIS M 396 7.197 -36.915-113.383 1.00196.18 C
-ANISOU 5813 CB HIS M 396 20760 29812 23969 362 -6213 -4487 C
-ATOM 5814 CG HIS M 396 6.928 -36.598-111.947 1.00210.63 C
-ANISOU 5814 CG HIS M 396 23157 31383 25491 528 -6558 -4531 C
-ATOM 5815 ND1 HIS M 396 5.713 -36.119-111.506 1.00212.16 N
-ANISOU 5815 ND1 HIS M 396 24036 31189 25386 611 -6512 -4562 N
-ATOM 5816 CD2 HIS M 396 7.717 -36.687-110.851 1.00224.79 C
-ANISOU 5816 CD2 HIS M 396 24932 33268 27210 639 -6935 -4548 C
-ATOM 5817 CE1 HIS M 396 5.765 -35.928-110.200 1.00221.13 C
-ANISOU 5817 CE1 HIS M 396 25550 32202 26266 769 -6821 -4596 C
-ATOM 5818 NE2 HIS M 396 6.971 -36.265-109.778 1.00228.48 N
-ANISOU 5818 NE2 HIS M 396 26074 33415 27324 779 -7096 -4591 N
-ATOM 5819 N CYS M 397 8.966 -36.397-116.055 1.00177.07 N
-ANISOU 5819 N CYS M 397 16910 28088 22279 -556 -5754 -4402 N
-ATOM 5820 CA CYS M 397 9.096 -36.606-117.490 1.00174.87 C
-ANISOU 5820 CA CYS M 397 16201 28041 22200 -727 -5282 -4302 C
-ATOM 5821 C CYS M 397 10.488 -37.074-117.895 1.00173.19 C
-ANISOU 5821 C CYS M 397 15196 28367 22241 -754 -5254 -4273 C
-ATOM 5822 O CYS M 397 10.815 -37.072-119.088 1.00172.64 O
-ANISOU 5822 O CYS M 397 14687 28570 22337 -983 -4890 -4200 O
-ATOM 5823 CB CYS M 397 8.735 -35.314-118.226 1.00183.37 C
-ANISOU 5823 CB CYS M 397 17478 28863 23332 -1370 -5131 -4226 C
-ATOM 5824 SG CYS M 397 8.345 -35.534-119.973 1.00196.05 S
-ANISOU 5824 SG CYS M 397 18896 30552 25041 -1504 -4460 -4048 S
-ATOM 5825 N PHE M 398 11.326 -37.486-116.951 1.00172.53 N
-ANISOU 5825 N PHE M 398 14953 28425 22176 -509 -5588 -4295 N
-ATOM 5826 CA PHE M 398 12.702 -37.855-117.252 1.00172.03 C
-ANISOU 5826 CA PHE M 398 14174 28834 22355 -532 -5574 -4249 C
-ATOM 5827 C PHE M 398 13.075 -39.252-116.791 1.00180.64 C
-ANISOU 5827 C PHE M 398 15120 30100 23415 172 -5618 -4276 C
-ATOM 5828 O PHE M 398 13.840 -39.934-117.478 1.00189.95 O
-ANISOU 5828 O PHE M 398 15757 31654 24762 345 -5389 -4251 O
-ATOM 5829 CB PHE M 398 13.667 -36.842-116.619 1.00165.01 C
-ANISOU 5829 CB PHE M 398 13109 27998 21589 -1037 -5999 -4239 C
-ATOM 5830 N ASN M 399 12.555 -39.709-115.651 1.00177.36 N
-ANISOU 5830 N ASN M 399 15206 29411 22774 597 -5900 -4317 N
-ATOM 5831 CA ASN M 399 13.049 -40.948-115.059 1.00173.15 C
-ANISOU 5831 CA ASN M 399 14563 29011 22214 1215 -6032 -4319 C
-ATOM 5832 C ASN M 399 11.957 -41.657-114.262 1.00162.93 C
-ANISOU 5832 C ASN M 399 13937 27344 20627 1728 -6111 -4309 C
-ATOM 5833 O ASN M 399 12.216 -42.216-113.191 1.00159.97 O
-ANISOU 5833 O ASN M 399 13737 26921 20123 2098 -6425 -4299 O
-ATOM 5834 CB ASN M 399 14.279 -40.684-114.185 1.00178.10 C
-ANISOU 5834 CB ASN M 399 14892 29852 22928 1109 -6472 -4335 C
-ATOM 5835 CG ASN M 399 14.021 -39.649-113.102 1.00181.51 C
-ANISOU 5835 CG ASN M 399 15785 29995 23186 792 -6890 -4369 C
-ATOM 5836 OD1 ASN M 399 12.896 -39.488-112.629 1.00176.72 O
-ANISOU 5836 OD1 ASN M 399 15826 29003 22316 895 -6912 -4386 O
-ATOM 5837 ND2 ASN M 399 15.072 -38.938-112.706 1.00185.50 N
-ANISOU 5837 ND2 ASN M 399 15963 30686 23831 407 -7227 -4379 N
-ATOM 5838 N ARG M 400 10.730 -41.657-114.777 1.00155.60 N
-ANISOU 5838 N ARG M 400 13383 26158 19581 1749 -5824 -4294 N
-ATOM 5839 CA ARG M 400 9.649 -42.438-114.194 1.00144.43 C
-ANISOU 5839 CA ARG M 400 12554 24420 17905 2237 -5828 -4246 C
-ATOM 5840 C ARG M 400 8.941 -43.209-115.296 1.00135.00 C
-ANISOU 5840 C ARG M 400 11332 23194 16769 2464 -5396 -4211 C
-ATOM 5841 O ARG M 400 8.636 -42.654-116.356 1.00125.83 O
-ANISOU 5841 O ARG M 400 10027 22069 15713 2113 -5085 -4229 O
-ATOM 5842 CB ARG M 400 8.645 -41.559-113.438 1.00138.75 C
-ANISOU 5842 CB ARG M 400 12477 23337 16903 2046 -5984 -4259 C
-ATOM 5843 CG ARG M 400 7.626 -42.353-112.626 1.00136.91 C
-ANISOU 5843 CG ARG M 400 12852 22813 16357 2544 -6022 -4171 C
-ATOM 5844 CD ARG M 400 6.739 -41.442-111.787 1.00136.36 C
-ANISOU 5844 CD ARG M 400 13410 22426 15973 2380 -6165 -4192 C
-ATOM 5845 NE ARG M 400 5.690 -42.183-111.090 1.00132.44 N
-ANISOU 5845 NE ARG M 400 13502 21660 15161 2809 -6096 -4052 N
-ATOM 5846 N THR M 401 8.688 -44.490-115.043 1.00138.07 N
-ANISOU 5846 N THR M 401 11896 23478 17086 3037 -5380 -4143 N
-ATOM 5847 CA THR M 401 8.080 -45.377-116.021 1.00134.83 C
-ANISOU 5847 CA THR M 401 11499 22988 16743 3307 -5001 -4101 C
-ATOM 5848 C THR M 401 6.788 -45.959-115.468 1.00131.69 C
-ANISOU 5848 C THR M 401 11843 22094 16099 3577 -4916 -3928 C
-ATOM 5849 O THR M 401 6.627 -46.112-114.253 1.00141.56 O
-ANISOU 5849 O THR M 401 13449 23208 17128 3781 -5236 -3869 O
-ATOM 5850 CB THR M 401 9.032 -46.517-116.406 1.00133.29 C
-ANISOU 5850 CB THR M 401 10894 23016 16735 3712 -4944 -4123 C
-ATOM 5851 N LEU M 402 5.866 -46.277-116.372 1.00124.72 N
-ANISOU 5851 N LEU M 402 11181 20963 15242 3562 -4481 -3840 N
-ATOM 5852 CA LEU M 402 4.640 -46.951-115.972 1.00126.73 C
-ANISOU 5852 CA LEU M 402 12068 20780 15304 3806 -4364 -3658 C
-ATOM 5853 C LEU M 402 4.981 -48.318-115.393 1.00135.29 C
-ANISOU 5853 C LEU M 402 13198 21835 16371 4379 -4594 -3598 C
-ATOM 5854 O LEU M 402 5.693 -49.107-116.021 1.00129.65 O
-ANISOU 5854 O LEU M 402 12094 21306 15862 4658 -4575 -3685 O
-ATOM 5855 CB LEU M 402 3.693 -47.084-117.166 1.00109.31 C
-ANISOU 5855 CB LEU M 402 10005 18355 13172 3675 -3882 -3597 C
-ATOM 5856 N LEU M 403 4.497 -48.583-114.182 1.00141.26 N
-ANISOU 5856 N LEU M 403 14439 22368 16866 4570 -4822 -3449 N
-ATOM 5857 CA LEU M 403 4.783 -49.853-113.530 1.00142.13 C
-ANISOU 5857 CA LEU M 403 14673 22403 16928 5103 -5082 -3349 C
-ATOM 5858 C LEU M 403 4.129 -50.999-114.293 1.00140.53 C
-ANISOU 5858 C LEU M 403 14659 21902 16836 5346 -4790 -3235 C
-ATOM 5859 O LEU M 403 2.998 -50.883-114.772 1.00144.34 O
-ANISOU 5859 O LEU M 403 15459 22107 17278 5130 -4438 -3128 O
-ATOM 5860 CB LEU M 403 4.286 -49.826-112.083 1.00137.24 C
-ANISOU 5860 CB LEU M 403 14593 21602 15951 5205 -5346 -3175 C
-ATOM 5861 CG LEU M 403 5.346 -49.739-110.983 1.00143.64 C
-ANISOU 5861 CG LEU M 403 15247 22681 16649 5407 -5883 -3252 C
-ATOM 5862 CD1 LEU M 403 6.027 -48.378-111.004 1.00141.41 C
-ANISOU 5862 CD1 LEU M 403 14594 22708 16428 4978 -6003 -3475 C
-ATOM 5863 CD2 LEU M 403 4.738 -50.018-109.613 1.00151.79 C
-ANISOU 5863 CD2 LEU M 403 16897 23496 17281 5605 -6101 -3033 C
-ATOM 5864 N ARG M 404 4.852 -52.110-114.409 1.00137.30 N
-ANISOU 5864 N ARG M 404 14052 21543 16572 5810 -4964 -3273 N
-ATOM 5865 CA ARG M 404 4.350 -53.298-115.089 1.00133.49 C
-ANISOU 5865 CA ARG M 404 13767 20744 16207 6092 -4768 -3194 C
-ATOM 5866 C ARG M 404 3.645 -54.275-114.144 1.00145.11 C
-ANISOU 5866 C ARG M 404 15862 21789 17484 6380 -4932 -2903 C
-ATOM 5867 O ARG M 404 3.138 -55.300-114.603 1.00142.63 O
-ANISOU 5867 O ARG M 404 15795 21136 17261 6587 -4810 -2804 O
-ATOM 5868 CB ARG M 404 5.498 -53.997-115.827 1.00131.84 C
-ANISOU 5868 CB ARG M 404 13042 20784 16266 6449 -4834 -3410 C
-ATOM 5869 CG ARG M 404 6.173 -53.135-116.895 1.00129.83 C
-ANISOU 5869 CG ARG M 404 12173 20961 16198 6126 -4584 -3655 C
-ATOM 5870 N ASN M 405 3.621 -53.987-112.838 1.00161.91 N
-ANISOU 5870 N ASN M 405 18256 23926 19335 6391 -5218 -2762 N
-ATOM 5871 CA ASN M 405 2.704 -54.646-111.904 1.00176.27 C
-ANISOU 5871 CA ASN M 405 20727 25359 20890 6515 -5281 -2428 C
-ATOM 5872 C ASN M 405 1.249 -54.369-112.268 1.00180.61 C
-ANISOU 5872 C ASN M 405 21643 25624 21355 6145 -4844 -2265 C
-ATOM 5873 O ASN M 405 0.371 -55.186-111.969 1.00196.35 O
-ANISOU 5873 O ASN M 405 24108 27252 23244 6229 -4772 -1983 O
-ATOM 5874 CB ASN M 405 3.059 -54.170-110.484 1.00179.94 C
-ANISOU 5874 CB ASN M 405 21341 25996 21034 6565 -5658 -2359 C
-ATOM 5875 CG ASN M 405 1.990 -54.449-109.397 1.00186.95 C
-ANISOU 5875 CG ASN M 405 22908 26586 21537 6564 -5655 -2002 C
-ATOM 5876 OD1 ASN M 405 1.212 -55.407-109.405 1.00167.99 O
-ANISOU 5876 OD1 ASN M 405 20904 23815 19109 6673 -5526 -1733 O
-ATOM 5877 ND2 ASN M 405 2.000 -53.520-108.442 1.00224.47 N
-ANISOU 5877 ND2 ASN M 405 27771 31538 25981 6413 -5808 -2018 N
-ATOM 5878 N SER M 406 0.985 -53.246-112.936 1.00168.88 N
-ANISOU 5878 N SER M 406 19938 24301 19927 5732 -4562 -2428 N
-ATOM 5879 CA SER M 406 -0.361 -52.850-113.352 1.00157.72 C
-ANISOU 5879 CA SER M 406 18807 22669 18450 5384 -4157 -2311 C
-ATOM 5880 C SER M 406 -1.148 -53.963-114.037 1.00154.51 C
-ANISOU 5880 C SER M 406 18632 21890 18185 5479 -3936 -2156 C
-ATOM 5881 O SER M 406 -0.859 -54.327-115.175 1.00156.91 O
-ANISOU 5881 O SER M 406 18670 22185 18765 5532 -3808 -2318 O
-ATOM 5882 CB SER M 406 -0.284 -51.646-114.295 1.00155.22 C
-ANISOU 5882 CB SER M 406 18134 22573 18270 4998 -3916 -2552 C
-ATOM 5883 OG SER M 406 0.601 -51.901-115.371 1.00156.19 O
-ANISOU 5883 OG SER M 406 17778 22869 18696 5086 -3883 -2769 O
-ATOM 5884 N GLY M 408 -4.295 -53.061-115.348 1.00133.65 N
-ANISOU 5884 N GLY M 408 16443 18841 15497 4669 -3013 -1942 N
-ATOM 5885 CA GLY M 408 -4.529 -51.944-116.244 1.00131.49 C
-ANISOU 5885 CA GLY M 408 15940 18715 15304 4340 -2759 -2135 C
-ATOM 5886 C GLY M 408 -5.221 -50.766-115.582 1.00125.48 C
-ANISOU 5886 C GLY M 408 15351 18044 14283 4087 -2671 -2091 C
-ATOM 5887 O GLY M 408 -5.371 -49.703-116.187 1.00109.41 O
-ANISOU 5887 O GLY M 408 13165 16118 12287 3819 -2513 -2248 O
-ATOM 5888 N CYS M 409 -5.658 -50.958-114.335 1.00127.32 N
-ANISOU 5888 N CYS M 409 15922 18223 14230 4188 -2777 -1874 N
-ATOM 5889 CA CYS M 409 -6.284 -49.881-113.566 1.00121.58 C
-ANISOU 5889 CA CYS M 409 15387 17603 13204 4025 -2718 -1854 C
-ATOM 5890 C CYS M 409 -5.893 -50.065-112.101 1.00116.19 C
-ANISOU 5890 C CYS M 409 14928 17010 12209 4251 -3017 -1735 C
-ATOM 5891 O CYS M 409 -6.513 -50.848-111.378 1.00109.64 O
-ANISOU 5891 O CYS M 409 14422 16049 11186 4377 -2998 -1446 O
-ATOM 5892 CB CYS M 409 -7.798 -49.864-113.747 1.00127.30 C
-ANISOU 5892 CB CYS M 409 16352 18169 13846 3856 -2373 -1672 C
-ATOM 5893 SG CYS M 409 -8.675 -48.932-112.447 1.00138.60 S
-ANISOU 5893 SG CYS M 409 18113 19731 14816 3811 -2317 -1576 S
-ATOM 5894 N GLU M 410 -4.852 -49.358-111.683 1.00118.68 N
-ANISOU 5894 N GLU M 410 15070 17553 12471 4285 -3305 -1946 N
-ATOM 5895 CA GLU M 410 -4.455 -49.299-110.285 1.00119.46 C
-ANISOU 5895 CA GLU M 410 15379 17777 12232 4479 -3623 -1886 C
-ATOM 5896 C GLU M 410 -4.381 -47.842-109.853 1.00113.92 C
-ANISOU 5896 C GLU M 410 14689 17259 11337 4299 -3704 -2106 C
-ATOM 5897 O GLU M 410 -3.977 -46.971-110.630 1.00113.11 O
-ANISOU 5897 O GLU M 410 14296 17233 11449 4067 -3679 -2353 O
-ATOM 5898 CB GLU M 410 -3.099 -49.979-110.032 1.00116.93 C
-ANISOU 5898 CB GLU M 410 14848 17554 12026 4758 -4017 -1943 C
-ATOM 5899 CG GLU M 410 -3.072 -51.475-110.308 1.00115.00 C
-ANISOU 5899 CG GLU M 410 14658 17087 11947 5012 -4022 -1736 C
-ATOM 5900 CD GLU M 410 -1.674 -52.056-110.188 1.00124.84 C
-ANISOU 5900 CD GLU M 410 15636 18455 13343 5326 -4418 -1847 C
-ATOM 5901 OE1 GLU M 410 -0.696 -51.278-110.236 1.00127.71 O
-ANISOU 5901 OE1 GLU M 410 15639 19104 13781 5273 -4620 -2117 O
-ATOM 5902 OE2 GLU M 410 -1.554 -53.292-110.050 1.00125.80 O
-ANISOU 5902 OE2 GLU M 410 15900 18382 13515 5623 -4539 -1663 O
-ATOM 5903 N ALA M 411 -4.776 -47.582-108.611 1.00117.52 N
-ANISOU 5903 N ALA M 411 15504 17777 11371 4404 -3806 -2013 N
-ATOM 5904 CA ALA M 411 -4.751 -46.241-108.042 1.00 96.56 C
-ANISOU 5904 CA ALA M 411 12950 15264 8476 4287 -3928 -2234 C
-ATOM 5905 C ALA M 411 -3.608 -46.159-107.044 1.00100.98 C
-ANISOU 5905 C ALA M 411 13501 16007 8859 4468 -4420 -2341 C
-ATOM 5906 O ALA M 411 -3.551 -46.950-106.096 1.00113.98 O
-ANISOU 5906 O ALA M 411 15387 17680 10240 4744 -4585 -2136 O
-ATOM 5907 CB ALA M 411 -6.081 -45.905-107.370 1.00 96.05 C
-ANISOU 5907 CB ALA M 411 13301 15174 8019 4302 -3676 -2098 C
-ATOM 5908 N ARG M 412 -2.699 -45.215-107.261 1.00101.78 N
-ANISOU 5908 N ARG M 412 13329 16234 9108 4296 -4670 -2646 N
-ATOM 5909 CA ARG M 412 -1.570 -45.000-106.371 1.00119.95 C
-ANISOU 5909 CA ARG M 412 15570 18732 11273 4419 -5177 -2792 C
-ATOM 5910 C ARG M 412 -1.553 -43.554-105.891 1.00125.06 C
-ANISOU 5910 C ARG M 412 16361 19440 11717 4223 -5356 -3064 C
-ATOM 5911 O ARG M 412 -2.211 -42.678-106.461 1.00118.78 O
-ANISOU 5911 O ARG M 412 15618 18529 10984 3970 -5104 -3170 O
-ATOM 5912 CB ARG M 412 -0.242 -45.356-107.057 1.00123.03 C
-ANISOU 5912 CB ARG M 412 15412 19254 12079 4404 -5401 -2914 C
-ATOM 5913 CG ARG M 412 -0.138 -44.918-108.509 1.00112.01 C
-ANISOU 5913 CG ARG M 412 13615 17829 11115 4076 -5131 -3048 C
-ATOM 5914 CD ARG M 412 1.148 -45.427-109.143 1.00110.73 C
-ANISOU 5914 CD ARG M 412 12893 17858 11322 4124 -5310 -3142 C
-ATOM 5915 N ARG M 413 -0.793 -43.314-104.818 1.00129.82 N
-ANISOU 5915 N ARG M 413 17054 20205 12068 4359 -5827 -3183 N
-ATOM 5916 CA ARG M 413 -0.726 -41.974-104.244 1.00132.00 C
-ANISOU 5916 CA ARG M 413 17507 20432 12214 4136 -5951 -3407 C
-ATOM 5917 C ARG M 413 -0.065 -40.982-105.194 1.00134.66 C
-ANISOU 5917 C ARG M 413 17457 20761 12946 3729 -6039 -3671 C
-ATOM 5918 O ARG M 413 -0.427 -39.800-105.202 1.00132.17 O
-ANISOU 5918 O ARG M 413 17324 20306 12588 3484 -5998 -3837 O
-ATOM 5919 CB ARG M 413 0.019 -42.008-102.908 1.00119.04 C
-ANISOU 5919 CB ARG M 413 16009 18867 10352 4278 -6307 -3406 C
-ATOM 5920 N ASP M 414 0.895 -41.435-105.996 1.00127.76 N
-ANISOU 5920 N ASP M 414 16054 20032 12457 3653 -6149 -3701 N
-ATOM 5921 CA ASP M 414 1.592 -40.590-106.964 1.00127.35 C
-ANISOU 5921 CA ASP M 414 15570 20023 12792 3236 -6206 -3909 C
-ATOM 5922 C ASP M 414 1.284 -41.145-108.353 1.00122.12 C
-ANISOU 5922 C ASP M 414 14606 19325 12468 3158 -5780 -3792 C
-ATOM 5923 O ASP M 414 2.030 -41.969-108.890 1.00120.29 O
-ANISOU 5923 O ASP M 414 13941 19252 12513 3246 -5782 -3737 O
-ATOM 5924 CB ASP M 414 3.096 -40.548-106.677 1.00139.29 C
-ANISOU 5924 CB ASP M 414 16664 21735 14524 3133 -6586 -3997 C
-ATOM 5925 CG ASP M 414 3.808 -39.454-107.452 1.00144.18 C
-ANISOU 5925 CG ASP M 414 16903 22397 15480 2624 -6671 -4191 C
-ATOM 5926 OD1 ASP M 414 3.128 -38.685-108.163 1.00138.81 O
-ANISOU 5926 OD1 ASP M 414 16338 21554 14850 2356 -6456 -4261 O
-ATOM 5927 OD2 ASP M 414 5.049 -39.354-107.333 1.00148.78 O
-ANISOU 5927 OD2 ASP M 414 17081 23177 16274 2480 -6956 -4257 O
-ATOM 5928 N GLU M 415 0.177 -40.687-108.930 1.00118.25 N
-ANISOU 5928 N GLU M 415 14358 18609 11965 3004 -5387 -3749 N
-ATOM 5929 CA GLU M 415 -0.306 -41.219-110.195 1.00108.63 C
-ANISOU 5929 CA GLU M 415 12947 17300 11027 2936 -4931 -3608 C
-ATOM 5930 C GLU M 415 0.501 -40.650-111.357 1.00117.03 C
-ANISOU 5930 C GLU M 415 13520 18461 12486 2552 -4905 -3740 C
-ATOM 5931 O GLU M 415 0.851 -39.466-111.368 1.00119.45 O
-ANISOU 5931 O GLU M 415 13801 18757 12829 2216 -5091 -3916 O
-ATOM 5932 CB GLU M 415 -1.791 -40.894-110.367 1.00 96.70 C
-ANISOU 5932 CB GLU M 415 11855 15539 9346 2914 -4551 -3518 C
-ATOM 5933 CG GLU M 415 -2.428 -41.472-111.622 1.00127.95 C
-ANISOU 5933 CG GLU M 415 15672 19387 13557 2859 -4096 -3369 C
-ATOM 5934 CD GLU M 415 -2.496 -42.989-111.605 1.00125.98 C
-ANISOU 5934 CD GLU M 415 15370 19157 13341 3181 -3987 -3150 C
-ATOM 5935 OE1 GLU M 415 -2.497 -43.577-110.502 1.00130.99 O
-ANISOU 5935 OE1 GLU M 415 16230 19829 13711 3472 -4172 -3045 O
-ATOM 5936 OE2 GLU M 415 -2.552 -43.593-112.697 1.00124.51 O1-
-ANISOU 5936 OE2 GLU M 415 14944 18932 13431 3144 -3730 -3083 O1-
-ATOM 5937 N TYR M 416 0.802 -41.506-112.331 1.00122.31 N
-ANISOU 5937 N TYR M 416 13811 19221 13438 2601 -4680 -3652 N
-ATOM 5938 CA TYR M 416 1.541 -41.120-113.526 1.00117.58 C
-ANISOU 5938 CA TYR M 416 12713 18771 13191 2266 -4581 -3742 C
-ATOM 5939 C TYR M 416 0.580 -40.949-114.695 1.00113.94 C
-ANISOU 5939 C TYR M 416 12349 18109 12832 2089 -4114 -3659 C
-ATOM 5940 O TYR M 416 -0.348 -41.744-114.874 1.00119.57 O
-ANISOU 5940 O TYR M 416 13288 18662 13480 2324 -3836 -3509 O
-ATOM 5941 CB TYR M 416 2.609 -42.162-113.871 1.00122.28 C
-ANISOU 5941 CB TYR M 416 12787 19659 14015 2477 -4651 -3738 C
-ATOM 5942 CG TYR M 416 3.628 -41.691-114.888 1.00131.06 C
-ANISOU 5942 CG TYR M 416 13303 21048 15448 2134 -4621 -3854 C
-ATOM 5943 CD1 TYR M 416 3.958 -40.347-115.001 1.00133.82 C
-ANISOU 5943 CD1 TYR M 416 13574 21421 15850 1647 -4749 -3968 C
-ATOM 5944 CD2 TYR M 416 4.260 -42.593-115.737 1.00137.14 C
-ANISOU 5944 CD2 TYR M 416 13595 22057 16456 2296 -4463 -3846 C
-ATOM 5945 CE1 TYR M 416 4.886 -39.912-115.929 1.00134.35 C
-ANISOU 5945 CE1 TYR M 416 13082 21765 16198 1285 -4701 -4034 C
-ATOM 5946 CE2 TYR M 416 5.191 -42.167-116.669 1.00137.79 C
-ANISOU 5946 CE2 TYR M 416 13099 22456 16799 1984 -4396 -3939 C
-ATOM 5947 CZ TYR M 416 5.499 -40.826-116.761 1.00140.76 C
-ANISOU 5947 CZ TYR M 416 13388 22873 17222 1456 -4506 -4014 C
-ATOM 5948 OH TYR M 416 6.423 -40.396-117.687 1.00144.75 O
-ANISOU 5948 OH TYR M 416 13307 23715 17976 1098 -4420 -4068 O
-ATOM 5949 N ARG M 417 0.803 -39.901-115.487 1.00107.03 N
-ANISOU 5949 N ARG M 417 11313 17238 12117 1656 -4050 -3747 N
-ATOM 5950 CA ARG M 417 -0.087 -39.534-116.582 1.00 95.88 C
-ANISOU 5950 CA ARG M 417 10024 15630 10776 1452 -3658 -3680 C
-ATOM 5951 C ARG M 417 0.726 -39.443-117.863 1.00 98.88 C
-ANISOU 5951 C ARG M 417 9887 16229 11453 1166 -3503 -3701 C
-ATOM 5952 O ARG M 417 1.603 -38.581-117.988 1.00103.90 O
-ANISOU 5952 O ARG M 417 10258 17012 12205 804 -3691 -3794 O
-ATOM 5953 CB ARG M 417 -0.798 -38.216-116.275 1.00 90.37 C
-ANISOU 5953 CB ARG M 417 9753 14665 9920 1209 -3722 -3743 C
-ATOM 5954 CG ARG M 417 -1.239 -38.142-114.822 1.00 95.12 C
-ANISOU 5954 CG ARG M 417 10786 15160 10195 1477 -3971 -3783 C
-ATOM 5955 CD ARG M 417 -2.073 -36.926-114.533 1.00 98.75 C
-ANISOU 5955 CD ARG M 417 11706 15342 10471 1331 -4003 -3869 C
-ATOM 5956 NE ARG M 417 -2.574 -36.933-113.161 1.00 99.36 N
-ANISOU 5956 NE ARG M 417 12205 15360 10187 1642 -4188 -3911 N
-ATOM 5957 CZ ARG M 417 -3.494 -37.780-112.708 1.00 98.87 C
-ANISOU 5957 CZ ARG M 417 12380 15275 9912 2008 -3980 -3765 C
-ATOM 5958 NH1 ARG M 417 -4.010 -38.697-113.515 1.00 96.37 N1+
-ANISOU 5958 NH1 ARG M 417 11930 14952 9735 2099 -3614 -3581 N1+
-ATOM 5959 NH2 ARG M 417 -3.897 -37.714-111.447 1.00 91.90 N
-ANISOU 5959 NH2 ARG M 417 11873 14383 8664 2271 -4142 -3798 N
-ATOM 5960 N THR M 418 0.432 -40.325-118.810 1.00 89.33 N
-ANISOU 5960 N THR M 418 8539 15049 10352 1317 -3165 -3614 N
-ATOM 5961 CA THR M 418 1.274 -40.566-119.970 1.00104.22 C
-ANISOU 5961 CA THR M 418 9897 17223 12477 1180 -2995 -3638 C
-ATOM 5962 C THR M 418 0.585 -40.095-121.251 1.00104.09 C
-ANISOU 5962 C THR M 418 9962 17075 12512 909 -2626 -3574 C
-ATOM 5963 O THR M 418 -0.550 -39.610-121.242 1.00103.60 O
-ANISOU 5963 O THR M 418 10350 16691 12323 848 -2517 -3515 O
-ATOM 5964 CB THR M 418 1.632 -42.051-120.052 1.00101.42 C
-ANISOU 5964 CB THR M 418 9305 17034 12196 1633 -2943 -3627 C
-ATOM 5965 OG1 THR M 418 0.435 -42.832-119.960 1.00114.82 O
-ANISOU 5965 OG1 THR M 418 11427 18425 13774 1929 -2762 -3512 O
-ATOM 5966 CG2 THR M 418 2.557 -42.438-118.916 1.00 98.13 C
-ANISOU 5966 CG2 THR M 418 8715 16814 11757 1871 -3344 -3694 C
-ATOM 5967 N GLU M 419 1.291 -40.262-122.369 1.00110.48 N
-ANISOU 5967 N GLU M 419 10317 18168 13493 772 -2431 -3589 N
-ATOM 5968 CA GLU M 419 0.840 -39.783-123.669 1.00 87.15 C
-ANISOU 5968 CA GLU M 419 7382 15157 10574 485 -2097 -3526 C
-ATOM 5969 C GLU M 419 1.591 -40.557-124.742 1.00 96.03 C
-ANISOU 5969 C GLU M 419 8002 16652 11834 574 -1860 -3557 C
-ATOM 5970 O GLU M 419 2.822 -40.622-124.707 1.00 93.23 O
-ANISOU 5970 O GLU M 419 7140 16688 11596 523 -1975 -3631 O
-ATOM 5971 CB GLU M 419 1.080 -38.274-123.797 1.00 88.84 C
-ANISOU 5971 CB GLU M 419 7631 15323 10803 -62 -2202 -3512 C
-ATOM 5972 CG GLU M 419 0.943 -37.708-125.191 1.00101.33 C
-ANISOU 5972 CG GLU M 419 9140 16932 12430 -418 -1893 -3426 C
-ATOM 5973 CD GLU M 419 1.483 -36.293-125.288 1.00107.26 C
-ANISOU 5973 CD GLU M 419 9842 17678 13233 -995 -2047 -3394 C
-ATOM 5974 OE1 GLU M 419 1.917 -35.747-124.253 1.00 93.80 O
-ANISOU 5974 OE1 GLU M 419 8179 15925 11534 -1109 -2411 -3466 O
-ATOM 5975 OE2 GLU M 419 1.474 -35.724-126.398 1.00123.18 O1-
-ANISOU 5975 OE2 GLU M 419 11801 19726 15275 -1346 -1822 -3291 O1-
-ATOM 5976 N PHE M 420 0.855 -41.145-125.683 1.00 94.88 N
-ANISOU 5976 N PHE M 420 7983 16403 11664 722 -1541 -3516 N
-ATOM 5977 CA PHE M 420 1.440 -42.055-126.659 1.00 90.09 C
-ANISOU 5977 CA PHE M 420 6971 16115 11143 921 -1314 -3581 C
-ATOM 5978 C PHE M 420 2.005 -41.309-127.866 1.00 93.00 C
-ANISOU 5978 C PHE M 420 7004 16785 11548 505 -1078 -3560 C
-ATOM 5979 O PHE M 420 1.616 -40.180-128.181 1.00 88.53 O
-ANISOU 5979 O PHE M 420 6642 16066 10932 73 -1030 -3459 O
-ATOM 5980 CB PHE M 420 0.409 -43.081-127.135 1.00 92.06 C
-ANISOU 5980 CB PHE M 420 7527 16109 11342 1273 -1108 -3565 C
-ATOM 5981 CG PHE M 420 0.369 -44.338-126.310 1.00107.18 C
-ANISOU 5981 CG PHE M 420 9525 17922 13276 1777 -1276 -3604 C
-ATOM 5982 CD1 PHE M 420 -0.614 -44.526-125.352 1.00110.00 C
-ANISOU 5982 CD1 PHE M 420 10358 17897 13538 1918 -1409 -3510 C
-ATOM 5983 CD2 PHE M 420 1.313 -45.336-126.500 1.00117.03 C
-ANISOU 5983 CD2 PHE M 420 10379 19462 14626 2121 -1298 -3726 C
-ATOM 5984 CE1 PHE M 420 -0.656 -45.686-124.596 1.00116.35 C
-ANISOU 5984 CE1 PHE M 420 11270 18591 14345 2349 -1565 -3503 C
-ATOM 5985 CE2 PHE M 420 1.277 -46.499-125.746 1.00124.73 C
-ANISOU 5985 CE2 PHE M 420 11477 20295 15619 2592 -1483 -3743 C
-ATOM 5986 CZ PHE M 420 0.292 -46.673-124.794 1.00124.98 C
-ANISOU 5986 CZ PHE M 420 12010 19922 15552 2683 -1618 -3614 C
-ATOM 5987 N THR M 421 2.937 -41.974-128.550 1.00105.96 N
-ANISOU 5987 N THR M 421 8130 18866 13264 659 -928 -3652 N
-ATOM 5988 CA THR M 421 3.543 -41.485-129.783 1.00113.95 C
-ANISOU 5988 CA THR M 421 8759 20259 14279 327 -643 -3628 C
-ATOM 5989 C THR M 421 2.956 -42.153-131.022 1.00110.86 C
-ANISOU 5989 C THR M 421 8472 19857 13791 531 -284 -3650 C
-ATOM 5990 O THR M 421 2.535 -41.464-131.956 1.00114.91 O
-ANISOU 5990 O THR M 421 9122 20331 14206 194 -55 -3544 O
-ATOM 5991 CB THR M 421 5.061 -41.700-129.748 1.00125.15 C
-ANISOU 5991 CB THR M 421 9456 22273 15821 351 -697 -3730 C
-ATOM 5992 OG1 THR M 421 5.628 -40.930-128.681 1.00124.95 O
-ANISOU 5992 OG1 THR M 421 9324 22269 15884 73 -1053 -3706 O
-ATOM 5993 CG2 THR M 421 5.695 -41.277-131.070 1.00130.86 C
-ANISOU 5993 CG2 THR M 421 9743 23460 16517 20 -347 -3689 C
-ATOM 5994 N THR M 422 2.922 -43.484-131.053 1.00104.98 N
-ANISOU 5994 N THR M 422 7693 19127 13067 1080 -257 -3789 N
-ATOM 5995 CA THR M 422 2.290 -44.188-132.160 1.00109.24 C
-ANISOU 5995 CA THR M 422 8398 19597 13512 1306 31 -3841 C
-ATOM 5996 C THR M 422 0.773 -44.082-132.052 1.00105.72 C
-ANISOU 5996 C THR M 422 8604 18577 12987 1275 17 -3734 C
-ATOM 5997 O THR M 422 0.201 -44.195-130.965 1.00106.77 O
-ANISOU 5997 O THR M 422 9055 18358 13153 1386 -222 -3686 O
-ATOM 5998 CB THR M 422 2.716 -45.657-132.180 1.00118.72 C
-ANISOU 5998 CB THR M 422 9405 20930 14772 1916 14 -4040 C
-ATOM 5999 OG1 THR M 422 2.413 -46.266-130.918 1.00117.05 O
-ANISOU 5999 OG1 THR M 422 9450 20381 14642 2221 -306 -4039 O
-ATOM 6000 CG2 THR M 422 4.211 -45.778-132.451 1.00128.88 C
-ANISOU 6000 CG2 THR M 422 9984 22860 16124 1990 73 -4170 C
-ATOM 6001 N ALA M 423 0.123 -43.859-133.188 1.00103.44 N
-ANISOU 6001 N ALA M 423 8498 18226 12580 1129 277 -3691 N
-ATOM 6002 CA ALA M 423 -1.316 -43.656-133.240 1.00 80.26 C
-ANISOU 6002 CA ALA M 423 6121 14805 9568 1067 282 -3588 C
-ATOM 6003 C ALA M 423 -2.035 -44.950-133.596 1.00 78.56 C
-ANISOU 6003 C ALA M 423 6124 14380 9346 1499 340 -3691 C
-ATOM 6004 O ALA M 423 -1.436 -45.914-134.074 1.00 80.89 O
-ANISOU 6004 O ALA M 423 6171 14903 9661 1826 421 -3855 O
-ATOM 6005 CB ALA M 423 -1.672 -42.568-134.255 1.00 79.89 C
-ANISOU 6005 CB ALA M 423 6188 14777 9391 632 484 -3463 C
-ATOM 6006 N LEU M 424 -3.340 -44.959-133.351 1.00 80.47 N
-ANISOU 6006 N LEU M 424 6834 14181 9562 1500 284 -3601 N
-ATOM 6007 CA LEU M 424 -4.197 -46.075-133.737 1.00 82.93 C
-ANISOU 6007 CA LEU M 424 7400 14234 9873 1813 321 -3668 C
-ATOM 6008 C LEU M 424 -4.906 -45.687-135.030 1.00 83.21 C
-ANISOU 6008 C LEU M 424 7602 14239 9774 1627 537 -3648 C
-ATOM 6009 O LEU M 424 -5.770 -44.804-135.030 1.00 81.20 O
-ANISOU 6009 O LEU M 424 7618 13774 9459 1354 535 -3505 O
-ATOM 6010 CB LEU M 424 -5.195 -46.415-132.632 1.00 84.32 C
-ANISOU 6010 CB LEU M 424 7942 13986 10108 1926 124 -3566 C
-ATOM 6011 CG LEU M 424 -6.100 -47.622-132.887 1.00 86.26 C
-ANISOU 6011 CG LEU M 424 8456 13928 10391 2207 119 -3605 C
-ATOM 6012 CD1 LEU M 424 -5.280 -48.830-133.324 1.00104.00 C
-ANISOU 6012 CD1 LEU M 424 10493 16323 12700 2583 125 -3802 C
-ATOM 6013 CD2 LEU M 424 -6.929 -47.955-131.656 1.00 79.08 C
-ANISOU 6013 CD2 LEU M 424 7841 12670 9535 2287 -65 -3466 C
-ATOM 6014 N GLN M 425 -4.535 -46.341-136.127 1.00 87.50 N
-ANISOU 6014 N GLN M 425 7993 15000 10252 1804 709 -3802 N
-ATOM 6015 CA GLN M 425 -5.019 -45.988-137.454 1.00 92.44 C
-ANISOU 6015 CA GLN M 425 8738 15678 10705 1643 920 -3800 C
-ATOM 6016 C GLN M 425 -6.088 -46.962-137.924 1.00 88.81 C
-ANISOU 6016 C GLN M 425 8609 14898 10238 1892 895 -3888 C
-ATOM 6017 O GLN M 425 -6.016 -48.163-137.650 1.00 83.39 O
-ANISOU 6017 O GLN M 425 7936 14094 9657 2257 793 -4028 O
-ATOM 6018 CB GLN M 425 -3.873 -45.968-138.467 1.00106.75 C
-ANISOU 6018 CB GLN M 425 10154 18011 12393 1646 1156 -3916 C
-ATOM 6019 CG GLN M 425 -2.799 -44.942-138.171 1.00124.42 C
-ANISOU 6019 CG GLN M 425 12023 20612 14639 1317 1200 -3809 C
-ATOM 6020 CD GLN M 425 -1.956 -44.634-139.387 1.00135.30 C
-ANISOU 6020 CD GLN M 425 13065 22508 15834 1179 1499 -3843 C
-ATOM 6021 OE1 GLN M 425 -2.265 -45.073-140.494 1.00125.73 O
-ANISOU 6021 OE1 GLN M 425 11954 21369 14449 1320 1681 -3942 O
-ATOM 6022 NE2 GLN M 425 -0.889 -43.867-139.191 1.00148.87 N
-ANISOU 6022 NE2 GLN M 425 14382 24606 17575 886 1550 -3756 N
-ATOM 6023 N ARG M 426 -7.076 -46.429-138.640 1.00 90.82 N
-ANISOU 6023 N ARG M 426 9139 14997 10373 1686 963 -3804 N
-ATOM 6024 CA ARG M 426 -8.095 -47.233-139.297 1.00 82.25 C
-ANISOU 6024 CA ARG M 426 8343 13652 9258 1857 942 -3893 C
-ATOM 6025 C ARG M 426 -8.382 -46.639-140.667 1.00 79.33 C
-ANISOU 6025 C ARG M 426 8057 13431 8654 1673 1121 -3889 C
-ATOM 6026 O ARG M 426 -8.195 -45.439-140.894 1.00 70.14 O
-ANISOU 6026 O ARG M 426 6849 12423 7378 1345 1218 -3734 O
-ATOM 6027 CB ARG M 426 -9.385 -47.313-138.465 1.00 67.30 C
-ANISOU 6027 CB ARG M 426 6769 11310 7492 1821 753 -3759 C
-ATOM 6028 CG ARG M 426 -9.272 -48.212-137.247 1.00 65.88 C
-ANISOU 6028 CG ARG M 426 6584 10939 7508 2059 573 -3766 C
-ATOM 6029 CD ARG M 426 -8.898 -49.617-137.663 1.00 75.00 C
-ANISOU 6029 CD ARG M 426 7708 12071 8716 2427 542 -3984 C
-ATOM 6030 NE ARG M 426 -7.950 -50.233-136.740 1.00 82.13 N
-ANISOU 6030 NE ARG M 426 8422 13034 9749 2676 430 -4033 N
-ATOM 6031 CZ ARG M 426 -8.285 -51.101-135.792 1.00 84.88 C
-ANISOU 6031 CZ ARG M 426 8932 13067 10253 2861 230 -3985 C
-ATOM 6032 NH1 ARG M 426 -9.552 -51.468-135.647 1.00 75.47 N1+
-ANISOU 6032 NH1 ARG M 426 8063 11495 9119 2796 141 -3882 N1+
-ATOM 6033 NH2 ARG M 426 -7.349 -51.612-135.001 1.00 80.52 N
-ANISOU 6033 NH2 ARG M 426 8208 12591 9794 3105 114 -4027 N
-ATOM 6034 N VAL M 427 -8.821 -47.489-141.581 1.00 80.09 N
-ANISOU 6034 N VAL M 427 8299 13463 8667 1883 1144 -4058 N
-ATOM 6035 CA VAL M 427 -9.160 -47.061-142.932 1.00 86.91 C
-ANISOU 6035 CA VAL M 427 9286 14463 9273 1755 1292 -4072 C
-ATOM 6036 C VAL M 427 -10.633 -46.682-142.974 1.00 89.19 C
-ANISOU 6036 C VAL M 427 9934 14380 9574 1594 1154 -3937 C
-ATOM 6037 O VAL M 427 -11.467 -47.269-142.277 1.00103.51 O
-ANISOU 6037 O VAL M 427 11908 15841 11580 1693 964 -3929 O
-ATOM 6038 CB VAL M 427 -8.828 -48.162-143.960 1.00102.47 C
-ANISOU 6038 CB VAL M 427 11243 16571 11122 2079 1364 -4337 C
-ATOM 6039 CG1 VAL M 427 -8.794 -47.584-145.363 1.00110.38 C
-ANISOU 6039 CG1 VAL M 427 12297 17842 11801 1928 1561 -4316 C
-ATOM 6040 CG2 VAL M 427 -7.505 -48.831-143.617 1.00110.29 C
-ANISOU 6040 CG2 VAL M 427 11906 17786 12212 2320 1395 -4432 C
-ATOM 6041 N ASP M 428 -10.954 -45.680-143.793 1.00 78.56 N
-ANISOU 6041 N ASP M 428 8703 13128 8016 1338 1247 -3814 N
-ATOM 6042 CA ASP M 428 -12.334 -45.230-143.943 1.00 73.88 C
-ANISOU 6042 CA ASP M 428 8427 12231 7414 1208 1112 -3693 C
-ATOM 6043 C ASP M 428 -13.219 -46.370-144.437 1.00 81.66 C
-ANISOU 6043 C ASP M 428 9601 12999 8426 1437 985 -3871 C
-ATOM 6044 O ASP M 428 -12.854 -47.100-145.364 1.00 89.49 O
-ANISOU 6044 O ASP M 428 10585 14145 9272 1623 1058 -4082 O
-ATOM 6045 CB ASP M 428 -12.392 -44.049-144.915 1.00 76.39 C
-ANISOU 6045 CB ASP M 428 8852 12712 7463 939 1227 -3547 C
-ATOM 6046 CG ASP M 428 -13.810 -43.564-145.176 1.00 77.02 C
-ANISOU 6046 CG ASP M 428 9250 12501 7514 848 1069 -3437 C
-ATOM 6047 OD1 ASP M 428 -14.673 -43.711-144.287 1.00 84.39 O
-ANISOU 6047 OD1 ASP M 428 10264 13134 8666 892 894 -3394 O
-ATOM 6048 OD2 ASP M 428 -14.060 -43.027-146.277 1.00 67.02 O1-
-ANISOU 6048 OD2 ASP M 428 8142 11331 5991 738 1122 -3386 O1-
-ATOM 6049 N LEU M 429 -14.385 -46.528-143.805 1.00 71.77 N
-ANISOU 6049 N LEU M 429 8514 11397 7359 1422 791 -3793 N
-ATOM 6050 CA LEU M 429 -15.314 -47.579-144.203 1.00 83.99 C
-ANISOU 6050 CA LEU M 429 10236 12705 8970 1574 633 -3935 C
-ATOM 6051 C LEU M 429 -16.213 -47.161-145.360 1.00 84.78 C
-ANISOU 6051 C LEU M 429 10547 12796 8870 1477 590 -3934 C
-ATOM 6052 O LEU M 429 -16.784 -48.027-146.030 1.00 93.23 O
-ANISOU 6052 O LEU M 429 11757 13743 9922 1601 469 -4105 O
-ATOM 6053 CB LEU M 429 -16.174 -48.017-143.013 1.00 83.94 C
-ANISOU 6053 CB LEU M 429 10274 12367 9254 1578 453 -3834 C
-ATOM 6054 CG LEU M 429 -15.495 -48.910-141.968 1.00 89.80 C
-ANISOU 6054 CG LEU M 429 10889 13030 10202 1751 419 -3878 C
-ATOM 6055 CD1 LEU M 429 -14.633 -48.102-141.005 1.00108.63 C
-ANISOU 6055 CD1 LEU M 429 13085 15579 12611 1672 515 -3739 C
-ATOM 6056 CD2 LEU M 429 -16.521 -49.736-141.211 1.00 75.87 C
-ANISOU 6056 CD2 LEU M 429 9240 10913 8675 1774 227 -3816 C
-ATOM 6057 N PHE M 430 -16.350 -45.861-145.608 1.00 79.78 N
-ANISOU 6057 N PHE M 430 9962 12268 8084 1261 655 -3748 N
-ATOM 6058 CA PHE M 430 -17.074 -45.386-146.777 1.00 86.96 C
-ANISOU 6058 CA PHE M 430 11081 13202 8758 1184 612 -3732 C
-ATOM 6059 C PHE M 430 -16.172 -45.208-147.991 1.00 90.56 C
-ANISOU 6059 C PHE M 430 11538 14002 8870 1188 809 -3816 C
-ATOM 6060 O PHE M 430 -16.678 -45.133-149.117 1.00 74.95 O
-ANISOU 6060 O PHE M 430 9756 12071 6650 1191 769 -3864 O
-ATOM 6061 CB PHE M 430 -17.788 -44.074-146.442 1.00 80.73 C
-ANISOU 6061 CB PHE M 430 10394 12308 7974 979 546 -3479 C
-ATOM 6062 CG PHE M 430 -18.870 -44.230-145.413 1.00 77.01 C
-ANISOU 6062 CG PHE M 430 9927 11550 7782 1001 365 -3408 C
-ATOM 6063 CD1 PHE M 430 -19.134 -43.224-144.501 1.00 76.19 C
-ANISOU 6063 CD1 PHE M 430 9819 11359 7770 891 342 -3214 C
-ATOM 6064 CD2 PHE M 430 -19.626 -45.390-145.360 1.00 75.03 C
-ANISOU 6064 CD2 PHE M 430 9689 11125 7693 1126 215 -3538 C
-ATOM 6065 CE1 PHE M 430 -20.130 -43.372-143.551 1.00 67.08 C
-ANISOU 6065 CE1 PHE M 430 8645 10004 6839 934 209 -3153 C
-ATOM 6066 CE2 PHE M 430 -20.623 -45.543-144.416 1.00 65.90 C
-ANISOU 6066 CE2 PHE M 430 8501 9756 6781 1116 79 -3444 C
-ATOM 6067 CZ PHE M 430 -20.874 -44.534-143.509 1.00 67.42 C
-ANISOU 6067 CZ PHE M 430 8662 9919 7037 1033 93 -3253 C
-ATOM 6068 N MET M 431 -14.855 -45.145-147.779 1.00 94.70 N
-ANISOU 6068 N MET M 431 11831 14794 9355 1189 1021 -3829 N
-ATOM 6069 CA MET M 431 -13.859 -45.157-148.851 1.00 98.50 C
-ANISOU 6069 CA MET M 431 12233 15678 9514 1225 1256 -3929 C
-ATOM 6070 C MET M 431 -14.079 -44.018-149.846 1.00 90.43 C
-ANISOU 6070 C MET M 431 11396 14804 8162 986 1333 -3741 C
-ATOM 6071 O MET M 431 -14.147 -44.223-151.059 1.00102.48 O
-ANISOU 6071 O MET M 431 13061 16506 9370 1061 1392 -3848 O
-ATOM 6072 CB MET M 431 -13.833 -46.517-149.552 1.00109.82 C
-ANISOU 6072 CB MET M 431 13717 17117 10894 1542 1218 -4229 C
-ATOM 6073 CG MET M 431 -13.260 -47.628-148.680 1.00125.41 C
-ANISOU 6073 CG MET M 431 15503 18963 13185 1769 1166 -4346 C
-ATOM 6074 SD MET M 431 -13.284 -49.251-149.460 1.00135.46 S
-ANISOU 6074 SD MET M 431 16910 20068 14488 2100 1037 -4589 S
-ATOM 6075 CE MET M 431 -15.050 -49.517-149.586 1.00141.18 C
-ANISOU 6075 CE MET M 431 17971 20361 15310 2036 720 -4611 C
-ATOM 6076 N GLY M 432 -14.184 -42.803-149.316 1.00 84.39 N
-ANISOU 6076 N GLY M 432 10660 13948 7457 706 1316 -3458 N
-ATOM 6077 CA GLY M 432 -14.223 -41.606-150.125 1.00 74.23 C
-ANISOU 6077 CA GLY M 432 9553 12775 5877 445 1386 -3228 C
-ATOM 6078 C GLY M 432 -15.594 -41.154-150.574 1.00 90.64 C
-ANISOU 6078 C GLY M 432 11978 14578 7884 422 1154 -3136 C
-ATOM 6079 O GLY M 432 -15.689 -40.132-151.265 1.00102.24 O
-ANISOU 6079 O GLY M 432 13648 16099 9098 220 1176 -2925 O
-ATOM 6080 N GLN M 433 -16.659 -41.876-150.213 1.00 81.10 N
-ANISOU 6080 N GLN M 433 10839 13084 6892 615 921 -3274 N
-ATOM 6081 CA GLN M 433 -17.993 -41.481-150.658 1.00 83.39 C
-ANISOU 6081 CA GLN M 433 11405 13152 7125 613 683 -3203 C
-ATOM 6082 C GLN M 433 -18.388 -40.121-150.100 1.00 77.23 C
-ANISOU 6082 C GLN M 433 10740 12186 6417 418 594 -2921 C
-ATOM 6083 O GLN M 433 -19.078 -39.346-150.773 1.00 74.28 O
-ANISOU 6083 O GLN M 433 10626 11737 5859 356 468 -2784 O
-ATOM 6084 CB GLN M 433 -19.021 -42.541-150.261 1.00 85.24 C
-ANISOU 6084 CB GLN M 433 11625 13141 7623 816 456 -3390 C
-ATOM 6085 CG GLN M 433 -20.471 -42.111-150.470 1.00100.03 C
-ANISOU 6085 CG GLN M 433 13695 14792 9520 815 185 -3307 C
-ATOM 6086 CD GLN M 433 -20.809 -41.838-151.927 1.00114.57 C
-ANISOU 6086 CD GLN M 433 15795 16755 10982 816 120 -3316 C
-ATOM 6087 OE1 GLN M 433 -20.204 -42.408-152.838 1.00118.73 O
-ANISOU 6087 OE1 GLN M 433 16359 17506 11249 885 238 -3474 O
-ATOM 6088 NE2 GLN M 433 -21.782 -40.960-152.153 1.00117.68 N
-ANISOU 6088 NE2 GLN M 433 16377 17012 11323 769 -77 -3152 N
-ATOM 6089 N PHE M 434 -17.951 -39.805-148.886 1.00 76.81 N
-ANISOU 6089 N PHE M 434 10522 12046 6616 342 634 -2842 N
-ATOM 6090 CA PHE M 434 -18.229 -38.516-148.272 1.00 76.37 C
-ANISOU 6090 CA PHE M 434 10593 11794 6632 180 539 -2610 C
-ATOM 6091 C PHE M 434 -16.969 -37.664-148.171 1.00 80.89 C
-ANISOU 6091 C PHE M 434 11107 12517 7110 -90 721 -2445 C
-ATOM 6092 O PHE M 434 -16.859 -36.802-147.297 1.00 85.89 O
-ANISOU 6092 O PHE M 434 11766 12981 7885 -223 657 -2308 O
-ATOM 6093 CB PHE M 434 -18.875 -38.721-146.907 1.00 70.79 C
-ANISOU 6093 CB PHE M 434 9783 10843 6272 302 399 -2648 C
-ATOM 6094 CG PHE M 434 -20.108 -39.574-146.959 1.00 77.63 C
-ANISOU 6094 CG PHE M 434 10657 11582 7256 514 228 -2782 C
-ATOM 6095 CD1 PHE M 434 -20.025 -40.945-146.787 1.00 76.43 C
-ANISOU 6095 CD1 PHE M 434 10328 11471 7240 657 255 -2981 C
-ATOM 6096 CD2 PHE M 434 -21.349 -39.007-147.198 1.00 85.45 C
-ANISOU 6096 CD2 PHE M 434 11831 12409 8229 564 20 -2706 C
-ATOM 6097 CE1 PHE M 434 -21.156 -41.735-146.842 1.00 76.03 C
-ANISOU 6097 CE1 PHE M 434 10284 11288 7317 794 80 -3087 C
-ATOM 6098 CE2 PHE M 434 -22.484 -39.792-147.253 1.00 86.24 C
-ANISOU 6098 CE2 PHE M 434 11888 12425 8453 722 -145 -2821 C
-ATOM 6099 CZ PHE M 434 -22.387 -41.157-147.074 1.00 83.72 C
-ANISOU 6099 CZ PHE M 434 11394 12138 8280 811 -114 -3004 C
-ATOM 6100 N SER M 435 -16.019 -37.889-149.074 1.00 86.14 N
-ANISOU 6100 N SER M 435 11690 13515 7524 -179 944 -2462 N
-ATOM 6101 CA SER M 435 -14.763 -37.154-149.091 1.00 87.41 C
-ANISOU 6101 CA SER M 435 11736 13891 7583 -477 1144 -2295 C
-ATOM 6102 C SER M 435 -14.890 -35.776-149.721 1.00 91.25 C
-ANISOU 6102 C SER M 435 12540 14289 7841 -769 1100 -1994 C
-ATOM 6103 O SER M 435 -13.865 -35.129-149.959 1.00 87.96 O
-ANISOU 6103 O SER M 435 12056 14074 7292 -1079 1274 -1815 O
-ATOM 6104 CB SER M 435 -13.692 -37.958-149.830 1.00 85.76 C
-ANISOU 6104 CB SER M 435 11272 14135 7176 -439 1429 -2430 C
-ATOM 6105 OG SER M 435 -14.033 -38.111-151.195 1.00 93.67 O
-ANISOU 6105 OG SER M 435 12479 15292 7820 -382 1479 -2449 O
-ATOM 6106 N GLU M 436 -16.112 -35.317-150.017 1.00 94.74 N
-ANISOU 6106 N GLU M 436 13320 14442 8234 -683 863 -1923 N
-ATOM 6107 CA GLU M 436 -16.289 -33.964-150.533 1.00103.88 C
-ANISOU 6107 CA GLU M 436 14831 15441 9196 -932 769 -1624 C
-ATOM 6108 C GLU M 436 -17.457 -33.241-149.865 1.00 96.03 C
-ANISOU 6108 C GLU M 436 14096 13997 8394 -819 446 -1564 C
-ATOM 6109 O GLU M 436 -17.958 -32.252-150.417 1.00 87.64 O
-ANISOU 6109 O GLU M 436 13399 12738 7163 -906 288 -1356 O
-ATOM 6110 CB GLU M 436 -16.465 -33.974-152.056 1.00113.89 C
-ANISOU 6110 CB GLU M 436 16323 16907 10043 -947 830 -1549 C
-ATOM 6111 CG GLU M 436 -15.293 -34.607-152.799 1.00124.81 C
-ANISOU 6111 CG GLU M 436 17461 18789 11174 -1037 1179 -1608 C
-ATOM 6112 CD GLU M 436 -15.014 -33.952-154.136 1.00141.65 C
-ANISOU 6112 CD GLU M 436 19852 21132 12838 -1265 1302 -1359 C
-ATOM 6113 OE1 GLU M 436 -15.769 -33.034-154.520 1.00145.95 O
-ANISOU 6113 OE1 GLU M 436 20800 21398 13256 -1342 1084 -1138 O
-ATOM 6114 OE2 GLU M 436 -14.035 -34.354-154.802 1.00151.10 O1-
-ANISOU 6114 OE2 GLU M 436 20849 22787 13776 -1352 1618 -1381 O1-
-ATOM 6115 N VAL M 437 -17.897 -33.707-148.693 1.00100.02 N
-ANISOU 6115 N VAL M 437 14426 14347 9230 -608 346 -1738 N
-ATOM 6116 CA VAL M 437 -18.842 -32.994-147.842 1.00 90.87 C
-ANISOU 6116 CA VAL M 437 13444 12815 8268 -489 85 -1701 C
-ATOM 6117 C VAL M 437 -18.310 -33.012-146.415 1.00 99.62 C
-ANISOU 6117 C VAL M 437 14335 13856 9662 -513 112 -1770 C
-ATOM 6118 O VAL M 437 -17.338 -33.698-146.097 1.00104.72 O
-ANISOU 6118 O VAL M 437 14678 14735 10377 -582 305 -1860 O
-ATOM 6119 CB VAL M 437 -20.262 -33.594-147.886 1.00 68.62 C
-ANISOU 6119 CB VAL M 437 10643 9899 5531 -145 -98 -1851 C
-ATOM 6120 CG1 VAL M 437 -20.848 -33.477-149.274 1.00 70.85 C
-ANISOU 6120 CG1 VAL M 437 11173 10227 5522 -111 -185 -1784 C
-ATOM 6121 CG2 VAL M 437 -20.232 -35.041-147.434 1.00 66.22 C
-ANISOU 6121 CG2 VAL M 437 9988 9765 5408 28 12 -2095 C
-ATOM 6122 N LEU M 438 -18.968 -32.246-145.549 1.00 94.60 N
-ANISOU 6122 N LEU M 438 13862 12904 9176 -422 -98 -1740 N
-ATOM 6123 CA LEU M 438 -18.606 -32.163-144.135 1.00 82.80 C
-ANISOU 6123 CA LEU M 438 12223 11317 7921 -409 -116 -1813 C
-ATOM 6124 C LEU M 438 -19.711 -32.821-143.316 1.00 78.95 C
-ANISOU 6124 C LEU M 438 11619 10758 7621 -52 -209 -1982 C
-ATOM 6125 O LEU M 438 -20.769 -32.227-143.092 1.00 77.88 O
-ANISOU 6125 O LEU M 438 11679 10401 7512 132 -402 -1969 O
-ATOM 6126 CB LEU M 438 -18.389 -30.715-143.703 1.00 74.48 C
-ANISOU 6126 CB LEU M 438 11467 9963 6870 -593 -282 -1657 C
-ATOM 6127 CG LEU M 438 -18.129 -30.533-142.205 1.00 69.56 C
-ANISOU 6127 CG LEU M 438 10751 9214 6464 -546 -352 -1757 C
-ATOM 6128 CD1 LEU M 438 -16.869 -31.271-141.783 1.00 68.05 C
-ANISOU 6128 CD1 LEU M 438 10194 9308 6356 -710 -151 -1824 C
-ATOM 6129 CD2 LEU M 438 -18.048 -29.062-141.827 1.00 70.50 C
-ANISOU 6129 CD2 LEU M 438 11235 8973 6580 -697 -573 -1634 C
-ATOM 6130 N LEU M 439 -19.465 -34.050-142.872 1.00 71.56 N
-ANISOU 6130 N LEU M 439 10360 10016 6811 48 -73 -2134 N
-ATOM 6131 CA LEU M 439 -20.401 -34.720-141.984 1.00 68.52 C
-ANISOU 6131 CA LEU M 439 9840 9582 6611 326 -135 -2258 C
-ATOM 6132 C LEU M 439 -20.278 -34.144-140.583 1.00 80.62 C
-ANISOU 6132 C LEU M 439 11384 10973 8275 366 -202 -2265 C
-ATOM 6133 O LEU M 439 -19.174 -33.879-140.099 1.00 92.19 O
-ANISOU 6133 O LEU M 439 12800 12467 9760 186 -148 -2247 O
-ATOM 6134 CB LEU M 439 -20.140 -36.221-141.950 1.00 57.79 C
-ANISOU 6134 CB LEU M 439 8184 8430 5344 401 8 -2395 C
-ATOM 6135 CG LEU M 439 -20.045 -36.931-143.291 1.00 65.59 C
-ANISOU 6135 CG LEU M 439 9151 9582 6188 374 86 -2441 C
-ATOM 6136 CD1 LEU M 439 -19.823 -38.411-143.058 1.00 62.50 C
-ANISOU 6136 CD1 LEU M 439 8501 9320 5925 490 181 -2601 C
-ATOM 6137 CD2 LEU M 439 -21.296 -36.677-144.117 1.00 79.22 C
-ANISOU 6137 CD2 LEU M 439 11066 11215 7819 479 -72 -2414 C
-ATOM 6138 N THR M 440 -21.421 -33.945-139.931 1.00 71.55 N
-ANISOU 6138 N THR M 440 10288 9695 7201 611 -325 -2301 N
-ATOM 6139 CA THR M 440 -21.445 -33.333-138.614 1.00 62.51 C
-ANISOU 6139 CA THR M 440 9199 8419 6133 704 -402 -2330 C
-ATOM 6140 C THR M 440 -22.234 -34.119-137.575 1.00 69.32 C
-ANISOU 6140 C THR M 440 9855 9361 7123 963 -370 -2422 C
-ATOM 6141 O THR M 440 -22.211 -33.735-136.400 1.00 75.12 O
-ANISOU 6141 O THR M 440 10617 10034 7891 1065 -408 -2462 O
-ATOM 6142 CB THR M 440 -22.015 -31.907-138.694 1.00 63.62 C
-ANISOU 6142 CB THR M 440 9688 8291 6191 768 -607 -2271 C
-ATOM 6143 OG1 THR M 440 -23.300 -31.936-139.325 1.00 67.46 O
-ANISOU 6143 OG1 THR M 440 10221 8762 6647 984 -694 -2268 O
-ATOM 6144 CG2 THR M 440 -21.085 -31.002-139.491 1.00 61.74 C
-ANISOU 6144 CG2 THR M 440 9694 7934 5832 448 -650 -2136 C
-ATOM 6145 N SER M 441 -22.921 -35.194-137.956 1.00 63.05 N
-ANISOU 6145 N SER M 441 8866 8701 6389 1058 -307 -2452 N
-ATOM 6146 CA SER M 441 -23.655 -35.993-136.985 1.00 66.68 C
-ANISOU 6146 CA SER M 441 9116 9249 6971 1247 -261 -2497 C
-ATOM 6147 C SER M 441 -23.617 -37.455-137.403 1.00 65.45 C
-ANISOU 6147 C SER M 441 8733 9227 6906 1195 -160 -2523 C
-ATOM 6148 O SER M 441 -23.633 -37.772-138.596 1.00 78.10 O
-ANISOU 6148 O SER M 441 10355 10855 8464 1114 -171 -2534 O
-ATOM 6149 CB SER M 441 -25.106 -35.509-136.850 1.00 76.60 C
-ANISOU 6149 CB SER M 441 10404 10473 8228 1486 -365 -2496 C
-ATOM 6150 OG SER M 441 -25.889 -36.406-136.081 1.00 81.46 O
-ANISOU 6150 OG SER M 441 10766 11229 8955 1623 -290 -2508 O
-ATOM 6151 N ILE M 442 -23.571 -38.347-136.416 1.00 63.07 N
-ANISOU 6151 N ILE M 442 8250 8997 6717 1251 -80 -2536 N
-ATOM 6152 CA ILE M 442 -23.614 -39.780-136.693 1.00 60.06 C
-ANISOU 6152 CA ILE M 442 7690 8685 6446 1217 -20 -2559 C
-ATOM 6153 C ILE M 442 -24.306 -40.497-135.541 1.00 59.13 C
-ANISOU 6153 C ILE M 442 7411 8610 6445 1323 20 -2513 C
-ATOM 6154 O ILE M 442 -24.190 -40.101-134.377 1.00 58.92 O
-ANISOU 6154 O ILE M 442 7392 8602 6393 1405 51 -2482 O
-ATOM 6155 CB ILE M 442 -22.206 -40.364-136.941 1.00 51.54 C
-ANISOU 6155 CB ILE M 442 6574 7645 5364 1098 58 -2611 C
-ATOM 6156 CG1 ILE M 442 -22.304 -41.865-137.233 1.00 51.50 C
-ANISOU 6156 CG1 ILE M 442 6433 7658 5477 1108 84 -2660 C
-ATOM 6157 CG2 ILE M 442 -21.303 -40.102-135.751 1.00 51.26 C
-ANISOU 6157 CG2 ILE M 442 6518 7624 5334 1101 96 -2597 C
-ATOM 6158 CD1 ILE M 442 -21.000 -42.519-137.600 1.00 53.54 C
-ANISOU 6158 CD1 ILE M 442 6643 7972 5728 1060 152 -2744 C
-ATOM 6159 N SER M 443 -25.062 -41.534-135.893 1.00 59.83 N
-ANISOU 6159 N SER M 443 7367 8718 6649 1308 9 -2502 N
-ATOM 6160 CA SER M 443 -25.556 -42.528-134.954 1.00 52.05 C
-ANISOU 6160 CA SER M 443 6218 7768 5792 1329 60 -2425 C
-ATOM 6161 C SER M 443 -25.616 -43.855-135.698 1.00 62.47 C
-ANISOU 6161 C SER M 443 7471 9023 7241 1223 20 -2457 C
-ATOM 6162 O SER M 443 -25.402 -43.916-136.910 1.00 71.99 O
-ANISOU 6162 O SER M 443 8752 10190 8412 1170 -44 -2557 O
-ATOM 6163 CB SER M 443 -26.917 -42.134-134.371 1.00 62.58 C
-ANISOU 6163 CB SER M 443 7439 9201 7135 1436 63 -2345 C
-ATOM 6164 OG SER M 443 -27.856 -41.828-135.386 1.00 73.44 O
-ANISOU 6164 OG SER M 443 8790 10593 8522 1445 -41 -2376 O
-ATOM 6165 N THR M 444 -25.907 -44.925-134.966 1.00 65.73 N
-ANISOU 6165 N THR M 444 7772 9414 7788 1190 46 -2370 N
-ATOM 6166 CA THR M 444 -25.798 -46.259-135.541 1.00 71.66 C
-ANISOU 6166 CA THR M 444 8513 10038 8677 1094 -21 -2413 C
-ATOM 6167 C THR M 444 -26.875 -47.167-134.969 1.00 81.46 C
-ANISOU 6167 C THR M 444 9610 11256 10084 1004 -41 -2267 C
-ATOM 6168 O THR M 444 -27.164 -47.116-133.769 1.00 90.33 O
-ANISOU 6168 O THR M 444 10650 12463 11206 1028 55 -2113 O
-ATOM 6169 CB THR M 444 -24.408 -46.850-135.274 1.00 73.17 C
-ANISOU 6169 CB THR M 444 8780 10152 8869 1127 14 -2469 C
-ATOM 6170 OG1 THR M 444 -23.457 -46.258-136.168 1.00 75.74 O
-ANISOU 6170 OG1 THR M 444 9197 10516 9065 1154 23 -2617 O
-ATOM 6171 CG2 THR M 444 -24.405 -48.359-135.449 1.00 77.96 C
-ANISOU 6171 CG2 THR M 444 9394 10584 9643 1072 -68 -2483 C
-ATOM 6172 N PHE M 445 -27.470 -47.992-135.833 1.00 69.34 N
-ANISOU 6172 N PHE M 445 8048 9617 8679 884 -170 -2312 N
-ATOM 6173 CA PHE M 445 -28.391 -49.028-135.386 1.00 67.42 C
-ANISOU 6173 CA PHE M 445 7674 9313 8630 728 -216 -2164 C
-ATOM 6174 C PHE M 445 -28.201 -50.265-136.255 1.00 69.30 C
-ANISOU 6174 C PHE M 445 8020 9301 9009 616 -387 -2278 C
-ATOM 6175 O PHE M 445 -27.432 -50.260-137.221 1.00 70.14 O
-ANISOU 6175 O PHE M 445 8280 9333 9036 695 -448 -2485 O
-ATOM 6176 CB PHE M 445 -29.843 -48.536-135.405 1.00 60.83 C
-ANISOU 6176 CB PHE M 445 6617 8664 7830 673 -228 -2072 C
-ATOM 6177 CG PHE M 445 -30.386 -48.284-136.779 1.00 66.66 C
-ANISOU 6177 CG PHE M 445 7358 9402 8570 649 -397 -2225 C
-ATOM 6178 CD1 PHE M 445 -31.181 -49.230-137.407 1.00 75.07 C
-ANISOU 6178 CD1 PHE M 445 8340 10368 9816 457 -575 -2236 C
-ATOM 6179 CD2 PHE M 445 -30.116 -47.097-137.439 1.00 67.76 C
-ANISOU 6179 CD2 PHE M 445 7599 9626 8521 804 -402 -2348 C
-ATOM 6180 CE1 PHE M 445 -31.689 -48.999-138.668 1.00 73.16 C
-ANISOU 6180 CE1 PHE M 445 8110 10136 9551 446 -759 -2386 C
-ATOM 6181 CE2 PHE M 445 -30.622 -46.860-138.701 1.00 73.50 C
-ANISOU 6181 CE2 PHE M 445 8354 10358 9216 793 -570 -2470 C
-ATOM 6182 CZ PHE M 445 -31.410 -47.813-139.315 1.00 76.68 C
-ANISOU 6182 CZ PHE M 445 8664 10686 9783 627 -751 -2499 C
-ATOM 6183 N ILE M 446 -28.905 -51.337-135.905 1.00 68.91 N
-ANISOU 6183 N ILE M 446 7898 9122 9162 429 -466 -2141 N
-ATOM 6184 CA ILE M 446 -28.762 -52.626-136.569 1.00 64.23 C
-ANISOU 6184 CA ILE M 446 7448 8227 8731 317 -664 -2242 C
-ATOM 6185 C ILE M 446 -30.105 -53.020-137.168 1.00 81.28 C
-ANISOU 6185 C ILE M 446 9469 10361 11052 85 -839 -2216 C
-ATOM 6186 O ILE M 446 -31.129 -53.003-136.475 1.00 72.82 O
-ANISOU 6186 O ILE M 446 8163 9425 10082 -77 -788 -1988 O
-ATOM 6187 CB ILE M 446 -28.262 -53.709-135.596 1.00 65.51 C
-ANISOU 6187 CB ILE M 446 7710 8164 9016 270 -660 -2092 C
-ATOM 6188 CG1 ILE M 446 -26.939 -53.291-134.960 1.00 64.71 C
-ANISOU 6188 CG1 ILE M 446 7710 8122 8754 510 -512 -2120 C
-ATOM 6189 CG2 ILE M 446 -28.091 -55.031-136.312 1.00 71.55 C
-ANISOU 6189 CG2 ILE M 446 8673 8560 9951 188 -901 -2224 C
-ATOM 6190 CD1 ILE M 446 -26.373 -54.327-134.014 1.00 70.23 C
-ANISOU 6190 CD1 ILE M 446 8532 8600 9551 512 -535 -1977 C
-ATOM 6191 N LYS M 447 -30.097 -53.369-138.452 1.00 80.03 N
-ANISOU 6191 N LYS M 447 9440 10060 10907 72 -1046 -2453 N
-ATOM 6192 CA LYS M 447 -31.255 -53.940-139.138 1.00 79.26 C
-ANISOU 6192 CA LYS M 447 9251 9879 10983 -164 -1286 -2474 C
-ATOM 6193 C LYS M 447 -30.835 -55.318-139.640 1.00 77.71 C
-ANISOU 6193 C LYS M 447 9315 9279 10931 -244 -1517 -2621 C
-ATOM 6194 O LYS M 447 -30.112 -55.430-140.635 1.00 79.73 O
-ANISOU 6194 O LYS M 447 9801 9430 11063 -75 -1614 -2908 O
-ATOM 6195 CB LYS M 447 -31.729 -53.039-140.277 1.00 86.08 C
-ANISOU 6195 CB LYS M 447 10066 10938 11701 -84 -1376 -2647 C
-ATOM 6196 CG LYS M 447 -32.955 -53.555-141.020 1.00 90.57 C
-ANISOU 6196 CG LYS M 447 10514 11458 12441 -320 -1660 -2685 C
-ATOM 6197 N GLY M 448 -31.274 -56.361-138.941 1.00 79.56 N
-ANISOU 6197 N GLY M 448 9529 9287 11413 -493 -1603 -2423 N
-ATOM 6198 CA GLY M 448 -30.885 -57.713-139.316 1.00 79.46 C
-ANISOU 6198 CA GLY M 448 9808 8823 11559 -562 -1853 -2553 C
-ATOM 6199 C GLY M 448 -29.395 -57.911-139.128 1.00 85.61 C
-ANISOU 6199 C GLY M 448 10850 9466 12211 -248 -1758 -2686 C
-ATOM 6200 O GLY M 448 -28.839 -57.637-138.058 1.00 87.40 O
-ANISOU 6200 O GLY M 448 11034 9793 12383 -147 -1539 -2500 O
-ATOM 6201 N ASP M 449 -28.733 -58.399-140.174 1.00 88.00 N
-ANISOU 6201 N ASP M 449 11419 9562 12455 -73 -1931 -3024 N
-ATOM 6202 CA ASP M 449 -27.283 -58.537-140.176 1.00 88.37 C
-ANISOU 6202 CA ASP M 449 11669 9546 12362 270 -1841 -3204 C
-ATOM 6203 C ASP M 449 -26.575 -57.259-140.605 1.00 78.29 C
-ANISOU 6203 C ASP M 449 10300 8667 10778 524 -1602 -3339 C
-ATOM 6204 O ASP M 449 -25.341 -57.240-140.667 1.00 77.03 O
-ANISOU 6204 O ASP M 449 10245 8540 10483 802 -1500 -3492 O
-ATOM 6205 CB ASP M 449 -26.864 -59.696-141.089 1.00 79.87 C
-ANISOU 6205 CB ASP M 449 10920 8081 11345 381 -2127 -3525 C
-ATOM 6206 N LEU M 450 -27.322 -56.195-140.882 1.00 71.81 N
-ANISOU 6206 N LEU M 450 9282 8149 9854 429 -1520 -3275 N
-ATOM 6207 CA LEU M 450 -26.773 -54.956-141.412 1.00 74.79 C
-ANISOU 6207 CA LEU M 450 9612 8859 9945 619 -1335 -3385 C
-ATOM 6208 C LEU M 450 -26.560 -53.937-140.304 1.00 75.24 C
-ANISOU 6208 C LEU M 450 9486 9167 9933 652 -1071 -3147 C
-ATOM 6209 O LEU M 450 -27.383 -53.811-139.393 1.00 83.04 O
-ANISOU 6209 O LEU M 450 10306 10199 11046 493 -1030 -2894 O
-ATOM 6210 CB LEU M 450 -27.704 -54.358-142.465 1.00 80.34 C
-ANISOU 6210 CB LEU M 450 10265 9708 10553 531 -1449 -3473 C
-ATOM 6211 CG LEU M 450 -27.937 -55.186-143.721 1.00 72.20 C
-ANISOU 6211 CG LEU M 450 9434 8475 9524 516 -1733 -3752 C
-ATOM 6212 CD1 LEU M 450 -28.982 -54.511-144.585 1.00 72.65 C
-ANISOU 6212 CD1 LEU M 450 9404 8707 9492 414 -1860 -3784 C
-ATOM 6213 CD2 LEU M 450 -26.630 -55.353-144.469 1.00 72.39 C
-ANISOU 6213 CD2 LEU M 450 9681 8501 9322 802 -1675 -4040 C
-ATOM 6214 N THR M 451 -25.459 -53.199-140.399 1.00 77.81 N
-ANISOU 6214 N THR M 451 9841 9676 10050 855 -895 -3236 N
-ATOM 6215 CA THR M 451 -25.196 -52.058-139.532 1.00 81.11 C
-ANISOU 6215 CA THR M 451 10121 10333 10363 896 -677 -3064 C
-ATOM 6216 C THR M 451 -25.435 -50.790-140.339 1.00 62.06 C
-ANISOU 6216 C THR M 451 7682 8155 7744 912 -626 -3119 C
-ATOM 6217 O THR M 451 -24.759 -50.556-141.343 1.00 63.29 O
-ANISOU 6217 O THR M 451 7946 8380 7720 1009 -613 -3307 O
-ATOM 6218 CB THR M 451 -23.766 -52.084-138.991 1.00 86.74 C
-ANISOU 6218 CB THR M 451 10874 11077 11006 1075 -544 -3102 C
-ATOM 6219 OG1 THR M 451 -23.483 -53.376-138.439 1.00 99.09 O
-ANISOU 6219 OG1 THR M 451 12521 12379 12751 1102 -641 -3084 O
-ATOM 6220 CG2 THR M 451 -23.589 -51.028-137.914 1.00 76.95 C
-ANISOU 6220 CG2 THR M 451 9512 10034 9692 1085 -368 -2914 C
-ATOM 6221 N ILE M 452 -26.393 -49.980-139.906 1.00 59.41 N
-ANISOU 6221 N ILE M 452 7208 7947 7418 833 -596 -2952 N
-ATOM 6222 CA ILE M 452 -26.811 -48.795-140.643 1.00 62.24 C
-ANISOU 6222 CA ILE M 452 7565 8480 7604 856 -598 -2980 C
-ATOM 6223 C ILE M 452 -26.436 -47.552-139.850 1.00 63.96 C
-ANISOU 6223 C ILE M 452 7741 8857 7703 933 -423 -2859 C
-ATOM 6224 O ILE M 452 -26.636 -47.489-138.628 1.00 87.56 O
-ANISOU 6224 O ILE M 452 10621 11871 10779 932 -338 -2702 O
-ATOM 6225 CB ILE M 452 -28.321 -48.839-140.952 1.00 60.19 C
-ANISOU 6225 CB ILE M 452 7184 8235 7452 740 -762 -2926 C
-ATOM 6226 CG1 ILE M 452 -28.629 -50.051-141.836 1.00 62.56 C
-ANISOU 6226 CG1 ILE M 452 7562 8347 7860 642 -981 -3078 C
-ATOM 6227 CG2 ILE M 452 -28.777 -47.557-141.622 1.00 59.76 C
-ANISOU 6227 CG2 ILE M 452 7140 8350 7215 807 -786 -2937 C
-ATOM 6228 CD1 ILE M 452 -30.085 -50.202-142.169 1.00 67.84 C
-ANISOU 6228 CD1 ILE M 452 8082 9033 8662 493 -1180 -3035 C
-ATOM 6229 N ALA M 453 -25.880 -46.569-140.554 1.00 56.08 N
-ANISOU 6229 N ALA M 453 6854 7961 6495 992 -378 -2929 N
-ATOM 6230 CA ALA M 453 -25.403 -45.320-139.980 1.00 54.66 C
-ANISOU 6230 CA ALA M 453 6692 7886 6190 1045 -253 -2843 C
-ATOM 6231 C ALA M 453 -26.307 -44.172-140.403 1.00 62.37 C
-ANISOU 6231 C ALA M 453 7700 8931 7067 1068 -325 -2793 C
-ATOM 6232 O ALA M 453 -26.666 -44.057-141.583 1.00 69.81 O
-ANISOU 6232 O ALA M 453 8729 9882 7914 1053 -438 -2868 O
-ATOM 6233 CB ALA M 453 -23.966 -45.033-140.417 1.00 54.32 C
-ANISOU 6233 CB ALA M 453 6755 7896 5989 1061 -151 -2932 C
-ATOM 6234 N ASN M 454 -26.672 -43.332-139.433 1.00 57.83 N
-ANISOU 6234 N ASN M 454 7072 8403 6497 1132 -276 -2678 N
-ATOM 6235 CA ASN M 454 -27.408 -42.100-139.675 1.00 54.59 C
-ANISOU 6235 CA ASN M 454 6719 8037 5986 1213 -348 -2637 C
-ATOM 6236 C ASN M 454 -26.420 -40.946-139.641 1.00 59.27 C
-ANISOU 6236 C ASN M 454 7504 8608 6408 1227 -286 -2627 C
-ATOM 6237 O ASN M 454 -25.767 -40.714-138.617 1.00 67.13 O
-ANISOU 6237 O ASN M 454 8492 9599 7414 1242 -186 -2592 O
-ATOM 6238 CB ASN M 454 -28.506 -41.892-138.633 1.00 54.99 C
-ANISOU 6238 CB ASN M 454 6590 8163 6141 1313 -342 -2542 C
-ATOM 6239 CG ASN M 454 -29.372 -43.115-138.448 1.00 66.47 C
-ANISOU 6239 CG ASN M 454 7813 9650 7791 1232 -374 -2507 C
-ATOM 6240 OD1 ASN M 454 -30.254 -43.395-139.259 1.00 75.05 O
-ANISOU 6240 OD1 ASN M 454 8825 10759 8933 1194 -519 -2539 O
-ATOM 6241 ND2 ASN M 454 -29.129 -43.853-137.373 1.00 72.49 N
-ANISOU 6241 ND2 ASN M 454 8472 10410 8660 1189 -257 -2430 N
-ATOM 6242 N LEU M 455 -26.316 -40.228-140.754 1.00 57.14 N
-ANISOU 6242 N LEU M 455 7416 8320 5974 1203 -362 -2646 N
-ATOM 6243 CA LEU M 455 -25.329 -39.176-140.929 1.00 56.14 C
-ANISOU 6243 CA LEU M 455 7492 8158 5682 1144 -317 -2611 C
-ATOM 6244 C LEU M 455 -26.017 -37.846-141.192 1.00 61.05 C
-ANISOU 6244 C LEU M 455 8296 8703 6196 1231 -453 -2544 C
-ATOM 6245 O LEU M 455 -27.058 -37.790-141.858 1.00 67.78 O
-ANISOU 6245 O LEU M 455 9156 9564 7032 1317 -594 -2548 O
-ATOM 6246 CB LEU M 455 -24.382 -39.503-142.084 1.00 58.98 C
-ANISOU 6246 CB LEU M 455 7939 8569 5901 1010 -263 -2666 C
-ATOM 6247 CG LEU M 455 -23.701 -40.868-142.002 1.00 66.56 C
-ANISOU 6247 CG LEU M 455 8743 9591 6955 978 -159 -2770 C
-ATOM 6248 CD1 LEU M 455 -22.841 -41.108-143.233 1.00 65.48 C
-ANISOU 6248 CD1 LEU M 455 8693 9552 6636 898 -96 -2849 C
-ATOM 6249 CD2 LEU M 455 -22.869 -40.965-140.734 1.00 63.15 C
-ANISOU 6249 CD2 LEU M 455 8204 9163 6628 973 -43 -2745 C
-ATOM 6250 N GLY M 456 -25.428 -36.789-140.662 1.00 55.79 N
-ANISOU 6250 N GLY M 456 7786 7948 5463 1216 -437 -2489 N
-ATOM 6251 CA GLY M 456 -25.885 -35.438-140.940 1.00 59.36 C
-ANISOU 6251 CA GLY M 456 8489 8264 5800 1296 -589 -2424 C
-ATOM 6252 C GLY M 456 -24.718 -34.580-141.371 1.00 63.73 C
-ANISOU 6252 C GLY M 456 9293 8720 6201 1091 -569 -2348 C
-ATOM 6253 O GLY M 456 -23.622 -34.676-140.814 1.00 76.54 O
-ANISOU 6253 O GLY M 456 10864 10366 7849 946 -446 -2352 O
-ATOM 6254 N THR M 457 -24.969 -33.729-142.363 1.00 64.92 N
-ANISOU 6254 N THR M 457 9709 8766 6190 1068 -704 -2264 N
-ATOM 6255 CA THR M 457 -23.931 -32.956-143.027 1.00 71.55 C
-ANISOU 6255 CA THR M 457 10798 9531 6856 816 -684 -2145 C
-ATOM 6256 C THR M 457 -23.947 -31.495-142.591 1.00 69.74 C
-ANISOU 6256 C THR M 457 10881 9025 6591 829 -844 -2053 C
-ATOM 6257 O THR M 457 -24.850 -31.025-141.895 1.00 68.36 O
-ANISOU 6257 O THR M 457 10755 8722 6496 1091 -985 -2102 O
-ATOM 6258 CB THR M 457 -24.094 -33.029-144.548 1.00 83.91 C
-ANISOU 6258 CB THR M 457 12502 11163 8217 744 -724 -2082 C
-ATOM 6259 OG1 THR M 457 -25.200 -32.206-144.945 1.00 81.05 O
-ANISOU 6259 OG1 THR M 457 12373 10635 7786 929 -967 -2022 O
-ATOM 6260 CG2 THR M 457 -24.337 -34.464-144.992 1.00 79.63 C
-ANISOU 6260 CG2 THR M 457 11696 10846 7716 795 -635 -2217 C
-ATOM 6261 N SER M 458 -22.915 -30.774-143.036 1.00 79.37 N
-ANISOU 6261 N SER M 458 12317 10159 7683 536 -823 -1918 N
-ATOM 6262 CA SER M 458 -22.824 -29.339-142.790 1.00 78.49 C
-ANISOU 6262 CA SER M 458 12574 9723 7525 484 -1011 -1808 C
-ATOM 6263 C SER M 458 -23.916 -28.576-143.527 1.00 80.09 C
-ANISOU 6263 C SER M 458 13089 9727 7614 683 -1254 -1731 C
-ATOM 6264 O SER M 458 -24.466 -27.602-142.999 1.00 75.44 O
-ANISOU 6264 O SER M 458 12749 8855 7059 876 -1469 -1736 O
-ATOM 6265 CB SER M 458 -21.445 -28.833-143.210 1.00 80.20 C
-ANISOU 6265 CB SER M 458 12920 9920 7635 54 -925 -1647 C
-ATOM 6266 OG SER M 458 -21.481 -27.458-143.547 1.00 84.29 O
-ANISOU 6266 OG SER M 458 13886 10097 8045 -56 -1141 -1473 O
-ATOM 6267 N GLU M 459 -24.241 -28.997-144.750 1.00 87.69 N
-ANISOU 6267 N GLU M 459 14058 10832 8427 667 -1245 -1673 N
-ATOM 6268 CA GLU M 459 -25.256 -28.305-145.532 1.00 89.29 C
-ANISOU 6268 CA GLU M 459 14559 10866 8502 863 -1501 -1589 C
-ATOM 6269 C GLU M 459 -26.663 -28.513-144.987 1.00 87.50 C
-ANISOU 6269 C GLU M 459 14171 10650 8425 1300 -1648 -1750 C
-ATOM 6270 O GLU M 459 -27.600 -27.888-145.490 1.00 93.84 O
-ANISOU 6270 O GLU M 459 15189 11314 9153 1532 -1897 -1707 O
-ATOM 6271 CB GLU M 459 -25.190 -28.756-146.992 1.00 81.89 C
-ANISOU 6271 CB GLU M 459 13669 10113 7333 728 -1457 -1495 C
-ATOM 6272 N GLY M 460 -26.834 -29.358-143.977 1.00 81.32 N
-ANISOU 6272 N GLY M 460 13010 10044 7845 1418 -1505 -1919 N
-ATOM 6273 CA GLY M 460 -28.146 -29.632-143.430 1.00 81.96 C
-ANISOU 6273 CA GLY M 460 12871 10206 8065 1794 -1599 -2053 C
-ATOM 6274 C GLY M 460 -28.809 -30.877-143.964 1.00 80.45 C
-ANISOU 6274 C GLY M 460 12342 10300 7924 1841 -1545 -2128 C
-ATOM 6275 O GLY M 460 -30.017 -31.053-143.760 1.00 68.03 O
-ANISOU 6275 O GLY M 460 10580 8818 6451 2125 -1656 -2207 O
-ATOM 6276 N ARG M 461 -28.063 -31.747-144.641 1.00 81.84 N
-ANISOU 6276 N ARG M 461 12431 10628 8037 1575 -1387 -2118 N
-ATOM 6277 CA ARG M 461 -28.616 -32.966-145.209 1.00 72.86 C
-ANISOU 6277 CA ARG M 461 11024 9717 6943 1594 -1367 -2209 C
-ATOM 6278 C ARG M 461 -28.592 -34.087-144.181 1.00 76.53 C
-ANISOU 6278 C ARG M 461 11105 10335 7638 1594 -1185 -2327 C
-ATOM 6279 O ARG M 461 -27.640 -34.216-143.404 1.00 82.72 O
-ANISOU 6279 O ARG M 461 11843 11109 8479 1468 -1006 -2331 O
-ATOM 6280 CB ARG M 461 -27.830 -33.399-146.447 1.00 75.68 C
-ANISOU 6280 CB ARG M 461 11500 10162 7092 1351 -1292 -2172 C
-ATOM 6281 CG ARG M 461 -27.480 -32.282-147.407 1.00 94.62 C
-ANISOU 6281 CG ARG M 461 14318 12417 9217 1253 -1403 -1999 C
-ATOM 6282 CD ARG M 461 -26.936 -32.846-148.710 1.00103.46 C
-ANISOU 6282 CD ARG M 461 15513 13704 10092 1067 -1324 -1981 C
-ATOM 6283 NE ARG M 461 -27.883 -33.776-149.317 1.00103.81 N
-ANISOU 6283 NE ARG M 461 15395 13897 10150 1216 -1447 -2118 N
-ATOM 6284 CZ ARG M 461 -28.920 -33.399-150.057 1.00112.89 C
-ANISOU 6284 CZ ARG M 461 16691 15010 11194 1388 -1723 -2089 C
-ATOM 6285 NH1 ARG M 461 -29.140 -32.110-150.274 1.00117.06 N1+
-ANISOU 6285 NH1 ARG M 461 17552 15337 11588 1460 -1899 -1920 N1+
-ATOM 6286 NH2 ARG M 461 -29.740 -34.305-150.572 1.00117.28 N
-ANISOU 6286 NH2 ARG M 461 17068 15710 11781 1490 -1851 -2230 N
-ATOM 6287 N PHE M 462 -29.650 -34.892-144.181 1.00 71.18 N
-ANISOU 6287 N PHE M 462 10154 9797 7094 1723 -1250 -2407 N
-ATOM 6288 CA PHE M 462 -29.706 -36.131-143.422 1.00 69.53 C
-ANISOU 6288 CA PHE M 462 9599 9728 7092 1679 -1100 -2488 C
-ATOM 6289 C PHE M 462 -29.680 -37.304-144.389 1.00 75.56 C
-ANISOU 6289 C PHE M 462 10274 10588 7846 1540 -1113 -2562 C
-ATOM 6290 O PHE M 462 -30.306 -37.255-145.453 1.00 95.79 O
-ANISOU 6290 O PHE M 462 12915 13174 10306 1579 -1299 -2578 O
-ATOM 6291 CB PHE M 462 -30.967 -36.200-142.557 1.00 69.06 C
-ANISOU 6291 CB PHE M 462 9265 9763 7213 1898 -1155 -2510 C
-ATOM 6292 CG PHE M 462 -31.079 -37.466-141.753 1.00 71.07 C
-ANISOU 6292 CG PHE M 462 9182 10150 7672 1818 -1004 -2545 C
-ATOM 6293 CD1 PHE M 462 -30.499 -37.557-140.498 1.00 65.47 C
-ANISOU 6293 CD1 PHE M 462 8404 9439 7031 1807 -816 -2527 C
-ATOM 6294 CD2 PHE M 462 -31.759 -38.565-142.251 1.00 75.92 C
-ANISOU 6294 CD2 PHE M 462 9573 10869 8404 1740 -1075 -2589 C
-ATOM 6295 CE1 PHE M 462 -30.596 -38.719-139.757 1.00 70.74 C
-ANISOU 6295 CE1 PHE M 462 8800 10209 7869 1727 -688 -2525 C
-ATOM 6296 CE2 PHE M 462 -31.857 -39.732-141.513 1.00 81.56 C
-ANISOU 6296 CE2 PHE M 462 10015 11659 9313 1635 -955 -2592 C
-ATOM 6297 CZ PHE M 462 -31.275 -39.808-140.265 1.00 81.72 C
-ANISOU 6297 CZ PHE M 462 9985 11678 9389 1632 -755 -2547 C
-ATOM 6298 N MET M 463 -28.959 -38.359-144.020 1.00 69.04 N
-ANISOU 6298 N MET M 463 9306 9807 7118 1401 -941 -2620 N
-ATOM 6299 CA MET M 463 -28.869 -39.516-144.898 1.00 77.12 C
-ANISOU 6299 CA MET M 463 10282 10888 8133 1296 -966 -2725 C
-ATOM 6300 C MET M 463 -28.633 -40.776-144.079 1.00 71.28 C
-ANISOU 6300 C MET M 463 9306 10165 7614 1227 -841 -2784 C
-ATOM 6301 O MET M 463 -27.984 -40.742-143.033 1.00 78.63 O
-ANISOU 6301 O MET M 463 10178 11078 8620 1215 -678 -2741 O
-ATOM 6302 CB MET M 463 -27.765 -39.332-145.947 1.00 82.66 C
-ANISOU 6302 CB MET M 463 11236 11598 8574 1182 -901 -2742 C
-ATOM 6303 CG MET M 463 -26.484 -38.715-145.440 1.00 90.65 C
-ANISOU 6303 CG MET M 463 12345 12586 9514 1090 -702 -2668 C
-ATOM 6304 SD MET M 463 -25.472 -38.164-146.827 1.00 94.83 S
-ANISOU 6304 SD MET M 463 13165 13178 9689 946 -645 -2623 S
-ATOM 6305 CE MET M 463 -26.497 -36.855-147.490 1.00100.74 C
-ANISOU 6305 CE MET M 463 14185 13816 10276 1041 -897 -2488 C
-ATOM 6306 N GLN M 464 -29.182 -41.887-144.562 1.00 59.83 N
-ANISOU 6306 N GLN M 464 7742 8729 6263 1181 -948 -2879 N
-ATOM 6307 CA GLN M 464 -28.981 -43.198-143.960 1.00 62.38 C
-ANISOU 6307 CA GLN M 464 7896 9013 6792 1098 -876 -2931 C
-ATOM 6308 C GLN M 464 -28.215 -44.081-144.931 1.00 66.49 C
-ANISOU 6308 C GLN M 464 8549 9497 7216 1035 -886 -3090 C
-ATOM 6309 O GLN M 464 -28.626 -44.237-146.090 1.00 78.58 O
-ANISOU 6309 O GLN M 464 10184 11042 8629 1033 -1055 -3189 O
-ATOM 6310 CB GLN M 464 -30.309 -43.863-143.597 1.00 65.61 C
-ANISOU 6310 CB GLN M 464 8053 9438 7438 1070 -1012 -2905 C
-ATOM 6311 CG GLN M 464 -31.043 -43.229-142.438 1.00 66.60 C
-ANISOU 6311 CG GLN M 464 7982 9650 7674 1156 -950 -2762 C
-ATOM 6312 CD GLN M 464 -32.221 -44.066-141.986 1.00 72.92 C
-ANISOU 6312 CD GLN M 464 8474 10512 8720 1078 -1029 -2713 C
-ATOM 6313 OE1 GLN M 464 -32.668 -44.966-142.698 1.00 75.37 O
-ANISOU 6313 OE1 GLN M 464 8736 10778 9124 951 -1197 -2790 O
-ATOM 6314 NE2 GLN M 464 -32.720 -43.787-140.790 1.00 83.25 N
-ANISOU 6314 NE2 GLN M 464 9573 11933 10125 1140 -909 -2584 N
-ATOM 6315 N VAL M 465 -27.111 -44.664-144.448 1.00 69.19 N
-ANISOU 6315 N VAL M 465 8889 9805 7596 1013 -719 -3129 N
-ATOM 6316 CA VAL M 465 -26.210 -45.468-145.263 1.00 81.31 C
-ANISOU 6316 CA VAL M 465 10539 11331 9023 1013 -691 -3303 C
-ATOM 6317 C VAL M 465 -26.001 -46.816-144.585 1.00 75.87 C
-ANISOU 6317 C VAL M 465 9745 10510 8571 1000 -685 -3367 C
-ATOM 6318 O VAL M 465 -26.180 -46.964-143.376 1.00 93.20 O
-ANISOU 6318 O VAL M 465 11796 12652 10963 976 -629 -3240 O
-ATOM 6319 CB VAL M 465 -24.847 -44.772-145.486 1.00 91.40 C
-ANISOU 6319 CB VAL M 465 11925 12729 10074 1028 -488 -3299 C
-ATOM 6320 CG1 VAL M 465 -24.152 -45.328-146.722 1.00101.84 C
-ANISOU 6320 CG1 VAL M 465 13383 14131 11182 1063 -471 -3489 C
-ATOM 6321 CG2 VAL M 465 -25.019 -43.265-145.589 1.00 98.55 C
-ANISOU 6321 CG2 VAL M 465 12927 13698 10821 1006 -475 -3143 C
-ATOM 6322 N VAL M 466 -25.612 -47.807-145.380 1.00 71.91 N
-ANISOU 6322 N VAL M 466 9348 9947 8030 1032 -753 -3568 N
-ATOM 6323 CA VAL M 466 -25.267 -49.132-144.876 1.00 62.30 C
-ANISOU 6323 CA VAL M 466 8101 8555 7016 1049 -776 -3653 C
-ATOM 6324 C VAL M 466 -23.755 -49.225-144.764 1.00 72.12 C
-ANISOU 6324 C VAL M 466 9375 9878 8150 1172 -578 -3736 C
-ATOM 6325 O VAL M 466 -23.035 -48.974-145.738 1.00 85.87 O
-ANISOU 6325 O VAL M 466 11219 11770 9637 1249 -504 -3872 O
-ATOM 6326 CB VAL M 466 -25.822 -50.242-145.784 1.00 75.94 C
-ANISOU 6326 CB VAL M 466 9941 10120 8792 1033 -1021 -3856 C
-ATOM 6327 CG1 VAL M 466 -25.256 -51.589-145.375 1.00 66.12 C
-ANISOU 6327 CG1 VAL M 466 8741 8654 7728 1086 -1057 -3969 C
-ATOM 6328 CG2 VAL M 466 -27.336 -50.265-145.714 1.00 94.48 C
-ANISOU 6328 CG2 VAL M 466 12184 12400 11313 877 -1233 -3754 C
-ATOM 6329 N VAL M 467 -23.275 -49.592-143.582 1.00 71.10 N
-ANISOU 6329 N VAL M 467 9142 9674 8197 1194 -493 -3646 N
-ATOM 6330 CA VAL M 467 -21.848 -49.650-143.294 1.00 76.23 C
-ANISOU 6330 CA VAL M 467 9763 10423 8779 1318 -320 -3706 C
-ATOM 6331 C VAL M 467 -21.334 -51.047-143.618 1.00 85.14 C
-ANISOU 6331 C VAL M 467 10973 11399 9978 1466 -406 -3927 C
-ATOM 6332 O VAL M 467 -21.724 -52.028-142.974 1.00 83.27 O
-ANISOU 6332 O VAL M 467 10752 10907 9982 1456 -539 -3899 O
-ATOM 6333 CB VAL M 467 -21.564 -49.293-141.829 1.00 66.96 C
-ANISOU 6333 CB VAL M 467 8452 9253 7737 1295 -217 -3505 C
-ATOM 6334 CG1 VAL M 467 -20.068 -49.279-141.575 1.00 68.92 C
-ANISOU 6334 CG1 VAL M 467 8636 9638 7913 1417 -65 -3571 C
-ATOM 6335 CG2 VAL M 467 -22.188 -47.955-141.475 1.00 57.10 C
-ANISOU 6335 CG2 VAL M 467 7158 8109 6426 1183 -169 -3317 C
-ATOM 6336 N SER M 468 -20.451 -51.135-144.612 1.00 83.71 N
-ANISOU 6336 N SER M 468 10854 11374 9577 1611 -329 -4142 N
-ATOM 6337 CA SER M 468 -19.809 -52.396-144.956 1.00 85.34 C
-ANISOU 6337 CA SER M 468 11148 11463 9815 1826 -398 -4398 C
-ATOM 6338 C SER M 468 -18.523 -52.097-145.709 1.00 87.84 C
-ANISOU 6338 C SER M 468 11419 12107 9850 2002 -190 -4570 C
-ATOM 6339 O SER M 468 -18.516 -51.257-146.615 1.00 92.46 O
-ANISOU 6339 O SER M 468 12030 12936 10164 1937 -88 -4577 O
-ATOM 6340 CB SER M 468 -20.731 -53.283-145.798 1.00 85.09 C
-ANISOU 6340 CB SER M 468 11320 11188 9821 1819 -658 -4578 C
-ATOM 6341 OG SER M 468 -20.095 -54.508-146.119 1.00 83.07 O
-ANISOU 6341 OG SER M 468 11192 10776 9593 2060 -750 -4853 O
-ATOM 6342 N ARG M 469 -17.442 -52.778-145.326 1.00 86.75 N
-ANISOU 6342 N ARG M 469 11202 11989 9770 2225 -127 -4694 N
-ATOM 6343 CA ARG M 469 -16.163 -52.588-146.005 1.00103.27 C
-ANISOU 6343 CA ARG M 469 13181 14415 11641 2356 86 -4751 C
-ATOM 6344 C ARG M 469 -16.215 -53.121-147.431 1.00112.27 C
-ANISOU 6344 C ARG M 469 14495 15576 12585 2455 42 -4920 C
-ATOM 6345 O ARG M 469 -15.760 -52.458-148.369 1.00118.18 O
-ANISOU 6345 O ARG M 469 15213 16644 13046 2425 222 -4911 O
-ATOM 6346 CB ARG M 469 -15.043 -53.262-145.209 1.00105.16 C
-ANISOU 6346 CB ARG M 469 13267 14657 12032 2573 125 -4787 C
-ATOM 6347 CG ARG M 469 -13.663 -53.150-145.845 1.00 98.77 C
-ANISOU 6347 CG ARG M 469 12278 14223 11027 2718 339 -4848 C
-ATOM 6348 CD ARG M 469 -13.292 -51.701-146.122 1.00101.32 C
-ANISOU 6348 CD ARG M 469 12434 14939 11124 2501 585 -4703 C
-ATOM 6349 NE ARG M 469 -13.333 -50.871-144.922 1.00 96.99 N
-ANISOU 6349 NE ARG M 469 11742 14408 10700 2336 619 -4532 N
-ATOM 6350 CZ ARG M 469 -12.288 -50.645-144.134 1.00108.32 C
-ANISOU 6350 CZ ARG M 469 12918 16036 12201 2380 724 -4488 C
-ATOM 6351 NH1 ARG M 469 -11.112 -51.184-144.419 1.00128.49 N1+
-ANISOU 6351 NH1 ARG M 469 15298 18803 14720 2589 810 -4595 N1+
-ATOM 6352 NH2 ARG M 469 -12.419 -49.875-143.064 1.00104.19 N
-ANISOU 6352 NH2 ARG M 469 12308 15501 11781 2218 727 -4333 N
-ATOM 6353 N SER M 470 -16.766 -54.318-147.613 1.00113.84 N
-ANISOU 6353 N SER M 470 14895 15432 12926 2565 -205 -5079 N
-ATOM 6354 CA SER M 470 -16.936 -54.901-148.941 1.00118.16 C
-ANISOU 6354 CA SER M 470 15646 15954 13295 2662 -294 -5264 C
-ATOM 6355 C SER M 470 -18.337 -54.552-149.425 1.00119.74 C
-ANISOU 6355 C SER M 470 16017 16020 13457 2444 -476 -5243 C
-ATOM 6356 O SER M 470 -19.318 -55.202-149.054 1.00117.53 O
-ANISOU 6356 O SER M 470 15863 15380 13414 2372 -749 -5290 O
-ATOM 6357 CB SER M 470 -16.711 -56.408-148.907 1.00125.56 C
-ANISOU 6357 CB SER M 470 16728 16575 14405 2906 -492 -5464 C
-ATOM 6358 OG SER M 470 -17.625 -57.041-148.031 1.00127.82 O
-ANISOU 6358 OG SER M 470 17131 16423 15011 2816 -761 -5448 O
-ATOM 6359 N GLY M 471 -18.433 -53.515-150.251 1.00128.11 N
-ANISOU 6359 N GLY M 471 17078 17374 14223 2332 -341 -5170 N
-ATOM 6360 CA GLY M 471 -19.701 -53.089-150.785 1.00136.35 C
-ANISOU 6360 CA GLY M 471 18269 18341 15195 2152 -522 -5147 C
-ATOM 6361 C GLY M 471 -19.722 -51.607-151.091 1.00141.73 C
-ANISOU 6361 C GLY M 471 18893 19341 15619 1998 -341 -4965 C
-ATOM 6362 O GLY M 471 -18.934 -50.824-150.551 1.00141.63 O
-ANISOU 6362 O GLY M 471 18700 19548 15564 1960 -98 -4823 O
-ATOM 6363 N PRO M 472 -20.627 -51.194-151.978 1.00139.73 N
-ANISOU 6363 N PRO M 472 18805 19104 15182 1902 -482 -4968 N
-ATOM 6364 CA PRO M 472 -20.756 -49.766-152.301 1.00134.41 C
-ANISOU 6364 CA PRO M 472 18133 18688 14249 1759 -359 -4787 C
-ATOM 6365 C PRO M 472 -21.423 -49.020-151.156 1.00134.72 C
-ANISOU 6365 C PRO M 472 18047 18640 14500 1611 -414 -4625 C
-ATOM 6366 O PRO M 472 -22.545 -49.340-150.757 1.00139.95 O
-ANISOU 6366 O PRO M 472 18711 19046 15419 1530 -657 -4586 O
-ATOM 6367 CB PRO M 472 -21.624 -49.765-153.563 1.00136.26 C
-ANISOU 6367 CB PRO M 472 18608 18913 14254 1743 -566 -4864 C
-ATOM 6368 CG PRO M 472 -22.435 -51.014-153.448 1.00140.66 C
-ANISOU 6368 CG PRO M 472 19231 19125 15087 1781 -879 -5043 C
-ATOM 6369 CD PRO M 472 -21.553 -52.027-152.766 1.00141.71 C
-ANISOU 6369 CD PRO M 472 19266 19133 15443 1923 -787 -5141 C
-ATOM 6370 N SER M 473 -20.721 -48.023-150.621 1.00120.15 N
-ANISOU 6370 N SER M 473 16067 16972 12612 1522 -171 -4410 N
-ATOM 6371 CA SER M 473 -21.253 -47.206-149.533 1.00105.69 C
-ANISOU 6371 CA SER M 473 14119 15024 11014 1357 -188 -4129 C
-ATOM 6372 C SER M 473 -22.101 -46.079-150.126 1.00 95.14 C
-ANISOU 6372 C SER M 473 12920 13728 9500 1237 -284 -3965 C
-ATOM 6373 O SER M 473 -21.753 -44.899-150.093 1.00 87.58 O
-ANISOU 6373 O SER M 473 11979 12896 8400 1132 -151 -3767 O
-ATOM 6374 CB SER M 473 -20.121 -46.669-148.668 1.00103.48 C
-ANISOU 6374 CB SER M 473 13661 14877 10779 1319 63 -3996 C
-ATOM 6375 N THR M 474 -23.245 -46.471-150.686 1.00 93.54 N
-ANISOU 6375 N THR M 474 12828 13398 9315 1253 -549 -4052 N
-ATOM 6376 CA THR M 474 -24.161 -45.520-151.304 1.00 96.73 C
-ANISOU 6376 CA THR M 474 13366 13827 9558 1187 -699 -3921 C
-ATOM 6377 C THR M 474 -25.364 -45.313-150.401 1.00 97.04 C
-ANISOU 6377 C THR M 474 13270 13681 9920 1126 -878 -3778 C
-ATOM 6378 O THR M 474 -26.048 -46.291-150.062 1.00 96.22 O
-ANISOU 6378 O THR M 474 13066 13418 10077 1128 -1045 -3877 O
-ATOM 6379 CB THR M 474 -24.608 -46.007-152.679 1.00 95.68 C
-ANISOU 6379 CB THR M 474 13445 13740 9168 1262 -894 -4126 C
-ATOM 6380 OG1 THR M 474 -25.112 -47.344-152.573 1.00104.29 O
-ANISOU 6380 OG1 THR M 474 14493 14636 10496 1314 -1097 -4347 O
-ATOM 6381 CG2 THR M 474 -23.442 -45.978-153.655 1.00 97.90 C
-ANISOU 6381 CG2 THR M 474 13870 14285 9042 1336 -676 -4237 C
-ATOM 6382 N PRO M 475 -25.660 -44.080-149.992 1.00 92.25 N
-ANISOU 6382 N PRO M 475 12655 13090 9304 1074 -853 -3549 N
-ATOM 6383 CA PRO M 475 -26.769 -43.859-149.056 1.00 80.43 C
-ANISOU 6383 CA PRO M 475 10994 11468 8098 1062 -987 -3427 C
-ATOM 6384 C PRO M 475 -28.105 -44.233-149.681 1.00 90.32 C
-ANISOU 6384 C PRO M 475 12243 12675 9398 1081 -1295 -3503 C
-ATOM 6385 O PRO M 475 -28.440 -43.800-150.788 1.00 90.37 O
-ANISOU 6385 O PRO M 475 12435 12751 9149 1115 -1442 -3528 O
-ATOM 6386 CB PRO M 475 -26.687 -42.357-148.754 1.00 67.21 C
-ANISOU 6386 CB PRO M 475 9393 9826 6319 1051 -913 -3209 C
-ATOM 6387 CG PRO M 475 -25.306 -41.947-149.163 1.00 75.09 C
-ANISOU 6387 CG PRO M 475 10527 10940 7062 992 -686 -3187 C
-ATOM 6388 CD PRO M 475 -24.953 -42.830-150.316 1.00 86.81 C
-ANISOU 6388 CD PRO M 475 12112 12530 8343 1024 -696 -3389 C
-ATOM 6389 N HIS M 476 -28.864 -45.058-148.962 1.00 85.31 N
-ANISOU 6389 N HIS M 476 11390 11933 9090 1042 -1402 -3527 N
-ATOM 6390 CA HIS M 476 -30.215 -45.397-149.376 1.00 68.29 C
-ANISOU 6390 CA HIS M 476 9151 9750 7045 1019 -1706 -3574 C
-ATOM 6391 C HIS M 476 -31.251 -44.401-148.872 1.00 67.96 C
-ANISOU 6391 C HIS M 476 8954 9771 7098 1063 -1787 -3391 C
-ATOM 6392 O HIS M 476 -32.394 -44.440-149.337 1.00 87.48 O
-ANISOU 6392 O HIS M 476 11340 12277 9621 1069 -2054 -3416 O
-ATOM 6393 CB HIS M 476 -30.579 -46.810-148.910 1.00 68.93 C
-ANISOU 6393 CB HIS M 476 9065 9687 7440 912 -1801 -3673 C
-ATOM 6394 CG HIS M 476 -30.576 -46.980-147.425 1.00 85.46 C
-ANISOU 6394 CG HIS M 476 10921 11728 9823 856 -1632 -3514 C
-ATOM 6395 ND1 HIS M 476 -31.710 -46.822-146.658 1.00 92.67 N
-ANISOU 6395 ND1 HIS M 476 11562 12680 10970 801 -1702 -3365 N
-ATOM 6396 CD2 HIS M 476 -29.582 -47.304-146.566 1.00 85.93 C
-ANISOU 6396 CD2 HIS M 476 10968 11726 9955 859 -1399 -3481 C
-ATOM 6397 CE1 HIS M 476 -31.412 -47.034-145.388 1.00103.53 C
-ANISOU 6397 CE1 HIS M 476 12793 14020 12523 766 -1504 -3239 C
-ATOM 6398 NE2 HIS M 476 -30.127 -47.328-145.305 1.00 99.86 N
-ANISOU 6398 NE2 HIS M 476 12492 13480 11971 801 -1335 -3306 N
-ATOM 6399 N VAL M 477 -30.890 -43.513-147.944 1.00 65.89 N
-ANISOU 6399 N VAL M 477 8649 9529 6857 1112 -1584 -3227 N
-ATOM 6400 CA VAL M 477 -31.732 -42.371-147.599 1.00 72.25 C
-ANISOU 6400 CA VAL M 477 9383 10393 7676 1225 -1658 -3082 C
-ATOM 6401 C VAL M 477 -30.886 -41.109-147.699 1.00 77.57 C
-ANISOU 6401 C VAL M 477 10317 11055 8100 1290 -1523 -2979 C
-ATOM 6402 O VAL M 477 -29.710 -41.115-147.322 1.00 85.22 O
-ANISOU 6402 O VAL M 477 11362 11996 9021 1225 -1293 -2965 O
-ATOM 6403 CB VAL M 477 -32.358 -42.510-146.193 1.00 70.29 C
-ANISOU 6403 CB VAL M 477 8810 10168 7729 1234 -1577 -2983 C
-ATOM 6404 CG1 VAL M 477 -33.205 -41.290-145.853 1.00 65.64 C
-ANISOU 6404 CG1 VAL M 477 8153 9659 7127 1416 -1650 -2870 C
-ATOM 6405 CG2 VAL M 477 -33.200 -43.772-146.108 1.00 75.09 C
-ANISOU 6405 CG2 VAL M 477 9156 10780 8593 1105 -1713 -3045 C
-ATOM 6406 N ASN M 478 -31.480 -40.031-148.219 1.00 77.76 N
-ANISOU 6406 N ASN M 478 10480 11093 7973 1411 -1689 -2902 N
-ATOM 6407 CA ASN M 478 -30.763 -38.782-148.465 1.00 70.89 C
-ANISOU 6407 CA ASN M 478 9914 10168 6855 1440 -1618 -2780 C
-ATOM 6408 C ASN M 478 -31.742 -37.652-148.767 1.00 81.17 C
-ANISOU 6408 C ASN M 478 11324 11440 8076 1625 -1859 -2686 C
-ATOM 6409 O ASN M 478 -32.327 -37.611-149.857 1.00 74.41 O
-ANISOU 6409 O ASN M 478 10584 10624 7064 1678 -2095 -2714 O
-ATOM 6410 CB ASN M 478 -29.778 -38.959-149.629 1.00 74.12 C
-ANISOU 6410 CB ASN M 478 10591 10612 6960 1321 -1553 -2823 C
-ATOM 6411 CG ASN M 478 -28.871 -37.748-149.841 1.00 74.24 C
-ANISOU 6411 CG ASN M 478 10904 10579 6726 1267 -1437 -2660 C
-ATOM 6412 OD1 ASN M 478 -29.216 -36.617-149.498 1.00 76.11 O
-ANISOU 6412 OD1 ASN M 478 11253 10707 6959 1353 -1520 -2521 O
-ATOM 6413 ND2 ASN M 478 -27.703 -37.989-150.427 1.00 70.78 N
-ANISOU 6413 ND2 ASN M 478 10595 10223 6075 1123 -1250 -2678 N
-ATOM 6414 N PHE M 479 -31.920 -36.725-147.823 1.00 67.83 N
-ANISOU 6414 N PHE M 479 9619 9677 6477 1753 -1824 -2587 N
-ATOM 6415 CA PHE M 479 -32.762 -35.557-148.057 1.00 69.96 C
-ANISOU 6415 CA PHE M 479 10032 9885 6666 1981 -2060 -2506 C
-ATOM 6416 C PHE M 479 -32.227 -34.384-147.246 1.00 69.34 C
-ANISOU 6416 C PHE M 479 10149 9637 6562 2047 -1962 -2396 C
-ATOM 6417 O PHE M 479 -31.192 -34.481-146.583 1.00 77.44 O
-ANISOU 6417 O PHE M 479 11189 10616 7620 1890 -1722 -2381 O
-ATOM 6418 CB PHE M 479 -34.232 -35.849-147.732 1.00 74.31 C
-ANISOU 6418 CB PHE M 479 10225 10571 7436 2179 -2245 -2571 C
-ATOM 6419 CG PHE M 479 -34.502 -36.116-146.280 1.00 69.71 C
-ANISOU 6419 CG PHE M 479 9300 10062 7125 2236 -2069 -2586 C
-ATOM 6420 CD1 PHE M 479 -34.859 -35.085-145.425 1.00 70.20 C
-ANISOU 6420 CD1 PHE M 479 9369 10082 7222 2484 -2070 -2539 C
-ATOM 6421 CD2 PHE M 479 -34.423 -37.402-145.773 1.00 82.63 C
-ANISOU 6421 CD2 PHE M 479 10632 11802 8961 2055 -1914 -2649 C
-ATOM 6422 CE1 PHE M 479 -35.115 -35.331-144.088 1.00 73.72 C
-ANISOU 6422 CE1 PHE M 479 9508 10634 7867 2553 -1893 -2555 C
-ATOM 6423 CE2 PHE M 479 -34.680 -37.654-144.437 1.00 80.99 C
-ANISOU 6423 CE2 PHE M 479 10126 11679 8966 2096 -1744 -2631 C
-ATOM 6424 CZ PHE M 479 -35.026 -36.616-143.594 1.00 76.89 C
-ANISOU 6424 CZ PHE M 479 9601 11165 8449 2347 -1720 -2586 C
-ATOM 6425 N LEU M 480 -32.944 -33.262-147.313 1.00 76.19 N
-ANISOU 6425 N LEU M 480 11178 10397 7372 2295 -2181 -2332 N
-ATOM 6426 CA LEU M 480 -32.554 -32.016-146.658 1.00 75.12 C
-ANISOU 6426 CA LEU M 480 11307 10039 7196 2391 -2170 -2242 C
-ATOM 6427 C LEU M 480 -33.480 -31.770-145.473 1.00 84.55 C
-ANISOU 6427 C LEU M 480 12238 11284 8604 2699 -2198 -2319 C
-ATOM 6428 O LEU M 480 -34.671 -31.495-145.656 1.00 85.67 O
-ANISOU 6428 O LEU M 480 12267 11498 8784 2989 -2421 -2352 O
-ATOM 6429 CB LEU M 480 -32.603 -30.846-147.639 1.00 78.09 C
-ANISOU 6429 CB LEU M 480 12146 10205 7320 2466 -2419 -2106 C
-ATOM 6430 CG LEU M 480 -31.470 -30.743-148.661 1.00101.80 C
-ANISOU 6430 CG LEU M 480 15494 13136 10050 2145 -2343 -1974 C
-ATOM 6431 CD1 LEU M 480 -31.923 -29.984-149.900 1.00117.05 C
-ANISOU 6431 CD1 LEU M 480 17799 14958 11715 2242 -2639 -1845 C
-ATOM 6432 CD2 LEU M 480 -30.266 -30.061-148.038 1.00107.70 C
-ANISOU 6432 CD2 LEU M 480 16459 13688 10772 1941 -2163 -1873 C
-ATOM 6433 N LEU M 481 -32.927 -31.863-144.261 1.00 82.94 N
-ANISOU 6433 N LEU M 481 10639 11316 9558 85 -1539 -626 N
-ATOM 6434 CA LEU M 481 -33.707 -31.580-143.060 1.00 79.09 C
-ANISOU 6434 CA LEU M 481 10007 10683 9359 630 -1724 -731 C
-ATOM 6435 C LEU M 481 -33.959 -30.086-142.906 1.00 84.56 C
-ANISOU 6435 C LEU M 481 11028 10969 10131 670 -2235 -651 C
-ATOM 6436 O LEU M 481 -35.107 -29.652-142.754 1.00100.92 O
-ANISOU 6436 O LEU M 481 13135 12816 12392 1009 -2595 -705 O
-ATOM 6437 CB LEU M 481 -32.986 -32.124-141.829 1.00 80.31 C
-ANISOU 6437 CB LEU M 481 9830 11046 9639 844 -1415 -914 C
-ATOM 6438 CG LEU M 481 -33.582 -33.366-141.176 1.00 69.41 C
-ANISOU 6438 CG LEU M 481 8132 9880 8363 1170 -1174 -1044 C
-ATOM 6439 CD1 LEU M 481 -32.805 -33.708-139.916 1.00 55.51 C
-ANISOU 6439 CD1 LEU M 481 6173 8228 6689 1327 -1008 -1175 C
-ATOM 6440 CD2 LEU M 481 -35.056 -33.149-140.873 1.00 58.24 C
-ANISOU 6440 CD2 LEU M 481 6688 8372 7070 1494 -1381 -1098 C
-ATOM 6441 N ASP M 482 -32.897 -29.285-142.935 1.00 78.45 N
-ANISOU 6441 N ASP M 482 10476 10089 9244 329 -2300 -566 N
-ATOM 6442 CA ASP M 482 -33.011 -27.848-142.733 1.00 90.89 C
-ANISOU 6442 CA ASP M 482 12410 11219 10904 341 -2829 -489 C
-ATOM 6443 C ASP M 482 -31.817 -27.174-143.398 1.00 90.63 C
-ANISOU 6443 C ASP M 482 12740 11118 10578 -330 -2860 -290 C
-ATOM 6444 O ASP M 482 -30.859 -27.832-143.812 1.00 86.18 O
-ANISOU 6444 O ASP M 482 12025 10924 9795 -733 -2403 -309 O
-ATOM 6445 CB ASP M 482 -33.093 -27.507-141.239 1.00105.07 C
-ANISOU 6445 CB ASP M 482 13958 12972 12991 839 -2858 -737 C
-ATOM 6446 CG ASP M 482 -33.515 -26.070-140.985 1.00123.98 C
-ANISOU 6446 CG ASP M 482 16679 14860 15569 1000 -3479 -749 C
-ATOM 6447 OD1 ASP M 482 -34.244 -25.505-141.829 1.00137.97 O
-ANISOU 6447 OD1 ASP M 482 18792 16272 17357 950 -3976 -613 O
-ATOM 6448 OD2 ASP M 482 -33.118 -25.508-139.942 1.00114.05 O1-
-ANISOU 6448 OD2 ASP M 482 15353 13530 14451 1186 -3521 -910 O1-
-ATOM 6449 N SER M 483 -31.894 -25.844-143.506 1.00 91.76 N
-ANISOU 6449 N SER M 483 13357 10780 10727 -469 -3426 -135 N
-ATOM 6450 CA SER M 483 -30.775 -25.067-144.027 1.00 94.43 C
-ANISOU 6450 CA SER M 483 14095 11024 10761 -1180 -3496 65 C
-ATOM 6451 C SER M 483 -29.628 -24.967-143.031 1.00103.19 C
-ANISOU 6451 C SER M 483 14910 12341 11958 -1188 -3179 -120 C
-ATOM 6452 O SER M 483 -28.498 -24.668-143.433 1.00111.21 O
-ANISOU 6452 O SER M 483 16058 13489 12707 -1831 -3014 -48 O
-ATOM 6453 CB SER M 483 -31.244 -23.664-144.419 1.00103.90 C
-ANISOU 6453 CB SER M 483 15973 11554 11952 -1337 -4304 316 C
-ATOM 6454 OG SER M 483 -31.784 -22.971-143.307 1.00105.18 O
-ANISOU 6454 OG SER M 483 16054 11363 12545 -691 -4694 118 O
-ATOM 6455 N HIS M 484 -29.894 -25.215-141.729 1.00 98.59 N
-ANISOU 6455 N HIS M 484 13924 11815 11719 -528 -3090 -380 N
-ATOM 6456 CA HIS M 484 -28.929 -25.138-140.645 1.00 99.56 C
-ANISOU 6456 CA HIS M 484 13776 12095 11958 -444 -2872 -567 C
-ATOM 6457 C HIS M 484 -28.163 -26.450-140.513 1.00 87.92 C
-ANISOU 6457 C HIS M 484 11794 11164 10447 -479 -2260 -740 C
-ATOM 6458 O HIS M 484 -28.697 -27.522-140.816 1.00 88.69 O
-ANISOU 6458 O HIS M 484 11666 11488 10545 -297 -2017 -783 O
-ATOM 6459 CB HIS M 484 -29.635 -24.819-139.329 1.00113.54 C
-ANISOU 6459 CB HIS M 484 15402 13681 14056 235 -3087 -779 C
-ATOM 6460 CG HIS M 484 -30.461 -23.570-139.373 1.00140.58 C
-ANISOU 6460 CG HIS M 484 19242 16544 17627 402 -3743 -730 C
-ATOM 6461 ND1 HIS M 484 -30.366 -22.650-140.395 1.00152.49 N
-ANISOU 6461 ND1 HIS M 484 20604 17887 19447 1031 -3975 -1006 N
-ATOM 6462 CD2 HIS M 484 -31.399 -23.091-138.522 1.00153.40 C
-ANISOU 6462 CD2 HIS M 484 21433 17712 19138 11 -4261 -471 C
-ATOM 6463 CE1 HIS M 484 -31.209 -21.657-140.170 1.00158.90 C
-ANISOU 6463 CE1 HIS M 484 21824 18147 20404 1099 -4632 -967 C
-ATOM 6464 NE2 HIS M 484 -31.847 -21.900-139.040 1.00161.48 N
-ANISOU 6464 NE2 HIS M 484 22633 18247 20473 482 -4858 -604 N
-ATOM 6465 N PRO M 485 -26.905 -26.391-140.073 1.00 81.66 N
-ANISOU 6465 N PRO M 485 10811 10562 9654 -704 -2053 -867 N
-ATOM 6466 CA PRO M 485 -26.116 -27.620-139.937 1.00 69.04 C
-ANISOU 6466 CA PRO M 485 8706 9425 8100 -690 -1573 -1095 C
-ATOM 6467 C PRO M 485 -26.721 -28.560-138.908 1.00 81.82 C
-ANISOU 6467 C PRO M 485 10017 11122 9949 -34 -1490 -1235 C
-ATOM 6468 O PRO M 485 -27.411 -28.140-137.976 1.00 94.91 O
-ANISOU 6468 O PRO M 485 11761 12566 11736 373 -1723 -1240 O
-ATOM 6469 CB PRO M 485 -24.740 -27.114-139.489 1.00 71.12 C
-ANISOU 6469 CB PRO M 485 8841 9788 8394 -990 -1513 -1236 C
-ATOM 6470 CG PRO M 485 -24.702 -25.682-139.907 1.00 87.53 C
-ANISOU 6470 CG PRO M 485 11441 11520 10296 -1435 -1867 -1007 C
-ATOM 6471 CD PRO M 485 -26.110 -25.189-139.775 1.00 87.52 C
-ANISOU 6471 CD PRO M 485 11796 11087 10370 -1021 -2293 -826 C
-ATOM 6472 N VAL M 486 -26.450 -29.847-139.086 1.00 70.85 N
-ANISOU 6472 N VAL M 486 8278 10046 8595 26 -1162 -1377 N
-ATOM 6473 CA VAL M 486 -27.008 -30.873-138.213 1.00 71.15 C
-ANISOU 6473 CA VAL M 486 8095 10150 8789 537 -1097 -1465 C
-ATOM 6474 C VAL M 486 -26.132 -31.012-136.976 1.00 73.45 C
-ANISOU 6474 C VAL M 486 8174 10486 9246 729 -1122 -1636 C
-ATOM 6475 O VAL M 486 -24.918 -31.224-137.081 1.00 76.10 O
-ANISOU 6475 O VAL M 486 8268 10988 9658 526 -1008 -1810 O
-ATOM 6476 CB VAL M 486 -27.130 -32.209-138.958 1.00 67.99 C
-ANISOU 6476 CB VAL M 486 7478 9983 8372 521 -827 -1531 C
-ATOM 6477 CG1 VAL M 486 -27.734 -33.254-138.051 1.00 57.18 C
-ANISOU 6477 CG1 VAL M 486 5968 8633 7125 969 -813 -1574 C
-ATOM 6478 CG2 VAL M 486 -27.957 -32.037-140.225 1.00 74.83 C
-ANISOU 6478 CG2 VAL M 486 8584 10808 9041 284 -830 -1355 C
-ATOM 6479 N SER M 487 -26.747 -30.908-135.802 1.00 76.53 N
-ANISOU 6479 N SER M 487 8638 10753 9688 1101 -1277 -1628 N
-ATOM 6480 CA SER M 487 -25.992 -30.955-134.558 1.00 80.91 C
-ANISOU 6480 CA SER M 487 9081 11314 10348 1261 -1369 -1758 C
-ATOM 6481 C SER M 487 -25.552 -32.387-134.253 1.00 72.20 C
-ANISOU 6481 C SER M 487 7717 10367 9347 1408 -1270 -1868 C
-ATOM 6482 O SER M 487 -26.286 -33.340-134.537 1.00 67.35 O
-ANISOU 6482 O SER M 487 7083 9810 8697 1522 -1162 -1815 O
-ATOM 6483 CB SER M 487 -26.834 -30.408-133.403 1.00 85.17 C
-ANISOU 6483 CB SER M 487 9807 11709 10842 1552 -1544 -1751 C
-ATOM 6484 OG SER M 487 -26.114 -30.415-132.180 1.00 89.31 O
-ANISOU 6484 OG SER M 487 10288 12236 11410 1661 -1659 -1859 O
-ATOM 6485 N PRO M 488 -24.360 -32.573-133.677 1.00 60.18 N
-ANISOU 6485 N PRO M 488 6003 8883 7982 1414 -1362 -2034 N
-ATOM 6486 CA PRO M 488 -23.922 -33.931-133.323 1.00 69.19 C
-ANISOU 6486 CA PRO M 488 6933 10077 9280 1603 -1408 -2159 C
-ATOM 6487 C PRO M 488 -24.675 -34.528-132.148 1.00 76.52 C
-ANISOU 6487 C PRO M 488 8078 10894 10100 1874 -1569 -2033 C
-ATOM 6488 O PRO M 488 -24.607 -35.748-131.950 1.00 79.18 O
-ANISOU 6488 O PRO M 488 8362 11207 10516 2006 -1655 -2056 O
-ATOM 6489 CB PRO M 488 -22.435 -33.743-132.995 1.00 67.92 C
-ANISOU 6489 CB PRO M 488 6501 9954 9349 1539 -1546 -2408 C
-ATOM 6490 CG PRO M 488 -22.332 -32.326-132.554 1.00 67.47 C
-ANISOU 6490 CG PRO M 488 6636 9812 9186 1405 -1634 -2335 C
-ATOM 6491 CD PRO M 488 -23.327 -31.565-133.388 1.00 65.42 C
-ANISOU 6491 CD PRO M 488 6626 9515 8715 1235 -1479 -2137 C
-ATOM 6492 N GLU M 489 -25.383 -33.718-131.366 1.00 85.44 N
-ANISOU 6492 N GLU M 489 9464 11959 11041 1925 -1627 -1930 N
-ATOM 6493 CA GLU M 489 -26.162 -34.216-130.237 1.00 87.41 C
-ANISOU 6493 CA GLU M 489 9931 12186 11095 2070 -1711 -1847 C
-ATOM 6494 C GLU M 489 -27.453 -34.828-130.769 1.00 74.38 C
-ANISOU 6494 C GLU M 489 8333 10617 9311 2079 -1503 -1741 C
-ATOM 6495 O GLU M 489 -28.356 -34.105-131.205 1.00 85.97 O
-ANISOU 6495 O GLU M 489 9840 12120 10704 2068 -1372 -1726 O
-ATOM 6496 CB GLU M 489 -26.449 -33.088-129.249 1.00 94.23 C
-ANISOU 6496 CB GLU M 489 10984 13015 11805 2098 -1798 -1883 C
-ATOM 6497 CG GLU M 489 -25.204 -32.401-128.704 1.00106.81 C
-ANISOU 6497 CG GLU M 489 12542 14519 13521 2067 -2021 -1987 C
-ATOM 6498 CD GLU M 489 -24.426 -33.269-127.733 1.00123.55 C
-ANISOU 6498 CD GLU M 489 14692 16587 15665 2133 -2289 -2005 C
-ATOM 6499 OE1 GLU M 489 -25.054 -34.080-127.019 1.00129.59 O
-ANISOU 6499 OE1 GLU M 489 15668 17359 16212 2168 -2341 -1905 O
-ATOM 6500 OE2 GLU M 489 -23.184 -33.139-127.685 1.00131.55 O
-ANISOU 6500 OE2 GLU M 489 15529 17545 16909 2119 -2481 -2126 O
-ATOM 6501 N VAL M 490 -27.542 -36.161-130.742 1.00 60.89 N
-ANISOU 6501 N VAL M 490 6629 8907 7600 2105 -1528 -1682 N
-ATOM 6502 CA VAL M 490 -28.676 -36.889-131.300 1.00 72.04 C
-ANISOU 6502 CA VAL M 490 8071 10398 8903 2079 -1340 -1586 C
-ATOM 6503 C VAL M 490 -29.073 -38.010-130.348 1.00 72.31 C
-ANISOU 6503 C VAL M 490 8324 10403 8749 2054 -1458 -1481 C
-ATOM 6504 O VAL M 490 -28.327 -38.381-129.438 1.00 61.32 O
-ANISOU 6504 O VAL M 490 7066 8883 7352 2070 -1739 -1466 O
-ATOM 6505 CB VAL M 490 -28.371 -37.466-132.699 1.00 70.55 C
-ANISOU 6505 CB VAL M 490 7671 10223 8913 2044 -1226 -1620 C
-ATOM 6506 CG1 VAL M 490 -28.216 -36.342-133.720 1.00 78.16 C
-ANISOU 6506 CG1 VAL M 490 8525 11238 9936 1935 -1089 -1667 C
-ATOM 6507 CG2 VAL M 490 -27.123 -38.346-132.654 1.00 59.40 C
-ANISOU 6507 CG2 VAL M 490 6113 8709 7747 2108 -1426 -1744 C
-ATOM 6508 N ILE M 491 -30.269 -38.558-130.574 1.00 76.74 N
-ANISOU 6508 N ILE M 491 8947 11072 9138 1975 -1276 -1400 N
-ATOM 6509 CA ILE M 491 -30.787 -39.646-129.752 1.00 82.14 C
-ANISOU 6509 CA ILE M 491 9894 11746 9570 1833 -1360 -1269 C
-ATOM 6510 C ILE M 491 -31.208 -40.794-130.660 1.00 86.91 C
-ANISOU 6510 C ILE M 491 10458 12310 10253 1793 -1300 -1188 C
-ATOM 6511 O ILE M 491 -31.649 -40.581-131.793 1.00 85.07 O
-ANISOU 6511 O ILE M 491 10011 12170 10141 1836 -1080 -1238 O
-ATOM 6512 CB ILE M 491 -31.968 -39.180-128.863 1.00 81.61 C
-ANISOU 6512 CB ILE M 491 9958 11924 9128 1673 -1164 -1303 C
-ATOM 6513 CG1 ILE M 491 -31.519 -38.065-127.917 1.00 80.84 C
-ANISOU 6513 CG1 ILE M 491 9915 11852 8950 1718 -1245 -1427 C
-ATOM 6514 CG2 ILE M 491 -32.546 -40.330-128.047 1.00 75.61 C
-ANISOU 6514 CG2 ILE M 491 9516 11201 8014 1381 -1211 -1150 C
-ATOM 6515 CD1 ILE M 491 -30.506 -38.513-126.892 1.00 92.44 C
-ANISOU 6515 CD1 ILE M 491 11658 13135 10329 1655 -1600 -1326 C
-ATOM 6516 N VAL M 492 -31.044 -42.022-130.166 1.00 89.01 N
-ANISOU 6516 N VAL M 492 10974 12396 10449 1698 -1553 -1055 N
-ATOM 6517 CA VAL M 492 -31.533 -43.221-130.840 1.00 75.37 C
-ANISOU 6517 CA VAL M 492 9288 10592 8757 1625 -1548 -968 C
-ATOM 6518 C VAL M 492 -32.313 -44.041-129.824 1.00 80.29 C
-ANISOU 6518 C VAL M 492 10325 11204 8977 1302 -1643 -763 C
-ATOM 6519 O VAL M 492 -31.755 -44.464-128.804 1.00 80.47 O
-ANISOU 6519 O VAL M 492 10690 11014 8872 1206 -2013 -644 O
-ATOM 6520 CB VAL M 492 -30.397 -44.058-131.449 1.00 60.42 C
-ANISOU 6520 CB VAL M 492 7293 8401 7261 1825 -1855 -1054 C
-ATOM 6521 CG1 VAL M 492 -30.922 -45.412-131.897 1.00 61.41 C
-ANISOU 6521 CG1 VAL M 492 7561 8377 7394 1733 -1942 -959 C
-ATOM 6522 CG2 VAL M 492 -29.781 -43.326-132.615 1.00 58.38 C
-ANISOU 6522 CG2 VAL M 492 6611 8257 7315 2006 -1649 -1286 C
-ATOM 6523 N GLU M 493 -33.594 -44.267-130.099 1.00 77.46 N
-ANISOU 6523 N GLU M 493 9954 11078 8399 1089 -1335 -727 N
-ATOM 6524 CA GLU M 493 -34.465 -45.021-129.209 1.00 75.24 C
-ANISOU 6524 CA GLU M 493 10044 10875 7667 660 -1335 -557 C
-ATOM 6525 C GLU M 493 -35.064 -46.198-129.962 1.00 81.41 C
-ANISOU 6525 C GLU M 493 10884 11563 8484 521 -1334 -446 C
-ATOM 6526 O GLU M 493 -35.607 -46.026-131.057 1.00 80.28 O
-ANISOU 6526 O GLU M 493 10404 11572 8526 647 -1059 -562 O
-ATOM 6527 CB GLU M 493 -35.573 -44.131-128.640 1.00 80.93 C
-ANISOU 6527 CB GLU M 493 10650 12060 8041 450 -918 -706 C
-ATOM 6528 CG GLU M 493 -36.580 -44.871-127.775 1.00 92.03 C
-ANISOU 6528 CG GLU M 493 12379 13675 8914 -110 -805 -598 C
-ATOM 6529 CD GLU M 493 -35.938 -45.587-126.600 1.00103.83 C
-ANISOU 6529 CD GLU M 493 14470 14903 10078 -426 -1223 -334 C
-ATOM 6530 OE1 GLU M 493 -34.921 -45.087-126.073 1.00105.72 O
-ANISOU 6530 OE1 GLU M 493 14805 14958 10405 -224 -1496 -335 O
-ATOM 6531 OE2 GLU M 493 -36.451 -46.656-126.207 1.00108.23 O1-
-ANISOU 6531 OE2 GLU M 493 15434 15410 10277 -907 -1323 -112 O1-
-ATOM 6532 N HIS M 494 -34.970 -47.387-129.375 1.00 89.31 N
-ANISOU 6532 N HIS M 494 12357 12280 9298 239 -1690 -210 N
-ATOM 6533 CA HIS M 494 -35.487 -48.607-129.981 1.00 96.91 C
-ANISOU 6533 CA HIS M 494 13460 13078 10282 68 -1772 -84 C
-ATOM 6534 C HIS M 494 -36.794 -49.010-129.310 1.00107.03 C
-ANISOU 6534 C HIS M 494 15014 14647 11005 -542 -1539 57 C
-ATOM 6535 O HIS M 494 -36.879 -49.051-128.078 1.00115.29 O
-ANISOU 6535 O HIS M 494 16463 15745 11596 -942 -1638 196 O
-ATOM 6536 CB HIS M 494 -34.464 -49.738-129.876 1.00105.64 C
-ANISOU 6536 CB HIS M 494 14931 13586 11621 171 -2426 60 C
-ATOM 6537 CG HIS M 494 -33.161 -49.436-130.547 1.00108.36 C
-ANISOU 6537 CG HIS M 494 14927 13706 12539 736 -2633 -177 C
-ATOM 6538 ND1 HIS M 494 -33.012 -49.444-131.918 1.00111.86 N
-ANISOU 6538 ND1 HIS M 494 14927 14189 13385 1045 -2440 -409 N
-ATOM 6539 CD2 HIS M 494 -31.950 -49.110-130.038 1.00103.04 C
-ANISOU 6539 CD2 HIS M 494 14261 12810 12081 997 -2996 -255 C
-ATOM 6540 CE1 HIS M 494 -31.763 -49.140-132.223 1.00107.41 C
-ANISOU 6540 CE1 HIS M 494 14095 13475 13242 1436 -2632 -644 C
-ATOM 6541 NE2 HIS M 494 -31.098 -48.933-131.101 1.00101.02 N
-ANISOU 6541 NE2 HIS M 494 13527 12498 12358 1438 -2981 -563 N
-ATOM 6542 N THR M 495 -37.806 -49.308-130.123 1.00111.90 N
-ANISOU 6542 N THR M 495 15408 15479 11632 -658 -1224 -3 N
-ATOM 6543 CA THR M 495 -39.114 -49.709-129.627 1.00118.98 C
-ANISOU 6543 CA THR M 495 16455 16721 12033 -1270 -940 57 C
-ATOM 6544 C THR M 495 -39.643 -50.857-130.472 1.00126.89 C
-ANISOU 6544 C THR M 495 17533 17552 13129 -1425 -1009 170 C
-ATOM 6545 O THR M 495 -39.386 -50.928-131.677 1.00126.38 O
-ANISOU 6545 O THR M 495 17166 17333 13519 -1000 -1033 67 O
-ATOM 6546 CB THR M 495 -40.114 -48.544-129.649 1.00112.50 C
-ANISOU 6546 CB THR M 495 15114 16524 11109 -1272 -358 -277 C
-ATOM 6547 N LEU M 496 -40.390 -51.750-129.825 1.00139.39 N
-ANISOU 6547 N LEU M 496 19546 19179 14238 -2095 -1037 377 N
-ATOM 6548 CA LEU M 496 -40.972 -52.940-130.464 1.00154.74 C
-ANISOU 6548 CA LEU M 496 21660 20941 16192 -2367 -1139 520 C
-ATOM 6549 C LEU M 496 -39.816 -53.775-131.012 1.00175.00 C
-ANISOU 6549 C LEU M 496 24493 22789 19210 -1963 -1763 663 C
-ATOM 6550 O LEU M 496 -38.881 -54.081-130.253 1.00176.93 O
-ANISOU 6550 O LEU M 496 25197 22602 19427 -1949 -2279 848 O
-ATOM 6551 CB LEU M 496 -42.026 -52.516-131.484 1.00139.41 C
-ANISOU 6551 CB LEU M 496 19093 19460 14415 -2258 -622 236 C
-ATOM 6552 CG LEU M 496 -43.440 -52.282-130.946 1.00131.94 C
-ANISOU 6552 CG LEU M 496 17965 19164 13001 -2852 -107 82 C
-ATOM 6553 N ASN M 497 -39.824 -54.155-132.288 1.00180.09 N
-ANISOU 6553 N ASN M 497 24856 23288 20282 -1627 -1765 539 N
-ATOM 6554 CA ASN M 497 -38.804 -55.025-132.874 1.00186.31 C
-ANISOU 6554 CA ASN M 497 25824 23437 21528 -1250 -2327 557 C
-ATOM 6555 C ASN M 497 -37.952 -54.201-133.838 1.00182.02 C
-ANISOU 6555 C ASN M 497 24701 22947 21509 -548 -2193 225 C
-ATOM 6556 O ASN M 497 -38.277 -54.072-135.020 1.00183.94 O
-ANISOU 6556 O ASN M 497 24541 23367 21981 -343 -1908 27 O
-ATOM 6557 CB ASN M 497 -39.446 -56.220-133.581 1.00189.11 C
-ANISOU 6557 CB ASN M 497 26354 23576 21923 -1489 -2450 635 C
-ATOM 6558 CG ASN M 497 -40.295 -57.064-132.650 1.00193.73 C
-ANISOU 6558 CG ASN M 497 27557 24111 21942 -2295 -2585 983 C
-ATOM 6559 OD1 ASN M 497 -41.509 -57.170-132.824 1.00192.76 O
-ANISOU 6559 OD1 ASN M 497 27321 24394 21525 -2749 -2171 989 O
-ATOM 6560 ND2 ASN M 497 -39.657 -57.675-131.658 1.00197.92 N
-ANISOU 6560 ND2 ASN M 497 28758 24139 22303 -2519 -3194 1267 N
-ATOM 6561 N GLN M 498 -36.858 -53.640-133.319 1.00176.62 N
-ANISOU 6561 N GLN M 498 24006 22123 20979 -237 -2409 167 N
-ATOM 6562 CA GLN M 498 -35.878 -52.879-134.097 1.00160.74 C
-ANISOU 6562 CA GLN M 498 21499 20145 19428 343 -2327 -147 C
-ATOM 6563 C GLN M 498 -36.500 -51.706-134.848 1.00152.27 C
-ANISOU 6563 C GLN M 498 19908 19617 18330 439 -1711 -320 C
-ATOM 6564 O GLN M 498 -35.875 -51.145-135.755 1.00144.94 O
-ANISOU 6564 O GLN M 498 18593 18751 17726 806 -1588 -563 O
-ATOM 6565 CB GLN M 498 -35.124 -53.783-135.083 1.00152.81 C
-ANISOU 6565 CB GLN M 498 20405 18735 18922 685 -2660 -359 C
-ATOM 6566 CG GLN M 498 -34.231 -54.825-134.429 1.00150.52 C
-ANISOU 6566 CG GLN M 498 20555 17800 18835 768 -3417 -293 C
-ATOM 6567 CD GLN M 498 -33.404 -55.600-135.439 1.00146.07 C
-ANISOU 6567 CD GLN M 498 19770 16874 18857 1201 -3732 -657 C
-ATOM 6568 OE1 GLN M 498 -32.226 -55.877-135.210 1.00144.31 O
-ANISOU 6568 OE1 GLN M 498 19534 16262 19037 1558 -4244 -866 O
-ATOM 6569 NE2 GLN M 498 -34.016 -55.949-136.565 1.00142.59 N
-ANISOU 6569 NE2 GLN M 498 19121 16575 18480 1177 -3436 -790 N
-ATOM 6570 N ASN M 499 -37.721 -51.316-134.491 1.00151.22 N
-ANISOU 6570 N ASN M 499 19763 19877 17817 90 -1350 -228 N
-ATOM 6571 CA ASN M 499 -38.448 -50.253-135.178 1.00137.64 C
-ANISOU 6571 CA ASN M 499 17582 18609 16106 189 -876 -405 C
-ATOM 6572 C ASN M 499 -38.587 -49.072-134.222 1.00129.15 C
-ANISOU 6572 C ASN M 499 16423 17837 14813 156 -680 -448 C
-ATOM 6573 O ASN M 499 -39.639 -48.843-133.622 1.00127.33 O
-ANISOU 6573 O ASN M 499 16177 17946 14256 -167 -426 -459 O
-ATOM 6574 CB ASN M 499 -39.803 -50.751-135.666 1.00131.93 C
-ANISOU 6574 CB ASN M 499 16797 18107 15224 -119 -645 -386 C
-ATOM 6575 CG ASN M 499 -40.609 -49.663-136.335 1.00129.17 C
-ANISOU 6575 CG ASN M 499 15985 18173 14920 8 -267 -587 C
-ATOM 6576 OD1 ASN M 499 -40.291 -49.235-137.443 1.00130.49 O
-ANISOU 6576 OD1 ASN M 499 15907 18315 15358 317 -234 -708 O
-ATOM 6577 ND2 ASN M 499 -41.658 -49.203-135.662 1.00127.12 N
-ANISOU 6577 ND2 ASN M 499 15611 18299 14389 -254 -7 -654 N
-ATOM 6578 N GLY M 500 -37.502 -48.314-134.084 1.00112.82 N
-ANISOU 6578 N GLY M 500 14268 15662 12936 481 -792 -526 N
-ATOM 6579 CA GLY M 500 -37.499 -47.138-133.239 1.00 94.64 C
-ANISOU 6579 CA GLY M 500 11886 13597 10477 504 -648 -600 C
-ATOM 6580 C GLY M 500 -37.383 -45.851-134.028 1.00 73.43 C
-ANISOU 6580 C GLY M 500 8796 11075 8028 835 -449 -803 C
-ATOM 6581 O GLY M 500 -37.928 -45.740-135.130 1.00 77.51 O
-ANISOU 6581 O GLY M 500 9080 11691 8681 909 -295 -881 O
-ATOM 6582 N TYR M 501 -36.668 -44.875-133.476 1.00 61.50 N
-ANISOU 6582 N TYR M 501 7249 9563 6554 1003 -496 -871 N
-ATOM 6583 CA TYR M 501 -36.510 -43.572-134.105 1.00 59.29 C
-ANISOU 6583 CA TYR M 501 6677 9384 6466 1259 -375 -1031 C
-ATOM 6584 C TYR M 501 -35.202 -42.950-133.632 1.00 74.14 C
-ANISOU 6584 C TYR M 501 8599 11106 8465 1432 -557 -1055 C
-ATOM 6585 O TYR M 501 -34.493 -43.501-132.781 1.00 77.20 O
-ANISOU 6585 O TYR M 501 9216 11320 8798 1385 -788 -969 O
-ATOM 6586 CB TYR M 501 -37.695 -42.656-133.786 1.00 55.77 C
-ANISOU 6586 CB TYR M 501 6059 9256 5877 1216 -147 -1186 C
-ATOM 6587 CG TYR M 501 -37.834 -42.341-132.311 1.00 70.71 C
-ANISOU 6587 CG TYR M 501 8082 11300 7485 1063 -111 -1244 C
-ATOM 6588 CD1 TYR M 501 -37.199 -41.238-131.753 1.00 72.26 C
-ANISOU 6588 CD1 TYR M 501 8258 11473 7724 1238 -177 -1350 C
-ATOM 6589 CD2 TYR M 501 -38.593 -43.152-131.476 1.00 71.76 C
-ANISOU 6589 CD2 TYR M 501 8388 11613 7263 683 -6 -1201 C
-ATOM 6590 CE1 TYR M 501 -37.317 -40.950-130.408 1.00 82.24 C
-ANISOU 6590 CE1 TYR M 501 9657 12897 8695 1075 -136 -1434 C
-ATOM 6591 CE2 TYR M 501 -38.718 -42.872-130.130 1.00 85.51 C
-ANISOU 6591 CE2 TYR M 501 10283 13543 8664 457 56 -1274 C
-ATOM 6592 CZ TYR M 501 -38.078 -41.770-129.601 1.00 91.63 C
-ANISOU 6592 CZ TYR M 501 11020 14299 9496 673 -7 -1402 C
-ATOM 6593 OH TYR M 501 -38.197 -41.485-128.259 1.00 99.17 O
-ANISOU 6593 OH TYR M 501 12139 15461 10080 428 62 -1506 O
-ATOM 6594 N THR M 502 -34.897 -41.779-134.185 1.00 68.79 N
-ANISOU 6594 N THR M 502 7724 10466 7948 1609 -497 -1169 N
-ATOM 6595 CA THR M 502 -33.732 -41.000-133.796 1.00 58.46 C
-ANISOU 6595 CA THR M 502 6411 9049 6751 1738 -635 -1222 C
-ATOM 6596 C THR M 502 -34.120 -39.528-133.791 1.00 66.94 C
-ANISOU 6596 C THR M 502 7378 10235 7820 1821 -549 -1332 C
-ATOM 6597 O THR M 502 -34.783 -39.053-134.717 1.00 74.74 O
-ANISOU 6597 O THR M 502 8244 11280 8875 1852 -461 -1371 O
-ATOM 6598 CB THR M 502 -32.548 -41.254-134.742 1.00 67.73 C
-ANISOU 6598 CB THR M 502 7462 10074 8197 1825 -722 -1272 C
-ATOM 6599 OG1 THR M 502 -31.463 -40.378-134.413 1.00 76.79 O
-ANISOU 6599 OG1 THR M 502 8554 11166 9456 1908 -826 -1357 O
-ATOM 6600 CG2 THR M 502 -32.950 -41.042-136.198 1.00 66.74 C
-ANISOU 6600 CG2 THR M 502 7182 10031 8145 1794 -549 -1307 C
-ATOM 6601 N LEU M 503 -33.743 -38.821-132.730 1.00 70.33 N
-ANISOU 6601 N LEU M 503 7883 10663 8176 1859 -631 -1391 N
-ATOM 6602 CA LEU M 503 -33.977 -37.388-132.634 1.00 71.90 C
-ANISOU 6602 CA LEU M 503 8006 10897 8414 1971 -627 -1533 C
-ATOM 6603 C LEU M 503 -32.751 -36.654-133.151 1.00 69.50 C
-ANISOU 6603 C LEU M 503 7680 10417 8309 2029 -761 -1522 C
-ATOM 6604 O LEU M 503 -31.630 -36.904-132.686 1.00 79.85 O
-ANISOU 6604 O LEU M 503 9035 11640 9665 2021 -881 -1501 O
-ATOM 6605 CB LEU M 503 -34.277 -36.972-131.194 1.00 79.31 C
-ANISOU 6605 CB LEU M 503 9034 11958 9142 1950 -620 -1661 C
-ATOM 6606 CG LEU M 503 -35.484 -37.636-130.534 1.00 76.65 C
-ANISOU 6606 CG LEU M 503 8712 11884 8526 1775 -430 -1729 C
-ATOM 6607 CD1 LEU M 503 -35.644 -37.136-129.110 1.00 72.09 C
-ANISOU 6607 CD1 LEU M 503 8228 11476 7686 1689 -393 -1908 C
-ATOM 6608 CD2 LEU M 503 -36.746 -37.385-131.343 1.00 80.66 C
-ANISOU 6608 CD2 LEU M 503 8974 12542 9132 1840 -278 -1879 C
-ATOM 6609 N VAL M 504 -32.973 -35.756-134.113 1.00 70.28 N
-ANISOU 6609 N VAL M 504 7724 10462 8518 2053 -775 -1543 N
-ATOM 6610 CA VAL M 504 -31.910 -35.041-134.812 1.00 77.01 C
-ANISOU 6610 CA VAL M 504 8584 11182 9496 1979 -867 -1517 C
-ATOM 6611 C VAL M 504 -32.173 -33.545-134.699 1.00 81.10 C
-ANISOU 6611 C VAL M 504 9190 11575 10051 2041 -1029 -1582 C
-ATOM 6612 O VAL M 504 -33.315 -33.097-134.846 1.00 77.10 O
-ANISOU 6612 O VAL M 504 8684 11055 9554 2152 -1080 -1647 O
-ATOM 6613 CB VAL M 504 -31.825 -35.473-136.293 1.00 70.05 C
-ANISOU 6613 CB VAL M 504 7652 10310 8653 1824 -778 -1439 C
-ATOM 6614 CG1 VAL M 504 -30.748 -34.698-137.014 1.00 73.08 C
-ANISOU 6614 CG1 VAL M 504 8057 10624 9085 1624 -824 -1437 C
-ATOM 6615 CG2 VAL M 504 -31.566 -36.968-136.402 1.00 59.52 C
-ANISOU 6615 CG2 VAL M 504 6222 9057 7334 1806 -663 -1434 C
-ATOM 6616 N ILE M 505 -31.116 -32.770-134.451 1.00 84.11 N
-ANISOU 6616 N ILE M 505 9631 11842 10485 1978 -1151 -1597 N
-ATOM 6617 CA ILE M 505 -31.229 -31.349-134.128 1.00 78.51 C
-ANISOU 6617 CA ILE M 505 9051 10956 9825 2044 -1368 -1674 C
-ATOM 6618 C ILE M 505 -30.599 -30.517-135.237 1.00 76.20 C
-ANISOU 6618 C ILE M 505 8896 10482 9575 1794 -1505 -1556 C
-ATOM 6619 O ILE M 505 -29.465 -30.779-135.655 1.00 84.17 O
-ANISOU 6619 O ILE M 505 9852 11553 10573 1549 -1409 -1507 O
-ATOM 6620 CB ILE M 505 -30.571 -31.029-132.776 1.00 72.58 C
-ANISOU 6620 CB ILE M 505 8318 10204 9054 2123 -1436 -1790 C
-ATOM 6621 CG1 ILE M 505 -31.395 -31.617-131.630 1.00 71.99 C
-ANISOU 6621 CG1 ILE M 505 8200 10311 8842 2281 -1327 -1916 C
-ATOM 6622 CG2 ILE M 505 -30.399 -29.528-132.608 1.00 66.85 C
-ANISOU 6622 CG2 ILE M 505 7743 9246 8412 2144 -1692 -1870 C
-ATOM 6623 CD1 ILE M 505 -30.765 -31.412-130.273 1.00 74.26 C
-ANISOU 6623 CD1 ILE M 505 8561 10617 9037 2306 -1404 -2016 C
-ATOM 6624 N THR M 506 -31.334 -29.503-135.694 1.00 68.49 N
-ANISOU 6624 N THR M 506 8100 9279 8646 1830 -1757 -1542 N
-ATOM 6625 CA THR M 506 -30.852 -28.526-136.667 1.00 73.78 C
-ANISOU 6625 CA THR M 506 9035 9701 9297 1523 -1988 -1389 C
-ATOM 6626 C THR M 506 -31.338 -27.150-136.231 1.00 80.08 C
-ANISOU 6626 C THR M 506 10050 10152 10225 1705 -2404 -1480 C
-ATOM 6627 O THR M 506 -32.543 -26.873-136.271 1.00 76.87 O
-ANISOU 6627 O THR M 506 9654 9616 9936 1985 -2610 -1588 O
-ATOM 6628 CB THR M 506 -31.346 -28.850-138.078 1.00 74.08 C
-ANISOU 6628 CB THR M 506 9178 9728 9240 1313 -1986 -1216 C
-ATOM 6629 OG1 THR M 506 -32.750 -29.139-138.043 1.00 61.03 O
-ANISOU 6629 OG1 THR M 506 7443 8072 7675 1641 -2055 -1296 O
-ATOM 6630 CG2 THR M 506 -30.602 -30.042-138.646 1.00 90.46 C
-ANISOU 6630 CG2 THR M 506 11060 12113 11195 1063 -1602 -1175 C
-ATOM 6631 N GLY M 507 -30.411 -26.294-135.813 1.00 80.93 N
-ANISOU 6631 N GLY M 507 10302 10103 10346 1560 -2554 -1484 N
-ATOM 6632 CA GLY M 507 -30.784 -24.945-135.414 1.00 85.50 C
-ANISOU 6632 CA GLY M 507 11120 10292 11075 1728 -3005 -1592 C
-ATOM 6633 C GLY M 507 -31.754 -24.950-134.247 1.00 78.51 C
-ANISOU 6633 C GLY M 507 10015 9479 10335 2239 -3010 -1940 C
-ATOM 6634 O GLY M 507 -31.547 -25.631-133.236 1.00 66.42 O
-ANISOU 6634 O GLY M 507 8245 8261 8732 2357 -2699 -2082 O
-ATOM 6635 N LYS M 508 -32.832 -24.178-134.384 1.00 71.33 N
-ANISOU 6635 N LYS M 508 9192 8281 9628 2521 -3395 -2113 N
-ATOM 6636 CA LYS M 508 -33.867 -24.112-133.361 1.00 72.03 C
-ANISOU 6636 CA LYS M 508 9005 8491 9871 2985 -3382 -2559 C
-ATOM 6637 C LYS M 508 -34.867 -25.256-133.449 1.00 81.42 C
-ANISOU 6637 C LYS M 508 9861 10061 11014 3124 -3043 -2658 C
-ATOM 6638 O LYS M 508 -35.816 -25.285-132.658 1.00 89.29 O
-ANISOU 6638 O LYS M 508 10575 11247 12103 3439 -2967 -3073 O
-ATOM 6639 CB LYS M 508 -34.628 -22.783-133.449 1.00 76.68 C
-ANISOU 6639 CB LYS M 508 9750 8602 10784 3289 -3989 -2823 C
-ATOM 6640 CG LYS M 508 -33.758 -21.552-133.649 1.00 91.57 C
-ANISOU 6640 CG LYS M 508 12083 9979 12728 3087 -4460 -2655 C
-ATOM 6641 CD LYS M 508 -34.608 -20.287-133.718 1.00 84.66 C
-ANISOU 6641 CD LYS M 508 11383 8552 12231 3450 -5164 -2953 C
-ATOM 6642 N LYS M 509 -34.685 -26.192-134.378 1.00 77.77 N
-ANISOU 6642 N LYS M 509 9408 9739 10401 2867 -2826 -2330 N
-ATOM 6643 CA LYS M 509 -35.668 -27.233-134.640 1.00 86.91 C
-ANISOU 6643 CA LYS M 509 10301 11193 11529 2960 -2572 -2388 C
-ATOM 6644 C LYS M 509 -35.078 -28.603-134.342 1.00 84.44 C
-ANISOU 6644 C LYS M 509 9855 11265 10965 2753 -2080 -2225 C
-ATOM 6645 O LYS M 509 -33.903 -28.854-134.614 1.00 98.20 O
-ANISOU 6645 O LYS M 509 11726 12993 12595 2486 -1988 -1974 O
-ATOM 6646 CB LYS M 509 -36.145 -27.172-136.098 1.00103.78 C
-ANISOU 6646 CB LYS M 509 12597 13106 13731 2862 -2834 -2171 C
-ATOM 6647 CG LYS M 509 -37.233 -28.173-136.450 1.00107.11 C
-ANISOU 6647 CG LYS M 509 12743 13800 14154 2962 -2629 -2247 C
-ATOM 6648 CD LYS M 509 -37.659 -28.037-137.904 1.00116.61 C
-ANISOU 6648 CD LYS M 509 14156 14747 15405 2848 -2955 -2022 C
-ATOM 6649 CE LYS M 509 -36.516 -28.350-138.855 1.00122.28 C
-ANISOU 6649 CE LYS M 509 15176 15427 15857 2369 -2841 -1591 C
-ATOM 6650 NZ LYS M 509 -36.040 -29.752-138.702 1.00128.81 N1+
-ANISOU 6650 NZ LYS M 509 15782 16675 16485 2211 -2281 -1513 N1+
-ATOM 6651 N ILE M 510 -35.897 -29.486-133.774 1.00 76.82 N
-ANISOU 6651 N ILE M 510 8629 10635 9926 2860 -1793 -2401 N
-ATOM 6652 CA ILE M 510 -35.538 -30.884-133.577 1.00 75.35 C
-ANISOU 6652 CA ILE M 510 8369 10740 9521 2671 -1422 -2233 C
-ATOM 6653 C ILE M 510 -36.610 -31.745-134.229 1.00 76.93 C
-ANISOU 6653 C ILE M 510 8407 11110 9714 2670 -1284 -2230 C
-ATOM 6654 O ILE M 510 -37.803 -31.434-134.146 1.00 71.81 O
-ANISOU 6654 O ILE M 510 7572 10531 9180 2861 -1345 -2509 O
-ATOM 6655 CB ILE M 510 -35.371 -31.241-132.083 1.00 79.05 C
-ANISOU 6655 CB ILE M 510 8779 11449 9807 2674 -1221 -2395 C
-ATOM 6656 CG1 ILE M 510 -34.929 -32.699-131.931 1.00 83.69 C
-ANISOU 6656 CG1 ILE M 510 9384 12222 10191 2466 -974 -2174 C
-ATOM 6657 CG2 ILE M 510 -36.657 -30.978-131.311 1.00 71.99 C
-ANISOU 6657 CG2 ILE M 510 7670 10778 8906 2845 -1141 -2808 C
-ATOM 6658 CD1 ILE M 510 -34.750 -33.138-130.500 1.00 88.75 C
-ANISOU 6658 CD1 ILE M 510 10078 13055 10588 2386 -852 -2260 C
-ATOM 6659 N THR M 511 -36.182 -32.818-134.889 1.00 85.55 N
-ANISOU 6659 N THR M 511 9536 12269 10700 2467 -1114 -1966 N
-ATOM 6660 CA THR M 511 -37.074 -33.665-135.664 1.00 71.69 C
-ANISOU 6660 CA THR M 511 7668 10637 8935 2425 -1007 -1920 C
-ATOM 6661 C THR M 511 -36.913 -35.118-135.247 1.00 77.96 C
-ANISOU 6661 C THR M 511 8421 11656 9544 2267 -714 -1822 C
-ATOM 6662 O THR M 511 -35.795 -35.584-134.988 1.00 89.38 O
-ANISOU 6662 O THR M 511 9975 13061 10924 2160 -669 -1681 O
-ATOM 6663 CB THR M 511 -36.798 -33.527-137.159 1.00 68.55 C
-ANISOU 6663 CB THR M 511 7416 10038 8592 2297 -1160 -1696 C
-ATOM 6664 OG1 THR M 511 -36.531 -32.154-137.466 1.00 78.45 O
-ANISOU 6664 OG1 THR M 511 8853 10995 9961 2339 -1501 -1693 O
-ATOM 6665 CG2 THR M 511 -37.996 -33.991-137.963 1.00 76.54 C
-ANISOU 6665 CG2 THR M 511 8316 11120 9646 2325 -1176 -1720 C
-ATOM 6666 N LYS M 512 -38.040 -35.823-135.176 1.00 75.64 N
-ANISOU 6666 N LYS M 512 7973 11578 9190 2246 -563 -1920 N
-ATOM 6667 CA LYS M 512 -38.052 -37.256-134.916 1.00 76.64 C
-ANISOU 6667 CA LYS M 512 8124 11862 9135 2047 -350 -1795 C
-ATOM 6668 C LYS M 512 -38.090 -37.993-136.248 1.00 84.26 C
-ANISOU 6668 C LYS M 512 9100 12753 10161 1964 -348 -1618 C
-ATOM 6669 O LYS M 512 -39.043 -37.845-137.021 1.00 94.64 O
-ANISOU 6669 O LYS M 512 10297 14102 11560 2006 -387 -1681 O
-ATOM 6670 CB LYS M 512 -39.246 -37.657-134.051 1.00 74.46 C
-ANISOU 6670 CB LYS M 512 7693 11901 8695 1959 -154 -2008 C
-ATOM 6671 CG LYS M 512 -39.259 -39.140-133.725 1.00 75.52 C
-ANISOU 6671 CG LYS M 512 7954 12143 8596 1673 6 -1831 C
-ATOM 6672 CD LYS M 512 -40.662 -39.664-133.489 1.00 74.71 C
-ANISOU 6672 CD LYS M 512 7664 12372 8352 1490 221 -2011 C
-ATOM 6673 CE LYS M 512 -41.122 -39.437-132.069 1.00 69.50 C
-ANISOU 6673 CE LYS M 512 6959 12025 7424 1323 404 -2266 C
-ATOM 6674 NZ LYS M 512 -42.382 -40.187-131.806 1.00 81.23 N1+
-ANISOU 6674 NZ LYS M 512 8274 13892 8696 1001 673 -2432 N1+
-ATOM 6675 N ILE M 513 -37.061 -38.788-136.507 1.00 76.49 N
-ANISOU 6675 N ILE M 513 8240 11669 9155 1859 -329 -1442 N
-ATOM 6676 CA ILE M 513 -36.865 -39.445-137.791 1.00 64.05 C
-ANISOU 6676 CA ILE M 513 6674 10028 7634 1771 -313 -1332 C
-ATOM 6677 C ILE M 513 -36.937 -40.951-137.574 1.00 68.96 C
-ANISOU 6677 C ILE M 513 7334 10690 8177 1653 -221 -1264 C
-ATOM 6678 O ILE M 513 -36.182 -41.495-136.764 1.00 77.39 O
-ANISOU 6678 O ILE M 513 8506 11687 9213 1633 -266 -1225 O
-ATOM 6679 CB ILE M 513 -35.522 -39.049-138.426 1.00 55.22 C
-ANISOU 6679 CB ILE M 513 5614 8769 6598 1736 -378 -1289 C
-ATOM 6680 CG1 ILE M 513 -35.490 -37.541-138.698 1.00 56.71 C
-ANISOU 6680 CG1 ILE M 513 5855 8862 6831 1776 -527 -1307 C
-ATOM 6681 CG2 ILE M 513 -35.267 -39.851-139.681 1.00 50.18 C
-ANISOU 6681 CG2 ILE M 513 4961 8130 5974 1599 -304 -1254 C
-ATOM 6682 CD1 ILE M 513 -34.134 -37.033-139.134 1.00 54.76 C
-ANISOU 6682 CD1 ILE M 513 5674 8523 6611 1646 -562 -1280 C
-ATOM 6683 N PRO M 514 -37.822 -41.667-138.263 1.00 67.81 N
-ANISOU 6683 N PRO M 514 7140 10616 8007 1564 -151 -1243 N
-ATOM 6684 CA PRO M 514 -37.902 -43.118-138.071 1.00 68.64 C
-ANISOU 6684 CA PRO M 514 7336 10702 8041 1422 -115 -1166 C
-ATOM 6685 C PRO M 514 -36.693 -43.828-138.659 1.00 72.67 C
-ANISOU 6685 C PRO M 514 7906 11020 8683 1444 -197 -1146 C
-ATOM 6686 O PRO M 514 -36.135 -43.420-139.680 1.00 73.79 O
-ANISOU 6686 O PRO M 514 7970 11140 8927 1477 -180 -1206 O
-ATOM 6687 CB PRO M 514 -39.189 -43.503-138.807 1.00 60.63 C
-ANISOU 6687 CB PRO M 514 6218 9822 6995 1325 -29 -1184 C
-ATOM 6688 CG PRO M 514 -39.353 -42.444-139.840 1.00 60.84 C
-ANISOU 6688 CG PRO M 514 6143 9843 7132 1439 -87 -1236 C
-ATOM 6689 CD PRO M 514 -38.824 -41.177-139.224 1.00 67.60 C
-ANISOU 6689 CD PRO M 514 7001 10656 8028 1585 -164 -1290 C
-ATOM 6690 N LEU M 515 -36.290 -44.909-137.993 1.00 71.74 N
-ANISOU 6690 N LEU M 515 7937 10764 8558 1398 -310 -1094 N
-ATOM 6691 CA LEU M 515 -35.111 -45.653-138.414 1.00 69.66 C
-ANISOU 6691 CA LEU M 515 7675 10292 8499 1484 -453 -1175 C
-ATOM 6692 C LEU M 515 -35.352 -46.516-139.646 1.00 74.49 C
-ANISOU 6692 C LEU M 515 8228 10882 9193 1433 -400 -1245 C
-ATOM 6693 O LEU M 515 -34.384 -47.027-140.217 1.00 84.67 O
-ANISOU 6693 O LEU M 515 9429 12054 10686 1520 -473 -1425 O
-ATOM 6694 CB LEU M 515 -34.607 -46.538-137.270 1.00 70.98 C
-ANISOU 6694 CB LEU M 515 8070 10225 8673 1483 -727 -1102 C
-ATOM 6695 CG LEU M 515 -34.138 -45.871-135.973 1.00 62.64 C
-ANISOU 6695 CG LEU M 515 7126 9150 7527 1516 -845 -1047 C
-ATOM 6696 CD1 LEU M 515 -33.599 -46.923-135.010 1.00 68.13 C
-ANISOU 6696 CD1 LEU M 515 8124 9538 8226 1483 -1224 -949 C
-ATOM 6697 CD2 LEU M 515 -33.096 -44.792-136.232 1.00 54.16 C
-ANISOU 6697 CD2 LEU M 515 5834 8112 6631 1698 -819 -1204 C
-ATOM 6698 N ASN M 516 -36.602 -46.695-140.067 1.00 80.80 N
-ANISOU 6698 N ASN M 516 9038 11807 9855 1295 -280 -1163 N
-ATOM 6699 CA ASN M 516 -36.914 -47.555-141.199 1.00 82.54 C
-ANISOU 6699 CA ASN M 516 9233 12003 10125 1222 -246 -1224 C
-ATOM 6700 C ASN M 516 -38.070 -46.967-141.993 1.00 94.90 C
-ANISOU 6700 C ASN M 516 10707 13781 11570 1126 -95 -1186 C
-ATOM 6701 O ASN M 516 -38.939 -46.285-141.444 1.00 94.99 O
-ANISOU 6701 O ASN M 516 10681 13935 11477 1105 -50 -1120 O
-ATOM 6702 CB ASN M 516 -37.276 -48.977-140.750 1.00 74.15 C
-ANISOU 6702 CB ASN M 516 8371 10753 9050 1112 -402 -1143 C
-ATOM 6703 CG ASN M 516 -36.089 -49.734-140.193 1.00 86.56 C
-ANISOU 6703 CG ASN M 516 10065 12008 10815 1245 -690 -1212 C
-ATOM 6704 OD1 ASN M 516 -35.016 -49.760-140.797 1.00 96.29 O
-ANISOU 6704 OD1 ASN M 516 11131 13167 12287 1425 -733 -1455 O
-ATOM 6705 ND2 ASN M 516 -36.280 -50.368-139.042 1.00 86.90 N
-ANISOU 6705 ND2 ASN M 516 10402 11865 10751 1127 -915 -1028 N
-ATOM 6706 N GLY M 517 -38.072 -47.243-143.296 1.00102.44 N
-ANISOU 6706 N GLY M 517 11614 14756 12551 1070 -45 -1274 N
-ATOM 6707 CA GLY M 517 -39.170 -46.879-144.163 1.00108.76 C
-ANISOU 6707 CA GLY M 517 12372 15700 13251 968 5 -1234 C
-ATOM 6708 C GLY M 517 -38.987 -45.593-144.939 1.00104.75 C
-ANISOU 6708 C GLY M 517 11841 15266 12692 965 4 -1240 C
-ATOM 6709 O GLY M 517 -39.811 -45.300-145.815 1.00116.67 O
-ANISOU 6709 O GLY M 517 13364 16839 14127 878 -45 -1205 O
-ATOM 6710 N LEU M 518 -37.943 -44.813-144.650 1.00 80.31 N
-ANISOU 6710 N LEU M 518 8746 12142 9627 1027 10 -1272 N
-ATOM 6711 CA LEU M 518 -37.727 -43.570-145.380 1.00 77.68 C
-ANISOU 6711 CA LEU M 518 8473 11839 9204 940 -33 -1241 C
-ATOM 6712 C LEU M 518 -37.104 -43.788-146.750 1.00 91.59 C
-ANISOU 6712 C LEU M 518 10289 13664 10848 697 62 -1340 C
-ATOM 6713 O LEU M 518 -37.199 -42.900-147.605 1.00 94.21 O
-ANISOU 6713 O LEU M 518 10768 14016 11012 503 -11 -1262 O
-ATOM 6714 CB LEU M 518 -36.846 -42.616-144.577 1.00 81.37 C
-ANISOU 6714 CB LEU M 518 8934 12261 9720 1030 -59 -1242 C
-ATOM 6715 CG LEU M 518 -37.512 -41.914-143.397 1.00 86.03 C
-ANISOU 6715 CG LEU M 518 9503 12823 10362 1220 -166 -1175 C
-ATOM 6716 CD1 LEU M 518 -36.585 -40.842-142.858 1.00 86.18 C
-ANISOU 6716 CD1 LEU M 518 9556 12780 10410 1269 -219 -1182 C
-ATOM 6717 CD2 LEU M 518 -38.858 -41.327-143.797 1.00 81.67 C
-ANISOU 6717 CD2 LEU M 518 8954 12285 9792 1247 -314 -1130 C
-ATOM 6718 N GLY M 519 -36.461 -44.933-146.977 1.00 96.69 N
-ANISOU 6718 N GLY M 519 10840 14332 11566 678 194 -1535 N
-ATOM 6719 CA GLY M 519 -35.941 -45.231-148.298 1.00 89.23 C
-ANISOU 6719 CA GLY M 519 9900 13515 10489 419 337 -1723 C
-ATOM 6720 C GLY M 519 -37.019 -45.395-149.345 1.00 80.85 C
-ANISOU 6720 C GLY M 519 8987 12494 9239 239 283 -1622 C
-ATOM 6721 O GLY M 519 -36.753 -45.196-150.534 1.00 95.28 O
-ANISOU 6721 O GLY M 519 10921 14451 10832 -76 365 -1699 O
-ATOM 6722 N CYS M 520 -38.238 -45.744-148.929 1.00 75.72 N
-ANISOU 6722 N CYS M 520 8347 11761 8661 385 145 -1467 N
-ATOM 6723 CA CYS M 520 -39.339 -45.910-149.870 1.00 81.98 C
-ANISOU 6723 CA CYS M 520 9247 12584 9318 241 43 -1386 C
-ATOM 6724 C CYS M 520 -39.967 -44.582-150.275 1.00 87.23 C
-ANISOU 6724 C CYS M 520 10076 13218 9851 163 -194 -1189 C
-ATOM 6725 O CYS M 520 -40.452 -44.453-151.404 1.00 98.43 O
-ANISOU 6725 O CYS M 520 11670 14651 11076 -60 -321 -1134 O
-ATOM 6726 CB CYS M 520 -40.418 -46.819-149.270 1.00 91.94 C
-ANISOU 6726 CB CYS M 520 10412 13799 10721 384 -13 -1343 C
-ATOM 6727 SG CYS M 520 -39.830 -48.331-148.451 1.00106.14 S
-ANISOU 6727 SG CYS M 520 12126 15490 12712 501 93 -1487 S
-ATOM 6728 N ARG M 521 -39.959 -43.590-149.385 1.00 90.79 N
-ANISOU 6728 N ARG M 521 10500 13589 10405 343 -309 -1095 N
-ATOM 6729 CA ARG M 521 -40.810 -42.414-149.535 1.00 99.33 C
-ANISOU 6729 CA ARG M 521 11699 14559 11484 390 -648 -950 C
-ATOM 6730 C ARG M 521 -40.285 -41.407-150.553 1.00107.61 C
-ANISOU 6730 C ARG M 521 13084 15525 12279 82 -821 -827 C
-ATOM 6731 O ARG M 521 -40.727 -40.253-150.562 1.00128.06 O
-ANISOU 6731 O ARG M 521 15836 17927 14892 134 -1188 -696 O
-ATOM 6732 CB ARG M 521 -41.004 -41.731-148.175 1.00101.49 C
-ANISOU 6732 CB ARG M 521 11812 14775 11976 702 -717 -961 C
-ATOM 6733 CG ARG M 521 -41.887 -42.507-147.209 1.00104.96 C
-ANISOU 6733 CG ARG M 521 11976 15319 12587 907 -617 -1059 C
-ATOM 6734 CD ARG M 521 -41.977 -41.808-145.859 1.00119.34 C
-ANISOU 6734 CD ARG M 521 13648 17141 14553 1147 -632 -1123 C
-ATOM 6735 NE ARG M 521 -42.445 -40.427-145.963 1.00132.12 N
-ANISOU 6735 NE ARG M 521 15305 18627 16267 1287 -968 -1133 N
-ATOM 6736 CZ ARG M 521 -42.654 -39.628-144.918 1.00136.95 C
-ANISOU 6736 CZ ARG M 521 15777 19228 17029 1521 -1042 -1255 C
-ATOM 6737 NH1 ARG M 521 -42.445 -40.073-143.685 1.00130.44 N
-ANISOU 6737 NH1 ARG M 521 14792 18555 16213 1585 -770 -1346 N
-ATOM 6738 NH2 ARG M 521 -43.075 -38.384-145.105 1.00139.98 N
-ANISOU 6738 NH2 ARG M 521 16213 19424 17548 1679 -1429 -1299 N
-ATOM 6739 N HIS M 522 -39.361 -41.817-151.419 1.00 98.38 N
-ANISOU 6739 N HIS M 522 12033 14488 10857 -271 -588 -896 N
-ATOM 6740 CA HIS M 522 -38.924 -40.957-152.508 1.00107.62 C
-ANISOU 6740 CA HIS M 522 13584 15633 11672 -721 -723 -772 C
-ATOM 6741 C HIS M 522 -39.160 -41.578-153.878 1.00111.59 C
-ANISOU 6741 C HIS M 522 14281 16258 11859 -1101 -690 -799 C
-ATOM 6742 O HIS M 522 -38.898 -40.923-154.893 1.00117.64 O
-ANISOU 6742 O HIS M 522 15442 17021 12236 -1580 -823 -673 O
-ATOM 6743 CB HIS M 522 -37.441 -40.580-152.349 1.00120.50 C
-ANISOU 6743 CB HIS M 522 15209 17389 13187 -953 -442 -877 C
-ATOM 6744 CG HIS M 522 -36.485 -41.653-152.768 1.00127.54 C
-ANISOU 6744 CG HIS M 522 15891 18576 13992 -1148 14 -1202 C
-ATOM 6745 ND1 HIS M 522 -36.016 -42.620-151.904 1.00132.88 N
-ANISOU 6745 ND1 HIS M 522 16177 19322 14989 -806 263 -1453 N
-ATOM 6746 CD2 HIS M 522 -35.894 -41.897-153.961 1.00129.15 C
-ANISOU 6746 CD2 HIS M 522 16219 19020 13830 -1660 237 -1363 C
-ATOM 6747 CE1 HIS M 522 -35.186 -43.418-152.551 1.00134.93 C
-ANISOU 6747 CE1 HIS M 522 16289 19819 15157 -1027 582 -1792 C
-ATOM 6748 NE2 HIS M 522 -35.095 -43.001-153.801 1.00132.39 N
-ANISOU 6748 NE2 HIS M 522 16246 19648 14409 -1557 621 -1772 N
-ATOM 6749 N PHE M 523 -39.647 -42.815-153.936 1.00109.76 N
-ANISOU 6749 N PHE M 523 13828 16128 11749 -950 -535 -952 N
-ATOM 6750 CA PHE M 523 -40.062 -43.418-155.195 1.00101.88 C
-ANISOU 6750 CA PHE M 523 13012 15222 10475 -1268 -555 -984 C
-ATOM 6751 C PHE M 523 -41.479 -42.979-155.540 1.00 99.99 C
-ANISOU 6751 C PHE M 523 12957 14775 10261 -1185 -1064 -748 C
-ATOM 6752 O PHE M 523 -42.345 -42.885-154.665 1.00109.48 O
-ANISOU 6752 O PHE M 523 13928 15851 11819 -762 -1254 -710 O
-ATOM 6753 CB PHE M 523 -39.990 -44.943-155.111 1.00 90.55 C
-ANISOU 6753 CB PHE M 523 11275 13936 9195 -1133 -229 -1270 C
-ATOM 6754 CG PHE M 523 -38.600 -45.474-154.918 1.00 87.03 C
-ANISOU 6754 CG PHE M 523 10617 13672 8780 -1185 192 -1595 C
-ATOM 6755 CD1 PHE M 523 -38.321 -46.369-153.898 1.00 78.73 C
-ANISOU 6755 CD1 PHE M 523 9234 12576 8103 -801 341 -1774 C
-ATOM 6756 CD2 PHE M 523 -37.576 -45.096-155.769 1.00 91.55 C
-ANISOU 6756 CD2 PHE M 523 11323 14463 9001 -1652 410 -1754 C
-ATOM 6757 CE1 PHE M 523 -37.040 -46.860-153.719 1.00 71.26 C
-ANISOU 6757 CE1 PHE M 523 8061 11752 7262 -789 632 -2126 C
-ATOM 6758 CE2 PHE M 523 -36.296 -45.587-155.598 1.00 88.07 C
-ANISOU 6758 CE2 PHE M 523 10587 14227 8649 -1674 791 -2158 C
-ATOM 6759 CZ PHE M 523 -36.029 -46.471-154.570 1.00 79.46 C
-ANISOU 6759 CZ PHE M 523 9134 13043 8016 -1196 869 -2356 C
-ATOM 6760 N GLN M 524 -41.715 -42.708-156.823 1.00 93.69 N
-ANISOU 6760 N GLN M 524 12566 13957 9075 -1616 -1298 -625 N
-ATOM 6761 CA GLN M 524 -43.006 -42.199-157.270 1.00 93.25 C
-ANISOU 6761 CA GLN M 524 12727 13655 9048 -1554 -1898 -410 C
-ATOM 6762 C GLN M 524 -43.682 -43.108-158.288 1.00 92.36 C
-ANISOU 6762 C GLN M 524 12702 13638 8754 -1756 -1949 -464 C
-ATOM 6763 O GLN M 524 -44.700 -42.714-158.869 1.00 96.18 O
-ANISOU 6763 O GLN M 524 13412 13922 9211 -1778 -2497 -298 O
-ATOM 6764 CB GLN M 524 -42.847 -40.788-157.844 1.00 92.57 C
-ANISOU 6764 CB GLN M 524 13186 13317 8670 -1881 -2381 -118 C
-ATOM 6765 CG GLN M 524 -42.283 -39.778-156.847 1.00 85.18 C
-ANISOU 6765 CG GLN M 524 12200 12230 7937 -1672 -2422 -53 C
-ATOM 6766 N SER M 525 -43.154 -44.310-158.514 1.00 95.88 N
-ANISOU 6766 N SER M 525 12970 14354 9108 -1881 -1446 -721 N
-ATOM 6767 CA SER M 525 -43.734 -45.261-159.451 1.00 89.99 C
-ANISOU 6767 CA SER M 525 12292 13705 8195 -2074 -1457 -819 C
-ATOM 6768 C SER M 525 -43.541 -46.675-158.926 1.00 89.81 C
-ANISOU 6768 C SER M 525 11845 13842 8439 -1837 -1005 -1129 C
-ATOM 6769 O SER M 525 -42.499 -46.993-158.345 1.00104.79 O
-ANISOU 6769 O SER M 525 13531 15849 10435 -1754 -601 -1328 O
-ATOM 6770 CB SER M 525 -43.107 -45.135-160.842 1.00 99.26 C
-ANISOU 6770 CB SER M 525 13936 15036 8741 -2748 -1390 -830 C
-ATOM 6771 OG SER M 525 -43.566 -46.168-161.694 1.00111.20 O
-ANISOU 6771 OG SER M 525 15483 16676 10094 -2926 -1334 -991 O
-ATOM 6772 N CYS M 526 -44.550 -47.522-159.141 1.00 80.39 N
-ANISOU 6772 N CYS M 526 10545 12627 7372 -1738 -1131 -1174 N
-ATOM 6773 CA CYS M 526 -44.489 -48.895-158.644 1.00 78.24 C
-ANISOU 6773 CA CYS M 526 9946 12424 7357 -1542 -806 -1426 C
-ATOM 6774 C CYS M 526 -43.365 -49.684-159.299 1.00 89.36 C
-ANISOU 6774 C CYS M 526 11395 14015 8542 -1805 -404 -1759 C
-ATOM 6775 O CYS M 526 -42.722 -50.516-158.648 1.00 82.98 O
-ANISOU 6775 O CYS M 526 10324 13217 7990 -1594 -116 -2006 O
-ATOM 6776 CB CYS M 526 -45.841 -49.573-158.852 1.00 86.16 C
-ANISOU 6776 CB CYS M 526 10870 13371 8497 -1474 -1055 -1398 C
-ATOM 6777 SG CYS M 526 -45.859 -51.377-158.981 1.00104.65 S
-ANISOU 6777 SG CYS M 526 13057 15761 10944 -1493 -780 -1698 S
-ATOM 6778 N SER M 527 -43.118 -49.446-160.585 1.00112.64 N
-ANISOU 6778 N SER M 527 14676 17109 11014 -2280 -408 -1807 N
-ATOM 6779 CA SER M 527 -41.982 -50.081-161.240 1.00115.80 C
-ANISOU 6779 CA SER M 527 15058 17764 11176 -2573 27 -2230 C
-ATOM 6780 C SER M 527 -40.658 -49.646-160.623 1.00111.11 C
-ANISOU 6780 C SER M 527 14279 17281 10656 -2524 353 -2396 C
-ATOM 6781 O SER M 527 -39.666 -50.380-160.717 1.00120.40 O
-ANISOU 6781 O SER M 527 15221 18640 11884 -2549 734 -2865 O
-ATOM 6782 CB SER M 527 -41.987 -49.773-162.742 1.00124.81 C
-ANISOU 6782 CB SER M 527 16637 19098 11686 -3206 -22 -2244 C
-ATOM 6783 N GLN M 528 -40.625 -48.474-159.988 1.00 82.37 N
-ANISOU 6783 N GLN M 528 10712 13525 7059 -2435 182 -2066 N
-ATOM 6784 CA GLN M 528 -39.450 -48.019-159.258 1.00 74.28 C
-ANISOU 6784 CA GLN M 528 9491 12576 6158 -2348 443 -2189 C
-ATOM 6785 C GLN M 528 -39.475 -48.484-157.809 1.00 96.02 C
-ANISOU 6785 C GLN M 528 11868 15134 9479 -1749 449 -2198 C
-ATOM 6786 O GLN M 528 -38.433 -48.857-157.259 1.00 93.92 O
-ANISOU 6786 O GLN M 528 11325 14935 9425 -1593 717 -2498 O
-ATOM 6787 CB GLN M 528 -39.353 -46.492-159.311 1.00 92.89 C
-ANISOU 6787 CB GLN M 528 12169 14875 8249 -2598 225 -1830 C
-ATOM 6788 CG GLN M 528 -39.416 -45.908-160.713 1.00107.96 C
-ANISOU 6788 CG GLN M 528 14590 16910 9520 -3279 104 -1711 C
-ATOM 6789 CD GLN M 528 -39.413 -44.391-160.715 1.00115.93 C
-ANISOU 6789 CD GLN M 528 16006 17745 10296 -3522 -247 -1295 C
-ATOM 6790 OE1 GLN M 528 -39.187 -43.758-159.683 1.00108.28 O
-ANISOU 6790 OE1 GLN M 528 14882 16617 9640 -3189 -313 -1170 O
-ATOM 6791 NE2 GLN M 528 -39.669 -43.800-161.878 1.00128.97 N
-ANISOU 6791 NE2 GLN M 528 18229 19394 11380 -4127 -523 -1074 N
-ATOM 6792 N CYS M 529 -40.654 -48.467-157.182 1.00 89.40 N
-ANISOU 6792 N CYS M 529 11017 14071 8878 -1441 140 -1901 N
-ATOM 6793 CA CYS M 529 -40.787 -48.982-155.824 1.00 70.55 C
-ANISOU 6793 CA CYS M 529 8338 11529 6937 -983 149 -1894 C
-ATOM 6794 C CYS M 529 -40.402 -50.454-155.751 1.00 79.01 C
-ANISOU 6794 C CYS M 529 9226 12585 8209 -869 334 -2234 C
-ATOM 6795 O CYS M 529 -39.983 -50.937-154.695 1.00 82.28 O
-ANISOU 6795 O CYS M 529 9449 12870 8942 -571 376 -2309 O
-ATOM 6796 CB CYS M 529 -42.220 -48.771-155.332 1.00 76.57 C
-ANISOU 6796 CB CYS M 529 9094 12148 7853 -788 -167 -1600 C
-ATOM 6797 SG CYS M 529 -42.517 -49.070-153.569 1.00107.56 S
-ANISOU 6797 SG CYS M 529 12733 15943 12191 -366 -159 -1528 S
-ATOM 6798 N LEU M 530 -40.524 -51.180-156.862 1.00 94.53 N
-ANISOU 6798 N LEU M 530 11280 14647 9990 -1110 395 -2452 N
-ATOM 6799 CA LEU M 530 -40.123 -52.580-156.884 1.00 89.03 C
-ANISOU 6799 CA LEU M 530 10425 13890 9513 -990 514 -2838 C
-ATOM 6800 C LEU M 530 -38.608 -52.741-156.918 1.00 83.98 C
-ANISOU 6800 C LEU M 530 9576 13379 8952 -971 794 -3301 C
-ATOM 6801 O LEU M 530 -38.099 -53.796-156.528 1.00 88.47 O
-ANISOU 6801 O LEU M 530 9952 13800 9864 -714 803 -3636 O
-ATOM 6802 CB LEU M 530 -40.765 -53.282-158.086 1.00 84.55 C
-ANISOU 6802 CB LEU M 530 10010 13391 8724 -1254 481 -2971 C
-ATOM 6803 CG LEU M 530 -40.819 -54.810-158.105 1.00 76.31 C
-ANISOU 6803 CG LEU M 530 8870 12183 7941 -1110 465 -3290 C
-ATOM 6804 N SER M 531 -37.879 -51.718-157.355 1.00 85.94 N
-ANISOU 6804 N SER M 531 9855 13885 8912 -1247 983 -3347 N
-ATOM 6805 CA SER M 531 -36.433 -51.791-157.506 1.00 86.35 C
-ANISOU 6805 CA SER M 531 9643 14159 9009 -1311 1297 -3866 C
-ATOM 6806 C SER M 531 -35.683 -51.366-156.252 1.00 94.01 C
-ANISOU 6806 C SER M 531 10393 15011 10314 -979 1277 -3821 C
-ATOM 6807 O SER M 531 -34.453 -51.251-156.290 1.00100.01 O
-ANISOU 6807 O SER M 531 10887 15974 11138 -1028 1517 -4248 O
-ATOM 6808 CB SER M 531 -35.981 -50.921-158.677 1.00 81.11 C
-ANISOU 6808 CB SER M 531 9143 13891 7782 -1915 1551 -3968 C
-ATOM 6809 OG SER M 531 -35.976 -49.553-158.306 1.00 80.59 O
-ANISOU 6809 OG SER M 531 9264 13817 7541 -2044 1459 -3531 O
-ATOM 6810 N ALA M 532 -36.393 -51.113-155.156 1.00 89.43 N
-ANISOU 6810 N ALA M 532 9898 14145 9935 -676 1008 -3358 N
-ATOM 6811 CA ALA M 532 -35.738 -50.705-153.928 1.00 86.18 C
-ANISOU 6811 CA ALA M 532 9326 13614 9804 -382 961 -3293 C
-ATOM 6812 C ALA M 532 -34.828 -51.824-153.425 1.00 95.41 C
-ANISOU 6812 C ALA M 532 10202 14640 11409 -55 945 -3754 C
-ATOM 6813 O ALA M 532 -35.080 -53.005-153.687 1.00104.55 O
-ANISOU 6813 O ALA M 532 11345 15650 12730 51 853 -3973 O
-ATOM 6814 CB ALA M 532 -36.773 -50.349-152.865 1.00 80.34 C
-ANISOU 6814 CB ALA M 532 8734 12630 9162 -158 695 -2772 C
-ATOM 6815 N PRO M 533 -33.751 -51.480-152.722 1.00 88.79 N
-ANISOU 6815 N PRO M 533 9136 13811 10791 114 979 -3932 N
-ATOM 6816 CA PRO M 533 -32.893 -52.513-152.156 1.00 85.62 C
-ANISOU 6816 CA PRO M 533 8462 13197 10873 487 836 -4373 C
-ATOM 6817 C PRO M 533 -33.692 -53.423-151.236 1.00 77.09 C
-ANISOU 6817 C PRO M 533 7591 11660 10041 788 448 -4068 C
-ATOM 6818 O PRO M 533 -34.638 -52.975-150.565 1.00 76.73 O
-ANISOU 6818 O PRO M 533 7796 11508 9851 769 331 -3516 O
-ATOM 6819 CB PRO M 533 -31.833 -51.714-151.385 1.00 83.58 C
-ANISOU 6819 CB PRO M 533 7988 13004 10764 600 868 -4448 C
-ATOM 6820 CG PRO M 533 -32.371 -50.322-151.280 1.00 70.64 C
-ANISOU 6820 CG PRO M 533 6591 11507 8743 344 961 -3915 C
-ATOM 6821 CD PRO M 533 -33.236 -50.125-152.469 1.00 78.83 C
-ANISOU 6821 CD PRO M 533 7862 12733 9358 -39 1104 -3769 C
-ATOM 6822 N PRO M 534 -33.340 -54.708-151.184 1.00 80.72 N
-ANISOU 6822 N PRO M 534 7957 11844 10870 1038 225 -4450 N
-ATOM 6823 CA PRO M 534 -34.225 -55.682-150.519 1.00 80.93 C
-ANISOU 6823 CA PRO M 534 8282 11429 11037 1179 -154 -4137 C
-ATOM 6824 C PRO M 534 -34.436 -55.427-149.036 1.00 88.31 C
-ANISOU 6824 C PRO M 534 9414 12098 12042 1323 -425 -3663 C
-ATOM 6825 O PRO M 534 -35.510 -55.754-148.515 1.00 89.36 O
-ANISOU 6825 O PRO M 534 9851 12046 12056 1229 -588 -3230 O
-ATOM 6826 CB PRO M 534 -33.509 -57.021-150.760 1.00 84.83 C
-ANISOU 6826 CB PRO M 534 8625 11632 11974 1447 -408 -4733 C
-ATOM 6827 CG PRO M 534 -32.589 -56.770-151.914 1.00 78.89 C
-ANISOU 6827 CG PRO M 534 7467 11307 11202 1351 -27 -5394 C
-ATOM 6828 CD PRO M 534 -32.154 -55.349-151.771 1.00 76.67 C
-ANISOU 6828 CD PRO M 534 7059 11405 10665 1175 287 -5228 C
-ATOM 6829 N PHE M 535 -33.453 -54.850-148.338 1.00 91.79 N
-ANISOU 6829 N PHE M 535 9685 12546 12646 1502 -461 -3755 N
-ATOM 6830 CA PHE M 535 -33.560 -54.707-146.891 1.00 82.43 C
-ANISOU 6830 CA PHE M 535 8713 11088 11518 1629 -754 -3355 C
-ATOM 6831 C PHE M 535 -34.519 -53.603-146.469 1.00 68.15 C
-ANISOU 6831 C PHE M 535 7070 9505 9320 1408 -553 -2820 C
-ATOM 6832 O PHE M 535 -34.993 -53.622-145.329 1.00 88.02 O
-ANISOU 6832 O PHE M 535 9822 11840 11781 1409 -749 -2456 O
-ATOM 6833 CB PHE M 535 -32.179 -54.460-146.271 1.00 80.77 C
-ANISOU 6833 CB PHE M 535 8260 10798 11631 1906 -906 -3655 C
-ATOM 6834 CG PHE M 535 -31.497 -53.209-146.756 1.00 76.04 C
-ANISOU 6834 CG PHE M 535 7341 10652 10898 1797 -501 -3835 C
-ATOM 6835 CD1 PHE M 535 -31.765 -51.982-146.167 1.00 71.20 C
-ANISOU 6835 CD1 PHE M 535 6832 10203 10020 1675 -366 -3421 C
-ATOM 6836 CD2 PHE M 535 -30.557 -53.266-147.774 1.00 71.46 C
-ANISOU 6836 CD2 PHE M 535 6362 10335 10453 1782 -267 -4456 C
-ATOM 6837 CE1 PHE M 535 -31.132 -50.833-146.601 1.00 71.05 C
-ANISOU 6837 CE1 PHE M 535 6588 10543 9866 1526 -51 -3554 C
-ATOM 6838 CE2 PHE M 535 -29.918 -52.119-148.211 1.00 71.23 C
-ANISOU 6838 CE2 PHE M 535 6086 10736 10241 1570 109 -4603 C
-ATOM 6839 CZ PHE M 535 -30.208 -50.902-147.624 1.00 67.81 C
-ANISOU 6839 CZ PHE M 535 5824 10401 9541 1437 190 -4119 C
-ATOM 6840 N VAL M 536 -34.811 -52.642-147.348 1.00 62.54 N
-ANISOU 6840 N VAL M 536 6256 9173 8335 1201 -201 -2794 N
-ATOM 6841 CA VAL M 536 -35.761 -51.590-147.005 1.00 68.66 C
-ANISOU 6841 CA VAL M 536 7159 10113 8814 1050 -91 -2360 C
-ATOM 6842 C VAL M 536 -37.190 -52.117-146.976 1.00 76.11 C
-ANISOU 6842 C VAL M 536 8303 11000 9615 908 -157 -2080 C
-ATOM 6843 O VAL M 536 -38.048 -51.536-146.299 1.00 82.08 O
-ANISOU 6843 O VAL M 536 9140 11826 10220 843 -151 -1770 O
-ATOM 6844 CB VAL M 536 -35.627 -50.407-147.981 1.00 69.71 C
-ANISOU 6844 CB VAL M 536 7190 10582 8714 860 186 -2404 C
-ATOM 6845 CG1 VAL M 536 -36.308 -49.171-147.420 1.00 80.44 C
-ANISOU 6845 CG1 VAL M 536 8647 12028 9889 816 192 -2035 C
-ATOM 6846 CG2 VAL M 536 -34.166 -50.115-148.246 1.00 64.13 C
-ANISOU 6846 CG2 VAL M 536 6243 9992 8132 896 309 -2787 C
-ATOM 6847 N GLN M 537 -37.464 -53.213-147.688 1.00 77.52 N
-ANISOU 6847 N GLN M 537 8530 11071 9852 849 -217 -2236 N
-ATOM 6848 CA GLN M 537 -38.767 -53.879-147.663 1.00 75.10 C
-ANISOU 6848 CA GLN M 537 8402 10695 9436 678 -301 -2009 C
-ATOM 6849 C GLN M 537 -39.884 -52.933-148.105 1.00 71.57 C
-ANISOU 6849 C GLN M 537 7919 10548 8726 500 -131 -1795 C
-ATOM 6850 O GLN M 537 -40.878 -52.735-147.403 1.00 73.55 O
-ANISOU 6850 O GLN M 537 8213 10850 8882 413 -156 -1545 O
-ATOM 6851 CB GLN M 537 -39.054 -54.464-146.278 1.00 65.04 C
-ANISOU 6851 CB GLN M 537 7341 9158 8212 676 -541 -1765 C
-ATOM 6852 CG GLN M 537 -38.041 -55.503-145.820 1.00 73.31 C
-ANISOU 6852 CG GLN M 537 8504 9793 9557 865 -869 -1949 C
-ATOM 6853 CD GLN M 537 -38.179 -55.839-144.346 1.00102.37 C
-ANISOU 6853 CD GLN M 537 12480 13209 13205 804 -1149 -1645 C
-ATOM 6854 OE1 GLN M 537 -38.379 -54.955-143.510 1.00106.98 O
-ANISOU 6854 OE1 GLN M 537 13064 13973 13611 749 -1035 -1422 O
-ATOM 6855 NE2 GLN M 537 -38.078 -57.123-144.021 1.00111.65 N
-ANISOU 6855 NE2 GLN M 537 13948 13940 14533 782 -1548 -1642 N
-ATOM 6856 N CYS M 538 -39.710 -52.349-149.286 1.00 76.08 N
-ANISOU 6856 N CYS M 538 8409 11321 9176 422 16 -1931 N
-ATOM 6857 CA CYS M 538 -40.680 -51.419-149.840 1.00 76.07 C
-ANISOU 6857 CA CYS M 538 8414 11530 8960 278 58 -1751 C
-ATOM 6858 C CYS M 538 -41.742 -52.160-150.643 1.00 83.62 C
-ANISOU 6858 C CYS M 538 9432 12502 9837 103 0 -1745 C
-ATOM 6859 O CYS M 538 -41.544 -53.289-151.096 1.00 86.33 O
-ANISOU 6859 O CYS M 538 9825 12728 10248 60 -20 -1931 O
-ATOM 6860 CB CYS M 538 -39.999 -50.378-150.730 1.00 96.12 C
-ANISOU 6860 CB CYS M 538 10944 14240 11338 188 171 -1838 C
-ATOM 6861 SG CYS M 538 -38.792 -49.328-149.892 1.00132.39 S
-ANISOU 6861 SG CYS M 538 15453 18847 16000 335 239 -1844 S
-ATOM 6862 N GLY M 539 -42.881 -51.497-150.813 1.00 89.35 N
-ANISOU 6862 N GLY M 539 10137 13360 10453 22 -67 -1566 N
-ATOM 6863 CA GLY M 539 -43.971 -52.024-151.610 1.00 84.36 C
-ANISOU 6863 CA GLY M 539 9532 12773 9747 -151 -156 -1559 C
-ATOM 6864 C GLY M 539 -44.889 -50.897-152.017 1.00 80.71 C
-ANISOU 6864 C GLY M 539 9023 12452 9190 -180 -295 -1431 C
-ATOM 6865 O GLY M 539 -44.860 -49.809-151.433 1.00 80.73 O
-ANISOU 6865 O GLY M 539 8956 12490 9227 -43 -334 -1339 O
-ATOM 6866 N TRP M 540 -45.710 -51.161-153.029 1.00 78.37 N
-ANISOU 6866 N TRP M 540 8776 12202 8799 -344 -425 -1446 N
-ATOM 6867 CA TRP M 540 -46.566 -50.136-153.615 1.00 73.82 C
-ANISOU 6867 CA TRP M 540 8197 11694 8157 -363 -682 -1351 C
-ATOM 6868 C TRP M 540 -47.969 -50.215-153.017 1.00 81.62 C
-ANISOU 6868 C TRP M 540 8916 12766 9331 -300 -812 -1346 C
-ATOM 6869 O TRP M 540 -48.660 -51.228-153.170 1.00 89.13 O
-ANISOU 6869 O TRP M 540 9804 13751 10310 -443 -802 -1403 O
-ATOM 6870 CB TRP M 540 -46.605 -50.277-155.137 1.00 78.30 C
-ANISOU 6870 CB TRP M 540 9003 12270 8478 -611 -804 -1383 C
-ATOM 6871 CG TRP M 540 -47.277 -49.127-155.822 1.00 88.77 C
-ANISOU 6871 CG TRP M 540 10442 13579 9706 -650 -1177 -1251 C
-ATOM 6872 CD1 TRP M 540 -48.530 -49.111-156.362 1.00 96.43 C
-ANISOU 6872 CD1 TRP M 540 11370 14551 10720 -687 -1514 -1231 C
-ATOM 6873 CD2 TRP M 540 -46.743 -47.811-156.009 1.00 85.79 C
-ANISOU 6873 CD2 TRP M 540 10263 13134 9200 -654 -1334 -1121 C
-ATOM 6874 NE1 TRP M 540 -48.801 -47.872-156.889 1.00 92.65 N
-ANISOU 6874 NE1 TRP M 540 11069 13968 10166 -680 -1927 -1099 N
-ATOM 6875 CE2 TRP M 540 -47.720 -47.055-156.682 1.00 82.91 C
-ANISOU 6875 CE2 TRP M 540 10016 12676 8809 -681 -1825 -1009 C
-ATOM 6876 CE3 TRP M 540 -45.530 -47.201-155.677 1.00 84.75 C
-ANISOU 6876 CE3 TRP M 540 10232 12989 8981 -654 -1145 -1094 C
-ATOM 6877 CZ2 TRP M 540 -47.523 -45.720-157.028 1.00 83.47 C
-ANISOU 6877 CZ2 TRP M 540 10369 12589 8758 -720 -2175 -839 C
-ATOM 6878 CZ3 TRP M 540 -45.336 -45.875-156.025 1.00 82.21 C
-ANISOU 6878 CZ3 TRP M 540 10163 12561 8512 -732 -1424 -927 C
-ATOM 6879 CH2 TRP M 540 -46.327 -45.151-156.692 1.00 69.85 C
-ANISOU 6879 CH2 TRP M 540 8776 10852 6910 -770 -1955 -786 C
-ATOM 6880 N CYS M 541 -48.374 -49.145-152.329 1.00 81.00 N
-ANISOU 6880 N CYS M 541 8653 12735 9387 -104 -928 -1326 N
-ATOM 6881 CA CYS M 541 -49.717 -48.987-151.769 1.00 81.98 C
-ANISOU 6881 CA CYS M 541 8422 13012 9715 -29 -1045 -1434 C
-ATOM 6882 C CYS M 541 -50.484 -48.031-152.676 1.00 87.67 C
-ANISOU 6882 C CYS M 541 9124 13687 10501 61 -1493 -1457 C
-ATOM 6883 O CYS M 541 -50.419 -46.813-152.499 1.00 87.99 O
-ANISOU 6883 O CYS M 541 9151 13644 10637 275 -1718 -1451 O
-ATOM 6884 CB CYS M 541 -49.647 -48.456-150.338 1.00 89.28 C
-ANISOU 6884 CB CYS M 541 9118 14034 10770 146 -885 -1493 C
-ATOM 6885 SG CYS M 541 -51.049 -48.795-149.214 1.00109.76 S
-ANISOU 6885 SG CYS M 541 11217 16954 13535 80 -757 -1732 S
-ATOM 6886 N HIS M 542 -51.194 -48.592-153.660 1.00 99.90 N
-ANISOU 6886 N HIS M 542 10709 15245 12004 -106 -1682 -1481 N
-ATOM 6887 CA HIS M 542 -52.035 -47.849-154.600 1.00107.83 C
-ANISOU 6887 CA HIS M 542 11729 16166 13075 -49 -2210 -1499 C
-ATOM 6888 C HIS M 542 -51.306 -46.690-155.272 1.00102.14 C
-ANISOU 6888 C HIS M 542 11417 15203 12187 -17 -2516 -1312 C
-ATOM 6889 O HIS M 542 -51.014 -46.750-156.471 1.00 92.56 O
-ANISOU 6889 O HIS M 542 10610 13880 10681 -267 -2692 -1172 O
-ATOM 6890 CB HIS M 542 -53.294 -47.325-153.903 1.00123.38 C
-ANISOU 6890 CB HIS M 542 13172 18277 15431 201 -2427 -1759 C
-ATOM 6891 CG HIS M 542 -54.265 -46.661-154.833 1.00140.33 C
-ANISOU 6891 CG HIS M 542 15280 20299 17740 312 -3072 -1837 C
-ATOM 6892 ND1 HIS M 542 -54.171 -45.330-155.182 1.00150.86 N
-ANISOU 6892 ND1 HIS M 542 16809 21358 19155 534 -3596 -1770 N
-ATOM 6893 CD2 HIS M 542 -55.340 -47.148-155.498 1.00136.23 C
-ANISOU 6893 CD2 HIS M 542 14583 19851 17326 223 -3347 -1970 C
-ATOM 6894 CE1 HIS M 542 -55.150 -45.024-156.014 1.00146.81 C
-ANISOU 6894 CE1 HIS M 542 16256 20722 18802 600 -4212 -1855 C
-ATOM 6895 NE2 HIS M 542 -55.874 -46.109-156.223 1.00132.92 N
-ANISOU 6895 NE2 HIS M 542 14244 19191 17067 422 -4059 -1989 N
-ATOM 6896 N ASP M 543 -51.023 -45.626-154.512 1.00102.31 N
-ANISOU 6896 N ASP M 543 11364 15149 12359 237 -2589 -1315 N
-ATOM 6897 CA ASP M 543 -50.416 -44.418-155.052 1.00102.95 C
-ANISOU 6897 CA ASP M 543 11851 14965 12300 239 -2945 -1125 C
-ATOM 6898 C ASP M 543 -49.100 -44.032-154.393 1.00 97.59 C
-ANISOU 6898 C ASP M 543 11317 14264 11498 243 -2598 -1026 C
-ATOM 6899 O ASP M 543 -48.452 -43.089-154.860 1.00 97.33 O
-ANISOU 6899 O ASP M 543 11669 14027 11285 145 -2834 -848 O
-ATOM 6900 CB ASP M 543 -51.386 -43.231-154.928 1.00115.15 C
-ANISOU 6900 CB ASP M 543 13228 16327 14196 573 -3576 -1238 C
-ATOM 6901 CG ASP M 543 -51.665 -42.851-153.480 1.00129.16 C
-ANISOU 6901 CG ASP M 543 14491 18239 16343 939 -3395 -1505 C
-ATOM 6902 OD1 ASP M 543 -51.714 -43.753-152.616 1.00134.77 O
-ANISOU 6902 OD1 ASP M 543 14863 19252 17092 909 -2860 -1647 O
-ATOM 6903 OD2 ASP M 543 -51.827 -41.644-153.204 1.00137.36 O
-ANISOU 6903 OD2 ASP M 543 15504 19068 17616 1228 -3813 -1580 O
-ATOM 6904 N LYS M 544 -48.691 -44.711-153.326 1.00 98.19 N
-ANISOU 6904 N LYS M 544 11128 14525 11654 318 -2090 -1126 N
-ATOM 6905 CA LYS M 544 -47.486 -44.358-152.594 1.00 92.19 C
-ANISOU 6905 CA LYS M 544 10452 13744 10831 361 -1801 -1066 C
-ATOM 6906 C LYS M 544 -46.594 -45.583-152.454 1.00 89.61 C
-ANISOU 6906 C LYS M 544 10156 13538 10354 187 -1313 -1081 C
-ATOM 6907 O LYS M 544 -47.029 -46.722-152.650 1.00 93.75 O
-ANISOU 6907 O LYS M 544 10590 14155 10874 80 -1182 -1152 O
-ATOM 6908 CB LYS M 544 -47.823 -43.772-151.208 1.00 88.90 C
-ANISOU 6908 CB LYS M 544 9686 13380 10712 691 -1771 -1209 C
-ATOM 6909 CG LYS M 544 -48.704 -44.663-150.334 1.00 86.06 C
-ANISOU 6909 CG LYS M 544 8900 13271 10527 749 -1526 -1413 C
-ATOM 6910 CD LYS M 544 -49.130 -43.949-149.056 1.00 85.17 C
-ANISOU 6910 CD LYS M 544 8434 13267 10659 1018 -1506 -1624 C
-ATOM 6911 N CYS M 545 -45.329 -45.334-152.122 1.00 80.01 N
-ANISOU 6911 N CYS M 545 9065 12291 9043 168 -1091 -1041 N
-ATOM 6912 CA CYS M 545 -44.336 -46.385-151.922 1.00 68.11 C
-ANISOU 6912 CA CYS M 545 7558 10848 7472 76 -707 -1120 C
-ATOM 6913 C CYS M 545 -43.922 -46.373-150.456 1.00 70.03 C
-ANISOU 6913 C CYS M 545 7615 11097 7896 298 -527 -1148 C
-ATOM 6914 O CYS M 545 -43.239 -45.448-150.005 1.00 68.44 O
-ANISOU 6914 O CYS M 545 7453 10848 7705 391 -534 -1108 O
-ATOM 6915 CB CYS M 545 -43.134 -46.178-152.838 1.00 70.77 C
-ANISOU 6915 CB CYS M 545 8155 11188 7547 -173 -601 -1131 C
-ATOM 6916 SG CYS M 545 -41.812 -47.399-152.636 1.00 90.86 S
-ANISOU 6916 SG CYS M 545 10608 13799 10114 -207 -193 -1369 S
-ATOM 6917 N VAL M 546 -44.351 -47.387-149.710 1.00 72.52 N
-ANISOU 6917 N VAL M 546 7772 11460 8322 335 -393 -1203 N
-ATOM 6918 CA VAL M 546 -44.100 -47.499-148.282 1.00 68.52 C
-ANISOU 6918 CA VAL M 546 7149 10964 7923 467 -256 -1208 C
-ATOM 6919 C VAL M 546 -43.821 -48.963-147.960 1.00 78.19 C
-ANISOU 6919 C VAL M 546 8425 12125 9158 366 -122 -1236 C
-ATOM 6920 O VAL M 546 -43.786 -49.819-148.847 1.00 83.13 O
-ANISOU 6920 O VAL M 546 9140 12700 9744 238 -124 -1292 O
-ATOM 6921 CB VAL M 546 -45.282 -46.980-147.438 1.00 59.72 C
-ANISOU 6921 CB VAL M 546 5795 9986 6911 563 -321 -1247 C
-ATOM 6922 CG1 VAL M 546 -45.544 -45.508-147.721 1.00 65.25 C
-ANISOU 6922 CG1 VAL M 546 6454 10660 7678 731 -563 -1262 C
-ATOM 6923 CG2 VAL M 546 -46.523 -47.815-147.699 1.00 58.22 C
-ANISOU 6923 CG2 VAL M 546 5463 9918 6739 411 -338 -1309 C
-ATOM 6924 N ARG M 547 -43.627 -49.252-146.679 1.00 71.54 N
-ANISOU 6924 N ARG M 547 7566 11256 8359 407 -51 -1203 N
-ATOM 6925 CA ARG M 547 -43.486 -50.627-146.227 1.00 70.92 C
-ANISOU 6925 CA ARG M 547 7613 11043 8292 284 -38 -1187 C
-ATOM 6926 C ARG M 547 -44.814 -51.132-145.676 1.00 74.87 C
-ANISOU 6926 C ARG M 547 8040 11681 8726 66 -14 -1140 C
-ATOM 6927 O ARG M 547 -45.722 -50.354-145.372 1.00 69.99 O
-ANISOU 6927 O ARG M 547 7201 11300 8092 67 29 -1181 O
-ATOM 6928 CB ARG M 547 -42.394 -50.753-145.166 1.00 70.48 C
-ANISOU 6928 CB ARG M 547 7670 10824 8284 389 -51 -1155 C
-ATOM 6929 CG ARG M 547 -42.625 -49.906-143.945 1.00 92.06 C
-ANISOU 6929 CG ARG M 547 10333 13689 10957 428 1 -1084 C
-ATOM 6930 CD ARG M 547 -41.563 -50.188-142.904 1.00106.39 C
-ANISOU 6930 CD ARG M 547 12318 15308 12796 494 -73 -1032 C
-ATOM 6931 NE ARG M 547 -41.815 -49.456-141.672 1.00117.13 N
-ANISOU 6931 NE ARG M 547 13645 16814 14045 479 -11 -977 N
-ATOM 6932 CZ ARG M 547 -41.092 -49.592-140.568 1.00135.78 C
-ANISOU 6932 CZ ARG M 547 16183 19041 16365 484 -98 -902 C
-ATOM 6933 NH1 ARG M 547 -40.075 -50.444-140.544 1.00142.91 N1+
-ANISOU 6933 NH1 ARG M 547 17288 19624 17387 547 -304 -881 N1+
-ATOM 6934 NH2 ARG M 547 -41.393 -48.885-139.489 1.00143.03 N
-ANISOU 6934 NH2 ARG M 547 17068 20139 17138 433 -12 -887 N
-ATOM 6935 N SER M 548 -44.909 -52.459-145.541 1.00 81.56 N
-ANISOU 6935 N SER M 548 9065 12375 9549 -139 -60 -1094 N
-ATOM 6936 CA SER M 548 -46.184 -53.089-145.201 1.00 83.31 C
-ANISOU 6936 CA SER M 548 9239 12745 9668 -462 -22 -1060 C
-ATOM 6937 C SER M 548 -46.765 -52.546-143.903 1.00 83.79 C
-ANISOU 6937 C SER M 548 9164 13065 9605 -590 119 -1048 C
-ATOM 6938 O SER M 548 -47.985 -52.584-143.707 1.00 86.84 O
-ANISOU 6938 O SER M 548 9332 13744 9918 -834 228 -1132 O
-ATOM 6939 CB SER M 548 -46.013 -54.608-145.115 1.00 90.30 C
-ANISOU 6939 CB SER M 548 10442 13337 10529 -698 -155 -973 C
-ATOM 6940 OG SER M 548 -44.989 -54.960-144.202 1.00104.49 O
-ANISOU 6940 OG SER M 548 12512 14855 12334 -647 -277 -873 O
-ATOM 6941 N GLU M 549 -45.919 -52.030-143.010 1.00 91.92 N
-ANISOU 6941 N GLU M 549 10286 14030 10609 -449 132 -995 N
-ATOM 6942 CA GLU M 549 -46.421 -51.452-141.768 1.00 95.96 C
-ANISOU 6942 CA GLU M 549 10671 14821 10968 -584 291 -1034 C
-ATOM 6943 C GLU M 549 -47.190 -50.158-142.017 1.00 92.21 C
-ANISOU 6943 C GLU M 549 9762 14671 10602 -381 386 -1265 C
-ATOM 6944 O GLU M 549 -48.121 -49.840-141.268 1.00 88.37 O
-ANISOU 6944 O GLU M 549 9017 14533 10026 -553 554 -1440 O
-ATOM 6945 CB GLU M 549 -45.263 -51.200-140.800 1.00 83.64 C
-ANISOU 6945 CB GLU M 549 9344 13080 9357 -467 235 -925 C
-ATOM 6946 CG GLU M 549 -44.407 -52.425-140.522 1.00 74.06 C
-ANISOU 6946 CG GLU M 549 8570 11459 8112 -589 10 -729 C
-ATOM 6947 N GLU M 550 -46.826 -49.410-143.057 1.00 88.25 N
-ANISOU 6947 N GLU M 550 9184 14058 10288 -45 255 -1303 N
-ATOM 6948 CA GLU M 550 -47.418 -48.107-143.330 1.00 84.45 C
-ANISOU 6948 CA GLU M 550 8380 13754 9953 198 201 -1497 C
-ATOM 6949 C GLU M 550 -48.548 -48.156-144.354 1.00 88.07 C
-ANISOU 6949 C GLU M 550 8608 14329 10527 173 85 -1626 C
-ATOM 6950 O GLU M 550 -49.145 -47.117-144.644 1.00 86.80 O
-ANISOU 6950 O GLU M 550 8181 14261 10538 396 -68 -1813 O
-ATOM 6951 CB GLU M 550 -46.337 -47.131-143.802 1.00 78.79 C
-ANISOU 6951 CB GLU M 550 7795 12811 9328 513 56 -1425 C
-ATOM 6952 CG GLU M 550 -45.207 -46.943-142.806 1.00 98.73 C
-ANISOU 6952 CG GLU M 550 10496 15231 11787 578 131 -1337 C
-ATOM 6953 CD GLU M 550 -44.145 -45.979-143.300 1.00128.23 C
-ANISOU 6953 CD GLU M 550 14337 18780 15605 821 10 -1289 C
-ATOM 6954 OE1 GLU M 550 -44.446 -45.171-144.204 1.00138.98 O
-ANISOU 6954 OE1 GLU M 550 15637 20118 17049 935 -150 -1328 O
-ATOM 6955 OE2 GLU M 550 -43.006 -46.036-142.789 1.00136.25 O1-
-ANISOU 6955 OE2 GLU M 550 15515 19661 16593 865 41 -1212 O1-
-ATOM 6956 N CYS M 551 -48.859 -49.324-144.908 1.00 88.79 N
-ANISOU 6956 N CYS M 551 8805 14379 10551 -79 95 -1547 N
-ATOM 6957 CA CYS M 551 -49.970 -49.472-145.850 1.00 95.22 C
-ANISOU 6957 CA CYS M 551 9402 15312 11465 -141 -32 -1674 C
-ATOM 6958 C CYS M 551 -51.177 -49.931-145.040 1.00 95.59 C
-ANISOU 6958 C CYS M 551 9127 15721 11470 -449 157 -1873 C
-ATOM 6959 O CYS M 551 -51.321 -51.117-144.728 1.00 95.75 O
-ANISOU 6959 O CYS M 551 9307 15756 11319 -833 294 -1769 O
-ATOM 6960 CB CYS M 551 -49.601 -50.443-146.970 1.00105.95 C
-ANISOU 6960 CB CYS M 551 11055 16435 12766 -257 -126 -1516 C
-ATOM 6961 SG CYS M 551 -50.756 -50.634-148.383 1.00130.59 S
-ANISOU 6961 SG CYS M 551 14017 19623 15976 -327 -359 -1623 S
-ATOM 6962 N LEU M 552 -52.041 -48.979-144.681 1.00 91.71 N
-ANISOU 6962 N LEU M 552 8179 15526 11140 -304 151 -2197 N
-ATOM 6963 CA LEU M 552 -53.115 -49.254-143.731 1.00 94.21 C
-ANISOU 6963 CA LEU M 552 8104 16298 11394 -630 419 -2494 C
-ATOM 6964 C LEU M 552 -54.275 -49.996-144.386 1.00103.85 C
-ANISOU 6964 C LEU M 552 9071 17710 12676 -900 386 -2640 C
-ATOM 6965 O LEU M 552 -54.688 -51.060-143.915 1.00112.15 O
-ANISOU 6965 O LEU M 552 10166 18943 13503 -1412 622 -2607 O
-ATOM 6966 CB LEU M 552 -53.599 -47.949-143.096 1.00 96.24 C
-ANISOU 6966 CB LEU M 552 7883 16831 11851 -342 428 -2910 C
-ATOM 6967 CG LEU M 552 -52.509 -47.046-142.517 1.00 93.56 C
-ANISOU 6967 CG LEU M 552 7766 16292 11492 -36 409 -2802 C
-ATOM 6968 CD1 LEU M 552 -53.121 -45.845-141.817 1.00 96.98 C
-ANISOU 6968 CD1 LEU M 552 7692 17019 12137 221 420 -3294 C
-ATOM 6969 CD2 LEU M 552 -51.621 -47.830-141.567 1.00 86.61 C
-ANISOU 6969 CD2 LEU M 552 7311 15349 10249 -366 678 -2501 C
-ATOM 6970 N SER M 553 -54.828 -49.437-145.459 1.00102.65 N
-ANISOU 6970 N SER M 553 8679 17506 12815 -596 54 -2796 N
-ATOM 6971 CA SER M 553 -55.883 -50.091-146.216 1.00 99.97 C
-ANISOU 6971 CA SER M 553 8106 17309 12568 -807 -50 -2932 C
-ATOM 6972 C SER M 553 -55.477 -50.161-147.681 1.00 87.87 C
-ANISOU 6972 C SER M 553 6923 15369 11094 -607 -429 -2671 C
-ATOM 6973 O SER M 553 -54.556 -49.471-148.126 1.00 75.36 O
-ANISOU 6973 O SER M 553 5649 13466 9519 -288 -624 -2474 O
-ATOM 6974 CB SER M 553 -57.226 -49.361-146.074 1.00105.14 C
-ANISOU 6974 CB SER M 553 8018 18380 13552 -678 -137 -3503 C
-ATOM 6975 OG SER M 553 -57.214 -48.128-146.770 1.00110.24 O
-ANISOU 6975 OG SER M 553 8559 18796 14532 -113 -609 -3619 O
-ATOM 6976 N GLY M 554 -56.174 -51.011-148.427 1.00 92.11 N
-ANISOU 6976 N GLY M 554 7418 15946 11632 -857 -517 -2685 N
-ATOM 6977 CA GLY M 554 -55.885 -51.168-149.839 1.00104.42 C
-ANISOU 6977 CA GLY M 554 9311 17175 13189 -750 -853 -2478 C
-ATOM 6978 C GLY M 554 -54.992 -52.354-150.140 1.00 97.09 C
-ANISOU 6978 C GLY M 554 8920 15981 11988 -1008 -704 -2148 C
-ATOM 6979 O GLY M 554 -55.015 -53.354-149.417 1.00 95.29 O
-ANISOU 6979 O GLY M 554 8768 15826 11612 -1365 -431 -2091 O
-ATOM 6980 N THR M 555 -54.196 -52.254-151.201 1.00 87.82 N
-ANISOU 6980 N THR M 555 8134 14494 10739 -857 -904 -1957 N
-ATOM 6981 CA THR M 555 -53.342 -53.344-151.648 1.00 84.52 C
-ANISOU 6981 CA THR M 555 8165 13824 10126 -1039 -807 -1760 C
-ATOM 6982 C THR M 555 -51.880 -52.940-151.546 1.00 78.35 C
-ANISOU 6982 C THR M 555 7706 12814 9249 -829 -725 -1607 C
-ATOM 6983 O THR M 555 -51.518 -51.799-151.850 1.00 82.17 O
-ANISOU 6983 O THR M 555 8203 13259 9758 -578 -862 -1590 O
-ATOM 6984 CB THR M 555 -53.663 -53.749-153.090 1.00 97.53 C
-ANISOU 6984 CB THR M 555 9959 15370 11729 -1130 -1061 -1766 C
-ATOM 6985 OG1 THR M 555 -53.419 -52.641-153.965 1.00103.06 O
-ANISOU 6985 OG1 THR M 555 10756 15981 12422 -888 -1343 -1738 O
-ATOM 6986 CG2 THR M 555 -55.116 -54.165-153.205 1.00104.70 C
-ANISOU 6986 CG2 THR M 555 10512 16510 12760 -1343 -1169 -1943 C
-ATOM 6987 N TRP M 556 -51.047 -53.886-151.118 1.00 69.68 N
-ANISOU 6987 N TRP M 556 6872 11544 8060 -947 -544 -1511 N
-ATOM 6988 CA TRP M 556 -49.608 -53.687-150.997 1.00 65.54 C
-ANISOU 6988 CA TRP M 556 6603 10813 7487 -763 -464 -1432 C
-ATOM 6989 C TRP M 556 -48.926 -54.799-151.775 1.00 73.39 C
-ANISOU 6989 C TRP M 556 7890 11573 8423 -863 -479 -1461 C
-ATOM 6990 O TRP M 556 -49.111 -55.980-151.463 1.00 74.69 O
-ANISOU 6990 O TRP M 556 8163 11614 8603 -1062 -473 -1454 O
-ATOM 6991 CB TRP M 556 -49.173 -53.699-149.528 1.00 67.97 C
-ANISOU 6991 CB TRP M 556 6907 11112 7807 -742 -297 -1361 C
-ATOM 6992 CG TRP M 556 -47.749 -53.281-149.280 1.00 66.58 C
-ANISOU 6992 CG TRP M 556 6905 10761 7632 -509 -247 -1315 C
-ATOM 6993 CD1 TRP M 556 -47.260 -52.005-149.251 1.00 69.71 C
-ANISOU 6993 CD1 TRP M 556 7231 11212 8045 -271 -248 -1312 C
-ATOM 6994 CD2 TRP M 556 -46.637 -54.140-149.001 1.00 67.78 C
-ANISOU 6994 CD2 TRP M 556 7311 10642 7802 -494 -230 -1297 C
-ATOM 6995 NE1 TRP M 556 -45.913 -52.018-148.981 1.00 66.77 N
-ANISOU 6995 NE1 TRP M 556 7024 10669 7677 -143 -182 -1295 N
-ATOM 6996 CE2 TRP M 556 -45.506 -53.317-148.823 1.00 66.33 C
-ANISOU 6996 CE2 TRP M 556 7143 10413 7648 -246 -184 -1311 C
-ATOM 6997 CE3 TRP M 556 -46.486 -55.525-148.889 1.00 77.59 C
-ANISOU 6997 CE3 TRP M 556 8771 11640 9070 -656 -306 -1295 C
-ATOM 6998 CZ2 TRP M 556 -44.245 -53.834-148.541 1.00 66.64 C
-ANISOU 6998 CZ2 TRP M 556 7340 10211 7768 -133 -198 -1365 C
-ATOM 6999 CZ3 TRP M 556 -45.234 -56.035-148.610 1.00 81.23 C
-ANISOU 6999 CZ3 TRP M 556 9429 11804 9630 -510 -376 -1341 C
-ATOM 7000 CH2 TRP M 556 -44.130 -55.193-148.440 1.00 77.27 C
-ANISOU 7000 CH2 TRP M 556 8872 11304 9184 -238 -315 -1397 C
-ATOM 7001 N THR M 557 -48.154 -54.429-152.789 1.00 80.82 N
-ANISOU 7001 N THR M 557 8967 12454 9285 -763 -509 -1524 N
-ATOM 7002 CA THR M 557 -47.527 -55.394-153.677 1.00 89.48 C
-ANISOU 7002 CA THR M 557 10277 13393 10329 -851 -503 -1669 C
-ATOM 7003 C THR M 557 -46.013 -55.269-153.613 1.00 85.64 C
-ANISOU 7003 C THR M 557 9887 12797 9857 -682 -373 -1785 C
-ATOM 7004 O THR M 557 -45.471 -54.166-153.482 1.00 84.22 O
-ANISOU 7004 O THR M 557 9661 12711 9628 -557 -310 -1736 O
-ATOM 7005 CB THR M 557 -48.001 -55.208-155.122 1.00100.50 C
-ANISOU 7005 CB THR M 557 11738 14890 11558 -992 -627 -1738 C
-ATOM 7006 OG1 THR M 557 -47.276 -56.099-155.979 1.00108.43 O
-ANISOU 7006 OG1 THR M 557 12929 15784 12487 -1081 -569 -1958 O
-ATOM 7007 CG2 THR M 557 -47.786 -53.773-155.578 1.00 98.15 C
-ANISOU 7007 CG2 THR M 557 11455 14715 11124 -917 -690 -1662 C
-ATOM 7008 N GLN M 558 -45.338 -56.411-153.705 1.00 88.94 N
-ANISOU 7008 N GLN M 558 10419 13001 10371 -677 -366 -1975 N
-ATOM 7009 CA GLN M 558 -43.885 -56.444-153.728 1.00 92.83 C
-ANISOU 7009 CA GLN M 558 10924 13404 10944 -501 -265 -2208 C
-ATOM 7010 C GLN M 558 -43.343 -57.392-154.792 1.00 90.28 C
-ANISOU 7010 C GLN M 558 10668 13001 10634 -554 -252 -2590 C
-ATOM 7011 O GLN M 558 -42.124 -57.565-154.877 1.00 85.18 O
-ANISOU 7011 O GLN M 558 9958 12302 10105 -404 -166 -2910 O
-ATOM 7012 CB GLN M 558 -43.347 -56.846-152.341 1.00 99.12 C
-ANISOU 7012 CB GLN M 558 11739 13953 11970 -321 -338 -2137 C
-ATOM 7013 CG GLN M 558 -41.938 -56.362-152.019 1.00101.70 C
-ANISOU 7013 CG GLN M 558 11978 14256 12407 -84 -251 -2306 C
-ATOM 7014 CD GLN M 558 -41.468 -56.821-150.647 1.00101.15 C
-ANISOU 7014 CD GLN M 558 11981 13894 12559 82 -419 -2215 C
-ATOM 7015 OE1 GLN M 558 -42.185 -57.531-149.941 1.00 97.12 O
-ANISOU 7015 OE1 GLN M 558 11636 13194 12070 -38 -591 -2007 O
-ATOM 7016 NE2 GLN M 558 -40.263 -56.410-150.261 1.00 96.61 N
-ANISOU 7016 NE2 GLN M 558 11304 13284 12120 307 -390 -2367 N
-ATOM 7017 N GLN M 559 -44.203 -57.993-155.616 1.00 94.70 N
-ANISOU 7017 N GLN M 559 11319 13573 11089 -761 -334 -2624 N
-ATOM 7018 CA GLN M 559 -43.804 -59.024-156.566 1.00102.97 C
-ANISOU 7018 CA GLN M 559 12437 14524 12163 -818 -342 -3028 C
-ATOM 7019 C GLN M 559 -43.884 -58.553-158.014 1.00100.40 C
-ANISOU 7019 C GLN M 559 12152 14505 11490 -1061 -209 -3189 C
-ATOM 7020 O GLN M 559 -42.860 -58.497-158.700 1.00104.82 O
-ANISOU 7020 O GLN M 559 12665 15203 11958 -1084 -14 -3577 O
-ATOM 7021 CB GLN M 559 -44.670 -60.276-156.361 1.00109.15 C
-ANISOU 7021 CB GLN M 559 13359 15024 13090 -914 -581 -2968 C
-ATOM 7022 CG GLN M 559 -44.655 -60.821-154.936 1.00105.48 C
-ANISOU 7022 CG GLN M 559 12968 14228 12880 -800 -762 -2761 C
-ATOM 7023 CD GLN M 559 -43.296 -61.363-154.531 1.00 90.01 C
-ANISOU 7023 CD GLN M 559 11018 11964 11216 -504 -855 -3072 C
-ATOM 7024 N ILE M 560 -45.079 -58.223-158.506 1.00 97.91 N
-ANISOU 7024 N ILE M 560 11921 14314 10966 -1278 -327 -2931 N
-ATOM 7025 CA ILE M 560 -45.279 -57.831-159.898 1.00 99.30 C
-ANISOU 7025 CA ILE M 560 12232 14731 10765 -1568 -300 -3027 C
-ATOM 7026 C ILE M 560 -45.639 -56.354-159.967 1.00 93.51 C
-ANISOU 7026 C ILE M 560 11540 14185 9807 -1645 -366 -2685 C
-ATOM 7027 O ILE M 560 -46.199 -55.782-159.027 1.00 78.25 O
-ANISOU 7027 O ILE M 560 9490 12200 8041 -1478 -482 -2376 O
-ATOM 7028 CB ILE M 560 -46.375 -58.668-160.598 1.00 97.54 C
-ANISOU 7028 CB ILE M 560 12125 14453 10482 -1771 -499 -3042 C
-ATOM 7029 CG1 ILE M 560 -47.647 -58.708-159.747 1.00 93.20 C
-ANISOU 7029 CG1 ILE M 560 11481 13802 10128 -1726 -720 -2677 C
-ATOM 7030 CG2 ILE M 560 -45.875 -60.067-160.944 1.00 81.32 C
-ANISOU 7030 CG2 ILE M 560 10109 12219 8571 -1757 -458 -3483 C
-ATOM 7031 N CYS M 561 -45.319 -55.737-161.101 1.00114.21 N
-ANISOU 7031 N CYS M 561 14352 17015 12029 -1932 -315 -2764 N
-ATOM 7032 CA CYS M 561 -45.825 -54.413-161.423 1.00133.31 C
-ANISOU 7032 CA CYS M 561 16932 19527 14193 -2075 -528 -2423 C
-ATOM 7033 C CYS M 561 -46.210 -54.388-162.896 1.00136.75 C
-ANISOU 7033 C CYS M 561 17687 20092 14181 -2497 -673 -2471 C
-ATOM 7034 O CYS M 561 -45.507 -54.954-163.741 1.00144.02 O
-ANISOU 7034 O CYS M 561 18717 21163 14843 -2755 -431 -2830 O
-ATOM 7035 CB CYS M 561 -44.805 -53.305-161.119 1.00154.90 C
-ANISOU 7035 CB CYS M 561 19686 22353 16818 -2067 -367 -2363 C
-ATOM 7036 SG CYS M 561 -45.632 -51.704-160.983 1.00181.50 S
-ANISOU 7036 SG CYS M 561 23208 25655 20099 -2061 -784 -1878 S
-ATOM 7037 N LEU M 562 -47.340 -53.742-163.198 1.00126.64 N
-ANISOU 7037 N LEU M 562 16543 18755 12819 -2568 -1096 -2150 N
-ATOM 7038 CA LEU M 562 -47.934 -53.744-164.536 1.00108.50 C
-ANISOU 7038 CA LEU M 562 14588 16520 10118 -2959 -1369 -2130 C
-ATOM 7039 C LEU M 562 -47.972 -52.317-165.069 1.00114.66 C
-ANISOU 7039 C LEU M 562 15729 17297 10538 -3198 -1697 -1818 C
-ATOM 7040 O LEU M 562 -48.941 -51.580-164.826 1.00113.39 O
-ANISOU 7040 O LEU M 562 15561 16967 10554 -3028 -2180 -1520 O
-ATOM 7041 CB LEU M 562 -49.334 -54.354-164.508 1.00 91.90 C
-ANISOU 7041 CB LEU M 562 12350 14299 8270 -2848 -1707 -2053 C
-ATOM 7042 CG LEU M 562 -49.475 -55.872-164.664 1.00 92.42 C
-ANISOU 7042 CG LEU M 562 12306 14351 8459 -2875 -1531 -2358 C
-ATOM 7043 CD1 LEU M 562 -48.634 -56.634-163.654 1.00 97.10 C
-ANISOU 7043 CD1 LEU M 562 12634 14872 9388 -2600 -1138 -2571 C
-ATOM 7044 CD2 LEU M 562 -50.933 -56.282-164.546 1.00 89.53 C
-ANISOU 7044 CD2 LEU M 562 11783 13891 8345 -2811 -1890 -2236 C
-ATOM 7045 N PRO M 563 -46.942 -51.884-165.800 1.00117.18 N
-ANISOU 7045 N PRO M 563 16372 17794 10356 -3617 -1478 -1905 N
-ATOM 7046 CA PRO M 563 -46.939 -50.514-166.334 1.00121.67 C
-ANISOU 7046 CA PRO M 563 17400 18309 10519 -3942 -1848 -1560 C
-ATOM 7047 C PRO M 563 -47.941 -50.323-167.463 1.00126.42 C
-ANISOU 7047 C PRO M 563 18446 18814 10774 -4282 -2428 -1357 C
-ATOM 7048 O PRO M 563 -48.631 -51.268-167.861 1.00123.96 O
-ANISOU 7048 O PRO M 563 18052 18521 10526 -4273 -2496 -1508 O
-ATOM 7049 CB PRO M 563 -45.497 -50.333-166.829 1.00124.69 C
-ANISOU 7049 CB PRO M 563 17981 18988 10410 -4412 -1347 -1792 C
-ATOM 7050 CG PRO M 563 -44.708 -51.426-166.155 1.00118.68 C
-ANISOU 7050 CG PRO M 563 16706 18373 10016 -4099 -751 -2258 C
-ATOM 7051 CD PRO M 563 -45.662 -52.567-166.035 1.00114.57 C
-ANISOU 7051 CD PRO M 563 15961 17720 9850 -3803 -881 -2358 C
-ATOM 7052 N ALA M 564 -48.024 -49.102-167.988 1.00131.87 N
-ANISOU 7052 N ALA M 564 19645 19366 11092 -4599 -2903 -1004 N
-ATOM 7053 CA ALA M 564 -48.956 -48.758-169.050 1.00145.71 C
-ANISOU 7053 CA ALA M 564 21909 20950 12503 -4930 -3603 -753 C
-ATOM 7054 C ALA M 564 -48.197 -48.350-170.306 1.00158.46 C
-ANISOU 7054 C ALA M 564 24105 22639 13465 -5608 -3428 -653 C
-ATOM 7055 O ALA M 564 -47.098 -47.791-170.234 1.00156.23 O
-ANISOU 7055 O ALA M 564 23939 22475 12947 -5868 -3046 -644 O
-ATOM 7056 CB ALA M 564 -49.895 -47.624-168.619 1.00145.11 C
-ANISOU 7056 CB ALA M 564 21887 20457 12790 -4572 -4409 -366 C
-ATOM 7057 N HIS M 565 -48.797 -48.632-171.460 1.00165.85 N
-ANISOU 7057 N HIS M 565 25355 23494 14165 -5891 -3671 -577 N
-ATOM 7058 CA HIS M 565 -48.186 -48.308-172.746 1.00177.34 C
-ANISOU 7058 CA HIS M 565 27344 25008 15031 -6581 -3491 -466 C
-ATOM 7059 C HIS M 565 -49.144 -47.517-173.632 1.00182.30 C
-ANISOU 7059 C HIS M 565 28522 25199 15543 -6762 -4287 5 C
-ATOM 7060 O HIS M 565 -50.217 -47.106-173.191 1.00181.63 O
-ANISOU 7060 O HIS M 565 28356 24757 15900 -6284 -4982 219 O
-ATOM 7061 CB HIS M 565 -47.742 -49.584-173.465 1.00180.72 C
-ANISOU 7061 CB HIS M 565 27643 25831 15191 -6877 -2869 -932 C
-TER 7062 HIS M 565
-HETATM 7063 C1 NAG A 1 -43.396 -30.273-138.856 1.00114.12 C
-HETATM 7064 C2 NAG A 1 -43.704 -30.257-140.341 1.00127.70 C
-HETATM 7065 C3 NAG A 1 -44.943 -29.397-140.602 1.00144.41 C
-HETATM 7066 C4 NAG A 1 -46.094 -29.759-139.664 1.00155.37 C
-HETATM 7067 C5 NAG A 1 -45.631 -29.952-138.218 1.00145.76 C
-HETATM 7068 C6 NAG A 1 -46.680 -30.585-137.333 1.00140.68 C
-HETATM 7069 C7 NAG A 1 -41.650 -30.559-141.657 1.00116.49 C
-HETATM 7070 C8 NAG A 1 -40.552 -29.870-142.411 1.00117.60 C
-HETATM 7071 N2 NAG A 1 -42.570 -29.761-141.104 1.00124.84 N
-HETATM 7072 O3 NAG A 1 -45.353 -29.559-141.955 1.00149.26 O
-HETATM 7073 O4 NAG A 1 -47.018 -28.677-139.653 1.00170.79 O
-HETATM 7074 O5 NAG A 1 -44.483 -30.806-138.162 1.00134.63 O
-HETATM 7075 O6 NAG A 1 -46.152 -30.917-136.056 1.00136.03 O
-HETATM 7076 O7 NAG A 1 -41.701 -31.781-141.553 1.00101.45 O
-HETATM 7077 C1 NAG A 2 -48.317 -29.078-140.109 1.00175.73 C
-HETATM 7078 C2 NAG A 2 -49.305 -27.963-139.756 1.00185.05 C
-HETATM 7079 C3 NAG A 2 -50.695 -28.290-140.298 1.00187.84 C
-HETATM 7080 C4 NAG A 2 -50.627 -28.626-141.782 1.00184.02 C
-HETATM 7081 C5 NAG A 2 -49.593 -29.721-142.022 1.00171.10 C
-HETATM 7082 C6 NAG A 2 -49.390 -30.040-143.484 1.00163.81 C
-HETATM 7083 C7 NAG A 2 -49.619 -26.567-137.755 1.00194.84 C
-HETATM 7084 C8 NAG A 2 -49.628 -26.538-136.255 1.00193.76 C
-HETATM 7085 N2 NAG A 2 -49.355 -27.752-138.317 1.00191.25 N
-HETATM 7086 O3 NAG A 2 -51.556 -27.175-140.095 1.00192.02 O
-HETATM 7087 O4 NAG A 2 -51.898 -29.069-142.244 1.00190.43 O
-HETATM 7088 O5 NAG A 2 -48.322 -29.298-141.513 1.00169.75 O
-HETATM 7089 O6 NAG A 2 -48.248 -30.863-143.677 1.00158.77 O
-HETATM 7090 O7 NAG A 2 -49.840 -25.563-138.426 1.00196.04 O
-HETATM 7091 C1 NAG B 1 -25.581 2.342-109.034 1.00158.80 C
-HETATM 7092 C2 NAG B 1 -26.013 3.587-108.282 1.00151.22 C
-HETATM 7093 C3 NAG B 1 -26.176 4.754-109.254 1.00154.46 C
-HETATM 7094 C4 NAG B 1 -24.972 4.900-110.181 1.00163.49 C
-HETATM 7095 C5 NAG B 1 -24.466 3.557-110.713 1.00162.24 C
-HETATM 7096 C6 NAG B 1 -23.088 3.641-111.334 1.00170.27 C
-HETATM 7097 C7 NAG B 1 -27.321 3.324-106.216 1.00139.41 C
-HETATM 7098 C8 NAG B 1 -26.029 3.534-105.482 1.00133.60 C
-HETATM 7099 N2 NAG B 1 -27.250 3.357-107.552 1.00146.38 N
-HETATM 7100 O3 NAG B 1 -26.356 5.956-108.513 1.00151.08 O
-HETATM 7101 O4 NAG B 1 -25.396 5.639-111.321 1.00169.50 O
-HETATM 7102 O5 NAG B 1 -24.372 2.583-109.667 1.00152.32 O
-HETATM 7103 O6 NAG B 1 -23.135 4.122-112.671 1.00176.73 O
-HETATM 7104 O7 NAG B 1 -28.380 3.131-105.627 1.00132.59 O
-HETATM 7105 C1 NAG B 2 -24.671 6.862-111.508 1.00176.51 C
-HETATM 7106 C2 NAG B 2 -25.395 7.649-112.605 1.00176.22 C
-HETATM 7107 C3 NAG B 2 -24.726 9.005-112.822 1.00175.94 C
-HETATM 7108 C4 NAG B 2 -24.588 9.752-111.501 1.00179.43 C
-HETATM 7109 C5 NAG B 2 -23.878 8.871-110.478 1.00177.50 C
-HETATM 7110 C6 NAG B 2 -23.777 9.504-109.110 1.00165.64 C
-HETATM 7111 C7 NAG B 2 -26.560 6.498-114.443 1.00167.22 C
-HETATM 7112 C8 NAG B 2 -26.397 5.727-115.718 1.00160.38 C
-HETATM 7113 N2 NAG B 2 -25.428 6.893-113.848 1.00174.22 N
-HETATM 7114 O3 NAG B 2 -25.498 9.773-113.739 1.00170.42 O
-HETATM 7115 O4 NAG B 2 -23.846 10.951-111.693 1.00178.82 O
-HETATM 7116 O5 NAG B 2 -24.605 7.645-110.317 1.00179.91 O
-HETATM 7117 O6 NAG B 2 -22.768 8.883-108.325 1.00154.90 O
-HETATM 7118 O7 NAG B 2 -27.665 6.752-113.973 1.00163.44 O
-HETATM 7119 C1 FUC B 3 -22.651 3.144-113.626 1.00184.07 C
-HETATM 7120 C2 FUC B 3 -21.115 3.207-113.862 1.00190.17 C
-HETATM 7121 C3 FUC B 3 -20.430 1.925-113.436 1.00188.40 C
-HETATM 7122 C4 FUC B 3 -21.028 0.775-114.228 1.00186.97 C
-HETATM 7123 C5 FUC B 3 -22.524 0.617-113.891 1.00182.20 C
-HETATM 7124 C6 FUC B 3 -23.368 0.117-115.061 1.00179.64 C
-HETATM 7125 O2 FUC B 3 -20.521 4.344-113.237 1.00190.49 O
-HETATM 7126 O3 FUC B 3 -19.040 1.990-113.752 1.00188.65 O
-HETATM 7127 O4 FUC B 3 -20.875 1.012-115.619 1.00185.30 O
-HETATM 7128 O5 FUC B 3 -23.182 1.832-113.374 1.00182.60 O
-HETATM 7129 C1 NAG C 1 -11.963 -15.344-124.565 1.00135.96 C
-HETATM 7130 C2 NAG C 1 -11.582 -13.923-124.964 1.00159.39 C
-HETATM 7131 C3 NAG C 1 -12.859 -13.071-125.042 1.00173.75 C
-HETATM 7132 C4 NAG C 1 -13.971 -13.776-125.822 1.00180.88 C
-HETATM 7133 C5 NAG C 1 -14.063 -15.275-125.513 1.00172.13 C
-HETATM 7134 C6 NAG C 1 -14.925 -16.045-126.488 1.00177.64 C
-HETATM 7135 C7 NAG C 1 -10.022 -12.149-124.274 1.00167.50 C
-HETATM 7136 C8 NAG C 1 -9.058 -11.686-123.224 1.00164.10 C
-HETATM 7137 N2 NAG C 1 -10.620 -13.328-124.046 1.00165.35 N
-HETATM 7138 O3 NAG C 1 -12.573 -11.815-125.649 1.00177.39 O
-HETATM 7139 O4 NAG C 1 -15.224 -13.224-125.433 1.00192.36 O
-HETATM 7140 O5 NAG C 1 -12.769 -15.888-125.538 1.00155.50 O
-HETATM 7141 O6 NAG C 1 -15.028 -15.391-127.745 1.00180.49 O
-HETATM 7142 O7 NAG C 1 -10.251 -11.484-125.284 1.00171.28 O
-HETATM 7143 C1 NAG C 2 -15.851 -12.472-126.482 1.00204.91 C
-HETATM 7144 C2 NAG C 2 -17.299 -12.154-126.041 1.00208.33 C
-HETATM 7145 C3 NAG C 2 -17.980 -11.165-126.996 1.00207.26 C
-HETATM 7146 C4 NAG C 2 -17.092 -9.952-127.233 1.00211.51 C
-HETATM 7147 C5 NAG C 2 -15.710 -10.402-127.692 1.00212.72 C
-HETATM 7148 C6 NAG C 2 -14.748 -9.253-127.890 1.00213.18 C
-HETATM 7149 C7 NAG C 2 -18.514 -14.293-126.682 1.00211.35 C
-HETATM 7150 C8 NAG C 2 -18.068 -14.157-128.114 1.00210.43 C
-HETATM 7151 N2 NAG C 2 -18.121 -13.343-125.806 1.00211.05 N
-HETATM 7152 O3 NAG C 2 -19.224 -10.751-126.442 1.00203.04 O
-HETATM 7153 O4 NAG C 2 -17.669 -9.107-128.222 1.00213.41 O
-HETATM 7154 O5 NAG C 2 -15.133 -11.256-126.696 1.00210.25 O
-HETATM 7155 O6 NAG C 2 -14.380 -8.668-126.649 1.00212.42 O
-HETATM 7156 O7 NAG C 2 -19.210 -15.239-126.321 1.00211.28 O
-HETATM 7157 C1 NAG D 1 1.571 -52.926-107.189 1.00159.99 C
-HETATM 7158 C2 NAG D 1 0.948 -53.566-105.918 1.00144.61 C
-HETATM 7159 C3 NAG D 1 1.223 -52.713-104.646 1.00150.21 C
-HETATM 7160 C4 NAG D 1 2.629 -52.116-104.605 1.00160.18 C
-HETATM 7161 C5 NAG D 1 3.059 -51.597-105.967 1.00155.01 C
-HETATM 7162 C6 NAG D 1 4.517 -51.211-106.023 1.00157.19 C
-HETATM 7163 C7 NAG D 1 -1.502 -52.973-106.235 1.00123.23 C
-HETATM 7164 C8 NAG D 1 -1.172 -51.500-106.289 1.00110.81 C
-HETATM 7165 N2 NAG D 1 -0.481 -53.848-106.070 1.00127.87 N
-HETATM 7166 O3 NAG D 1 0.984 -53.475-103.466 1.00140.13 O
-HETATM 7167 O4 NAG D 1 2.598 -50.938-103.809 1.00178.45 O
-HETATM 7168 O5 NAG D 1 2.882 -52.613-106.947 1.00159.24 O
-HETATM 7169 O6 NAG D 1 5.383 -52.291-105.700 1.00156.65 O
-HETATM 7170 O7 NAG D 1 -2.658 -53.365-106.344 1.00130.58 O
-HETATM 7171 C1 NAG D 2 3.042 -51.106-102.456 1.00205.88 C
-HETATM 7172 C2 NAG D 2 3.555 -49.751-101.961 1.00210.59 C
-HETATM 7173 C3 NAG D 2 3.964 -49.865-100.491 1.00213.52 C
-HETATM 7174 C4 NAG D 2 2.792 -50.366 -99.655 1.00212.79 C
-HETATM 7175 C5 NAG D 2 2.261 -51.686-100.212 1.00220.25 C
-HETATM 7176 C6 NAG D 2 0.985 -52.134 -99.534 1.00209.31 C
-HETATM 7177 C7 NAG D 2 4.544 -48.622-103.935 1.00194.56 C
-HETATM 7178 C8 NAG D 2 5.824 -48.221-104.607 1.00189.02 C
-HETATM 7179 N2 NAG D 2 4.673 -49.278-102.770 1.00205.54 N
-HETATM 7180 O3 NAG D 2 4.448 -48.632 -99.970 1.00211.77 O
-HETATM 7181 O4 NAG D 2 3.198 -50.557 -98.304 1.00203.57 O
-HETATM 7182 O5 NAG D 2 1.956 -51.555-101.611 1.00234.24 O
-HETATM 7183 O6 NAG D 2 0.979 -51.813 -98.149 1.00202.24 O
-HETATM 7184 O7 NAG D 2 3.446 -48.365-104.428 1.00188.95 O
-HETATM 7185 C1 FUC D 3 6.595 -51.682-105.223 1.00150.14 C
-HETATM 7186 C2 FUC D 3 7.309 -52.504-104.126 1.00147.30 C
-HETATM 7187 C3 FUC D 3 8.680 -52.933-104.572 1.00149.81 C
-HETATM 7188 C4 FUC D 3 9.467 -51.698-104.962 1.00154.13 C
-HETATM 7189 C5 FUC D 3 8.831 -51.045-106.198 1.00138.89 C
-HETATM 7190 C6 FUC D 3 9.023 -49.533-106.260 1.00133.55 C
-HETATM 7191 O2 FUC D 3 6.551 -53.638-103.691 1.00131.54 O
-HETATM 7192 O3 FUC D 3 9.346 -53.547-103.477 1.00154.10 O
-HETATM 7193 O4 FUC D 3 9.464 -50.785-103.888 1.00156.29 O
-HETATM 7194 O5 FUC D 3 7.396 -51.307-106.350 1.00135.02 O
-HETATM 7195 C1 NAG M 606 -51.453 -34.072-109.096 1.00157.41 C
-HETATM 7196 C2 NAG M 606 -52.825 -34.294-109.679 1.00173.49 C
-HETATM 7197 C3 NAG M 606 -53.289 -32.997-110.327 1.00180.46 C
-HETATM 7198 C4 NAG M 606 -53.228 -31.838-109.335 1.00181.40 C
-HETATM 7199 C5 NAG M 606 -51.889 -31.781-108.589 1.00174.49 C
-HETATM 7200 C6 NAG M 606 -51.912 -30.846-107.403 1.00169.64 C
-HETATM 7201 C7 NAG M 606 -53.854 -36.243-110.770 1.00167.48 C
-HETATM 7202 C8 NAG M 606 -55.009 -36.026-109.843 1.00166.18 C
-HETATM 7203 N2 NAG M 606 -52.834 -35.382-110.646 1.00174.55 N
-HETATM 7204 O3 NAG M 606 -54.614 -33.135-110.819 1.00178.44 O
-HETATM 7205 O4 NAG M 606 -53.436 -30.606-110.021 1.00183.12 O
-HETATM 7206 O5 NAG M 606 -51.532 -33.073-108.075 1.00167.86 O
-HETATM 7207 O6 NAG M 606 -51.412 -29.563-107.750 1.00167.41 O
-HETATM 7208 O7 NAG M 606 -53.846 -37.155-111.598 1.00160.73 O
-HETATM 7209 C FMT M 612 -31.194 -41.163-153.036 1.00 88.87 C
-HETATM 7210 O1 FMT M 612 -31.624 -42.289-152.788 1.00 81.33 O
-HETATM 7211 O2 FMT M 612 -31.825 -40.124-152.843 1.00 91.22 O
-HETATM 7212 O HOH H 301 -10.753 -11.204 -84.734 1.00 54.28 O
-HETATM 7213 O HOH H 302 -14.265 6.385 -83.153 1.00103.88 O
-HETATM 7214 O HOH H 303 -4.090 -1.997 -94.884 1.00 82.25 O
-HETATM 7215 O HOH H 304 -23.071 -6.612 -64.761 1.00 87.49 O
-HETATM 7216 O HOH H 305 -9.530 -15.353 -47.530 1.00 53.72 O
-HETATM 7217 O HOH H 306 -17.081 -6.245 -74.898 1.00 57.23 O
-HETATM 7218 O HOH H 307 -26.897 -5.397 -67.910 1.00 79.01 O
-HETATM 7219 O HOH H 308 -20.968 -6.654 -63.481 1.00 75.97 O
-HETATM 7220 O HOH H 309 -29.378 -3.806 -68.524 1.00 81.11 O
-HETATM 7221 O HOH L 301 -26.470 -14.621 -76.900 1.00 84.90 O
-HETATM 7222 O HOH L 302 -32.578 -26.252 -49.110 1.00 78.45 O
-HETATM 7223 O HOH L 303 -40.328 -23.055 -77.463 1.00 88.15 O
-HETATM 7224 O HOH L 304 -40.173 -27.752 -46.798 1.00 80.84 O
-HETATM 7225 O HOH L 305 -33.127 -22.770 -43.353 1.00 73.62 O
-HETATM 7226 O HOH L 306 -29.141 -7.846 -58.166 1.00 69.24 O
-HETATM 7227 O HOH L 307 -32.666 -16.326 -76.563 1.00 80.28 O
-HETATM 7228 O HOH L 308 -15.611 -14.878 -84.021 1.00 56.54 O
-HETATM 7229 O HOH L 309 -39.765 -18.235-102.020 1.00 81.97 O
-HETATM 7230 O HOH L 310 -17.465 -26.167 -79.936 1.00 51.79 O
-HETATM 7231 O HOH L 311 -19.067 -9.289 -75.113 1.00 63.58 O
-HETATM 7232 O HOH L 312 -12.672 -21.666 -79.707 1.00 70.83 O
-HETATM 7233 O HOH L 313 -25.011 -14.880 -74.770 1.00 73.09 O
-HETATM 7234 O HOH M 701 -23.691 -54.226-141.796 1.00 99.00 O
-HETATM 7235 O HOH M 702 -25.145 -33.732-121.433 1.00 78.54 O
-HETATM 7236 O HOH M 703 -22.944 -30.260-125.399 1.00 98.01 O
-HETATM 7237 O HOH M 704 -30.425 -22.271-120.963 1.00 80.45 O
-HETATM 7238 O HOH M 705 -5.577 -26.151 -97.147 1.00 77.41 O
-HETATM 7239 O HOH M 706 -15.287 -40.680-146.798 1.00 64.77 O
-HETATM 7240 O HOH M 707 -26.865 -40.240-128.072 1.00 57.14 O
-HETATM 7241 O HOH M 708 -23.381 -34.034-123.644 1.00 75.08 O
-HETATM 7242 O HOH M 709 -34.901 -39.959-149.876 1.00 77.78 O
-HETATM 7243 O HOH M 710 -38.807 -52.254-142.947 1.00 94.71 O
-HETATM 7244 O HOH M 711 -31.617 -32.931-152.216 1.00 92.88 O
-HETATM 7245 O HOH M 712 -28.322 -21.254-141.820 1.00 83.17 O
-HETATM 7246 O HOH M 713 -25.540 -57.394-132.838 1.00 54.96 O
-HETATM 7247 O HOH M 714 -26.926 -48.539-148.490 1.00 68.66 O
-HETATM 7248 O HOH M 715 -43.396 -35.990-150.899 1.00 85.84 O
-HETATM 7249 O HOH M 716 -27.800 -25.068-136.730 1.00 71.37 O
-HETATM 7250 O HOH M 717 -21.199 -35.065-128.953 1.00 75.67 O
-HETATM 7251 O HOH M 718 -29.812 -10.774-125.269 1.00 88.02 O
-HETATM 7252 O HOH M 719 -58.008 -44.516-157.896 1.00 71.55 O
-HETATM 7253 O HOH M 720 -20.440 -32.204-128.915 1.00 76.53 O
-HETATM 7254 O HOH M 721 -21.569 -37.393-129.796 1.00 81.50 O
-HETATM 7255 O HOH M 722 -9.059 -31.532-102.240 1.00 66.33 O
-HETATM 7256 O HOH M 723 -23.258 -38.366-151.095 1.00 58.97 O
-HETATM 7257 O HOH M 724 -34.853 -23.317-138.374 1.00 79.37 O
-HETATM 7258 O HOH M 725 -54.013 -46.258-148.203 1.00 74.96 O
-HETATM 7259 O HOH M 726 -46.961 -44.562-170.816 1.00 75.11 O
-HETATM 7260 O HOH M 727 -45.043 -19.678-123.906 1.00 63.51 O
-HETATM 7261 O HOH M 728 -35.121 -48.649-143.994 1.00 59.68 O
-HETATM 7262 O HOH M 729 -26.194 -40.683-114.836 1.00 75.68 O
-HETATM 7263 O HOH M 730 -23.992 -36.002-151.381 1.00 58.97 O
-CONECT 147 722
-CONECT 722 147
-CONECT 1031 1444
-CONECT 1444 1031
-CONECT 1749 2243
-CONECT 2243 1749
-CONECT 2575 3012
-CONECT 3012 2575
-CONECT 3195 7063
-CONECT 3580 3627
-CONECT 3604 4059
-CONECT 3627 3580
-CONECT 3661 7091
-CONECT 3867 3914
-CONECT 3914 3867
-CONECT 3982 7195
-CONECT 4059 3604
-CONECT 4151 4172
-CONECT 4172 4151
-CONECT 4362 7129
-CONECT 5019 5893
-CONECT 5131 5549
-CONECT 5549 5131
-CONECT 5724 5824
-CONECT 5824 5724
-CONECT 5877 7157
-CONECT 5893 5019
-CONECT 6727 6861
-CONECT 6777 7036
-CONECT 6797 6916
-CONECT 6861 6727
-CONECT 6885 6961
-CONECT 6916 6797
-CONECT 6961 6885
-CONECT 7036 6777
-CONECT 7063 3195 7064 7074
-CONECT 7064 7063 7065 7071
-CONECT 7065 7064 7066 7072
-CONECT 7066 7065 7067 7073
-CONECT 7067 7066 7068 7074
-CONECT 7068 7067 7075
-CONECT 7069 7070 7071 7076
-CONECT 7070 7069
-CONECT 7071 7064 7069
-CONECT 7072 7065
-CONECT 7073 7066 7077
-CONECT 7074 7063 7067
-CONECT 7075 7068
-CONECT 7076 7069
-CONECT 7077 7073 7078 7088
-CONECT 7078 7077 7079 7085
-CONECT 7079 7078 7080 7086
-CONECT 7080 7079 7081 7087
-CONECT 7081 7080 7082 7088
-CONECT 7082 7081 7089
-CONECT 7083 7084 7085 7090
-CONECT 7084 7083
-CONECT 7085 7078 7083
-CONECT 7086 7079
-CONECT 7087 7080
-CONECT 7088 7077 7081
-CONECT 7089 7082
-CONECT 7090 7083
-CONECT 7091 3661 7092 7102
-CONECT 7092 7091 7093 7099
-CONECT 7093 7092 7094 7100
-CONECT 7094 7093 7095 7101
-CONECT 7095 7094 7096 7102
-CONECT 7096 7095 7103
-CONECT 7097 7098 7099 7104
-CONECT 7098 7097
-CONECT 7099 7092 7097
-CONECT 7100 7093
-CONECT 7101 7094 7105
-CONECT 7102 7091 7095
-CONECT 7103 7096 7119
-CONECT 7104 7097
-CONECT 7105 7101 7106 7116
-CONECT 7106 7105 7107 7113
-CONECT 7107 7106 7108 7114
-CONECT 7108 7107 7109 7115
-CONECT 7109 7108 7110 7116
-CONECT 7110 7109 7117
-CONECT 7111 7112 7113 7118
-CONECT 7112 7111
-CONECT 7113 7106 7111
-CONECT 7114 7107
-CONECT 7115 7108
-CONECT 7116 7105 7109
-CONECT 7117 7110
-CONECT 7118 7111
-CONECT 7119 7103 7120 7128
-CONECT 7120 7119 7121 7125
-CONECT 7121 7120 7122 7126
-CONECT 7122 7121 7123 7127
-CONECT 7123 7122 7124 7128
-CONECT 7124 7123
-CONECT 7125 7120
-CONECT 7126 7121
-CONECT 7127 7122
-CONECT 7128 7119 7123
-CONECT 7129 4362 7130 7140
-CONECT 7130 7129 7131 7137
-CONECT 7131 7130 7132 7138
-CONECT 7132 7131 7133 7139
-CONECT 7133 7132 7134 7140
-CONECT 7134 7133 7141
-CONECT 7135 7136 7137 7142
-CONECT 7136 7135
-CONECT 7137 7130 7135
-CONECT 7138 7131
-CONECT 7139 7132 7143
-CONECT 7140 7129 7133
-CONECT 7141 7134
-CONECT 7142 7135
-CONECT 7143 7139 7144 7154
-CONECT 7144 7143 7145 7151
-CONECT 7145 7144 7146 7152
-CONECT 7146 7145 7147 7153
-CONECT 7147 7146 7148 7154
-CONECT 7148 7147 7155
-CONECT 7149 7150 7151 7156
-CONECT 7150 7149
-CONECT 7151 7144 7149
-CONECT 7152 7145
-CONECT 7153 7146
-CONECT 7154 7143 7147
-CONECT 7155 7148
-CONECT 7156 7149
-CONECT 7157 5877 7158 7168
-CONECT 7158 7157 7159 7165
-CONECT 7159 7158 7160 7166
-CONECT 7160 7159 7161 7167
-CONECT 7161 7160 7162 7168
-CONECT 7162 7161 7169
-CONECT 7163 7164 7165 7170
-CONECT 7164 7163
-CONECT 7165 7158 7163
-CONECT 7166 7159
-CONECT 7167 7160 7171
-CONECT 7168 7157 7161
-CONECT 7169 7162 7185
-CONECT 7170 7163
-CONECT 7171 7167 7172 7182
-CONECT 7172 7171 7173 7179
-CONECT 7173 7172 7174 7180
-CONECT 7174 7173 7175 7181
-CONECT 7175 7174 7176 7182
-CONECT 7176 7175 7183
-CONECT 7177 7178 7179 7184
-CONECT 7178 7177
-CONECT 7179 7172 7177
-CONECT 7180 7173
-CONECT 7181 7174
-CONECT 7182 7171 7175
-CONECT 7183 7176
-CONECT 7184 7177
-CONECT 7185 7169 7186 7194
-CONECT 7186 7185 7187 7191
-CONECT 7187 7186 7188 7192
-CONECT 7188 7187 7189 7193
-CONECT 7189 7188 7190 7194
-CONECT 7190 7189
-CONECT 7191 7186
-CONECT 7192 7187
-CONECT 7193 7188
-CONECT 7194 7185 7189
-CONECT 7195 3982 7196 7206
-CONECT 7196 7195 7197 7203
-CONECT 7197 7196 7198 7204
-CONECT 7198 7197 7199 7205
-CONECT 7199 7198 7200 7206
-CONECT 7200 7199 7207
-CONECT 7201 7202 7203 7208
-CONECT 7202 7201
-CONECT 7203 7196 7201
-CONECT 7204 7197
-CONECT 7205 7198
-CONECT 7206 7195 7199
-CONECT 7207 7200
-CONECT 7208 7201
-CONECT 7209 7210 7211
-CONECT 7210 7209
-CONECT 7211 7209
-MASTER 635 0 12 19 81 0 0 6 7255 3 184 77
-END
+ATOM 5 CB GLN H 1 -2.740 -13.608 -86.238 1.00 88.81 C
+ATOM 6 CG GLN H 1 -1.894 -14.678 -85.569 1.00 0.00 C
+ATOM 7 CD GLN H 1 -1.538 -14.324 -84.138 1.00 0.00 C
+ATOM 8 OE1 GLN H 1 -2.304 -13.653 -83.441 1.00 0.00 O
+ATOM 9 NE2 GLN H 1 -0.371 -14.773 -83.691 1.00 0.00 N
+ATOM 10 1H GLN H 1 -1.270 -14.618 -88.170 1.00 0.00 H
+ATOM 11 2H GLN H 1 -2.166 -14.183 -89.464 1.00 0.00 H
+ATOM 12 3H GLN H 1 -1.485 -13.038 -88.521 1.00 0.00 H
+ATOM 13 HA GLN H 1 -3.579 -14.901 -87.731 1.00 0.00 H
+ATOM 14 1HB GLN H 1 -2.190 -12.668 -86.195 1.00 0.00 H
+ATOM 15 2HB GLN H 1 -3.649 -13.482 -85.650 1.00 0.00 H
+ATOM 16 1HG GLN H 1 -2.451 -15.615 -85.561 1.00 0.00 H
+ATOM 17 2HG GLN H 1 -0.968 -14.799 -86.132 1.00 0.00 H
+ATOM 18 1HE2 GLN H 1 -0.082 -14.571 -82.754 1.00 0.00 H
+ATOM 19 2HE2 GLN H 1 0.220 -15.314 -84.290 1.00 0.00 H
+ATOM 20 N VAL H 2 -5.302 -13.378 -88.585 1.00 94.88 N
+ATOM 21 CA VAL H 2 -6.369 -12.524 -89.098 1.00101.27 C
+ATOM 22 C VAL H 2 -7.227 -12.061 -87.927 1.00103.76 C
+ATOM 23 O VAL H 2 -7.884 -12.876 -87.269 1.00113.20 O
+ATOM 24 CB VAL H 2 -7.215 -13.267 -90.141 1.00103.65 C
+ATOM 25 CG1 VAL H 2 -8.301 -12.362 -90.682 1.00 97.73 C
+ATOM 26 CG2 VAL H 2 -6.332 -13.789 -91.265 1.00115.77 C
+ATOM 27 H VAL H 2 -5.458 -14.374 -88.517 1.00 0.00 H
+ATOM 28 HA VAL H 2 -5.917 -11.655 -89.578 1.00 0.00 H
+ATOM 29 HB VAL H 2 -7.716 -14.106 -89.658 1.00 0.00 H
+ATOM 30 1HG1 VAL H 2 -8.892 -12.904 -91.420 1.00 0.00 H
+ATOM 31 2HG1 VAL H 2 -8.947 -12.041 -89.865 1.00 0.00 H
+ATOM 32 3HG1 VAL H 2 -7.847 -11.490 -91.152 1.00 0.00 H
+ATOM 33 1HG2 VAL H 2 -6.946 -14.314 -91.996 1.00 0.00 H
+ATOM 34 2HG2 VAL H 2 -5.826 -12.953 -91.749 1.00 0.00 H
+ATOM 35 3HG2 VAL H 2 -5.590 -14.475 -90.856 1.00 0.00 H
+ATOM 36 N GLN H 3 -7.232 -10.754 -87.668 1.00 96.09 N
+ATOM 37 CA GLN H 3 -7.901 -10.215 -86.492 1.00100.34 C
+ATOM 38 C GLN H 3 -8.688 -8.960 -86.842 1.00 96.55 C
+ATOM 39 O GLN H 3 -8.270 -8.165 -87.690 1.00 91.26 O
+ATOM 40 CB GLN H 3 -6.894 -9.890 -85.377 1.00116.60 C
+ATOM 41 CG GLN H 3 -6.208 -11.109 -84.778 1.00130.43 C
+ATOM 42 CD GLN H 3 -5.107 -10.740 -83.801 1.00136.00 C
+ATOM 43 OE1 GLN H 3 -4.616 -9.611 -83.800 1.00141.61 O
+ATOM 44 NE2 GLN H 3 -4.706 -11.697 -82.970 1.00130.84 N
+ATOM 45 H GLN H 3 -6.762 -10.121 -88.300 1.00 0.00 H
+ATOM 46 HA GLN H 3 -8.597 -10.965 -86.116 1.00 0.00 H
+ATOM 47 1HB GLN H 3 -6.121 -9.228 -85.767 1.00 0.00 H
+ATOM 48 2HB GLN H 3 -7.402 -9.361 -84.571 1.00 0.00 H
+ATOM 49 1HG GLN H 3 -6.949 -11.705 -84.245 1.00 0.00 H
+ATOM 50 2HG GLN H 3 -5.765 -11.696 -85.583 1.00 0.00 H
+ATOM 51 1HE2 GLN H 3 -3.983 -11.511 -82.304 1.00 0.00 H
+ATOM 52 2HE2 GLN H 3 -5.127 -12.603 -83.010 1.00 0.00 H
+ATOM 53 N LEU H 4 -9.828 -8.796 -86.173 1.00 99.29 N
+ATOM 54 CA LEU H 4 -10.626 -7.575 -86.219 1.00 96.29 C
+ATOM 55 C LEU H 4 -10.635 -6.970 -84.823 1.00 97.87 C
+ATOM 56 O LEU H 4 -11.003 -7.645 -83.855 1.00101.20 O
+ATOM 57 CB LEU H 4 -12.054 -7.854 -86.691 1.00 86.41 C
+ATOM 58 CG LEU H 4 -12.283 -8.095 -88.185 1.00 81.21 C
+ATOM 59 CD1 LEU H 4 -11.822 -9.486 -88.596 1.00 91.15 C
+ATOM 60 CD2 LEU H 4 -13.746 -7.891 -88.535 1.00 65.17 C
+ATOM 61 H LEU H 4 -10.145 -9.570 -85.606 1.00 0.00 H
+ATOM 62 HA LEU H 4 -10.164 -6.887 -86.926 1.00 0.00 H
+ATOM 63 1HB LEU H 4 -12.424 -8.739 -86.175 1.00 0.00 H
+ATOM 64 2HB LEU H 4 -12.683 -7.008 -86.414 1.00 0.00 H
+ATOM 65 HG LEU H 4 -11.679 -7.396 -88.763 1.00 0.00 H
+ATOM 66 1HD1 LEU H 4 -11.997 -9.627 -89.663 1.00 0.00 H
+ATOM 67 2HD1 LEU H 4 -10.758 -9.593 -88.387 1.00 0.00 H
+ATOM 68 3HD1 LEU H 4 -12.380 -10.235 -88.035 1.00 0.00 H
+ATOM 69 1HD2 LEU H 4 -13.893 -8.065 -89.601 1.00 0.00 H
+ATOM 70 2HD2 LEU H 4 -14.358 -8.591 -87.965 1.00 0.00 H
+ATOM 71 3HD2 LEU H 4 -14.040 -6.870 -88.290 1.00 0.00 H
+ATOM 72 N VAL H 5 -10.232 -5.707 -84.720 1.00 95.61 N
+ATOM 73 CA VAL H 5 -10.069 -5.022 -83.440 1.00 86.36 C
+ATOM 74 C VAL H 5 -10.929 -3.768 -83.456 1.00 89.81 C
+ATOM 75 O VAL H 5 -10.628 -2.808 -84.179 1.00102.77 O
+ATOM 76 CB VAL H 5 -8.604 -4.670 -83.161 1.00 75.58 C
+ATOM 77 CG1 VAL H 5 -8.500 -3.876 -81.880 1.00 71.33 C
+ATOM 78 CG2 VAL H 5 -7.764 -5.935 -83.077 1.00 78.84 C
+ATOM 79 H VAL H 5 -10.032 -5.207 -85.574 1.00 0.00 H
+ATOM 80 HA VAL H 5 -10.412 -5.686 -82.646 1.00 0.00 H
+ATOM 81 HB VAL H 5 -8.230 -4.042 -83.970 1.00 0.00 H
+ATOM 82 1HG1 VAL H 5 -7.455 -3.629 -81.689 1.00 0.00 H
+ATOM 83 2HG1 VAL H 5 -9.078 -2.957 -81.974 1.00 0.00 H
+ATOM 84 3HG1 VAL H 5 -8.890 -4.468 -81.052 1.00 0.00 H
+ATOM 85 1HG2 VAL H 5 -6.726 -5.670 -82.879 1.00 0.00 H
+ATOM 86 2HG2 VAL H 5 -8.137 -6.567 -82.271 1.00 0.00 H
+ATOM 87 3HG2 VAL H 5 -7.826 -6.477 -84.021 1.00 0.00 H
+ATOM 88 N GLN H 6 -11.987 -3.765 -82.653 1.00 78.13 N
+ATOM 89 CA GLN H 6 -12.877 -2.619 -82.577 1.00 79.96 C
+ATOM 90 C GLN H 6 -12.356 -1.605 -81.563 1.00 94.43 C
+ATOM 91 O GLN H 6 -11.422 -1.865 -80.802 1.00 99.15 O
+ATOM 92 CB GLN H 6 -14.294 -3.061 -82.213 1.00 72.96 C
+ATOM 93 CG GLN H 6 -14.892 -4.077 -83.164 1.00 78.68 C
+ATOM 94 CD GLN H 6 -16.355 -4.349 -82.880 1.00 87.09 C
+ATOM 95 OE1 GLN H 6 -16.914 -5.345 -83.341 1.00 92.14 O
+ATOM 96 NE2 GLN H 6 -16.987 -3.460 -82.122 1.00 83.34 N
+ATOM 97 H GLN H 6 -12.179 -4.576 -82.082 1.00 0.00 H
+ATOM 98 HA GLN H 6 -12.904 -2.137 -83.554 1.00 0.00 H
+ATOM 99 1HB GLN H 6 -14.294 -3.496 -81.213 1.00 0.00 H
+ATOM 100 2HB GLN H 6 -14.952 -2.192 -82.192 1.00 0.00 H
+ATOM 101 1HG GLN H 6 -14.807 -3.699 -84.183 1.00 0.00 H
+ATOM 102 2HG GLN H 6 -14.346 -5.015 -83.067 1.00 0.00 H
+ATOM 103 1HE2 GLN H 6 -17.955 -3.588 -81.901 1.00 0.00 H
+ATOM 104 2HE2 GLN H 6 -16.496 -2.662 -81.771 1.00 0.00 H
+ATOM 105 N SER H 7 -12.985 -0.433 -81.555 1.00 98.60 N
+ATOM 106 CA SER H 7 -12.590 0.647 -80.662 1.00106.30 C
+ATOM 107 C SER H 7 -13.059 0.337 -79.241 1.00122.83 C
+ATOM 108 O SER H 7 -13.429 -0.793 -78.911 1.00131.03 O
+ATOM 109 CB SER H 7 -13.141 1.977 -81.170 1.00102.85 C
+ATOM 110 OG SER H 7 -14.556 2.000 -81.109 1.00100.06 O
+ATOM 111 H SER H 7 -13.759 -0.290 -82.188 1.00 0.00 H
+ATOM 112 HA SER H 7 -11.501 0.701 -80.645 1.00 0.00 H
+ATOM 113 1HB SER H 7 -12.736 2.791 -80.570 1.00 0.00 H
+ATOM 114 2HB SER H 7 -12.817 2.136 -82.198 1.00 0.00 H
+ATOM 115 HG SER H 7 -14.819 1.148 -80.753 1.00 0.00 H
+ATOM 116 N GLY H 8 -13.040 1.348 -78.372 1.00120.59 N
+ATOM 117 CA GLY H 8 -13.467 1.163 -77.002 1.00114.26 C
+ATOM 118 C GLY H 8 -14.955 1.386 -76.823 1.00106.21 C
+ATOM 119 O GLY H 8 -15.668 1.767 -77.750 1.00110.06 O
+ATOM 120 H GLY H 8 -12.723 2.260 -78.670 1.00 0.00 H
+ATOM 121 1HA GLY H 8 -13.217 0.153 -76.676 1.00 0.00 H
+ATOM 122 2HA GLY H 8 -12.924 1.852 -76.356 1.00 0.00 H
+ATOM 123 N ALA H 9 -15.419 1.130 -75.602 1.00 97.23 N
+ATOM 124 CA ALA H 9 -16.812 1.369 -75.266 1.00 90.37 C
+ATOM 125 C ALA H 9 -17.076 2.867 -75.145 1.00 77.22 C
+ATOM 126 O ALA H 9 -16.166 3.669 -74.921 1.00 80.25 O
+ATOM 127 CB ALA H 9 -17.183 0.657 -73.967 1.00 74.38 C
+ATOM 128 H ALA H 9 -14.798 0.764 -74.894 1.00 0.00 H
+ATOM 129 HA ALA H 9 -17.428 0.971 -76.072 1.00 0.00 H
+ATOM 130 1HB ALA H 9 -18.230 0.849 -73.733 1.00 0.00 H
+ATOM 131 2HB ALA H 9 -17.028 -0.416 -74.083 1.00 0.00 H
+ATOM 132 3HB ALA H 9 -16.557 1.029 -73.157 1.00 0.00 H
+ATOM 133 N GLU H 10 -18.343 3.243 -75.303 1.00 81.08 N
+ATOM 134 CA GLU H 10 -18.710 4.651 -75.314 1.00 94.30 C
+ATOM 135 C GLU H 10 -20.088 4.834 -74.694 1.00 90.52 C
+ATOM 136 O GLU H 10 -20.964 3.968 -74.802 1.00 93.57 O
+ATOM 137 CB GLU H 10 -18.682 5.230 -76.739 1.00 96.75 C
+ATOM 138 CG GLU H 10 -17.270 5.431 -77.284 1.00113.34 C
+ATOM 139 CD GLU H 10 -17.240 5.939 -78.710 1.00126.15 C
+ATOM 140 OE1 GLU H 10 -18.319 6.237 -79.258 1.00132.71 O
+ATOM 141 OE2 GLU H 10 -16.135 6.024 -79.290 1.00128.07 O
+ATOM 142 H GLU H 10 -19.065 2.546 -75.417 1.00 0.00 H
+ATOM 143 HA GLU H 10 -17.988 5.201 -74.710 1.00 0.00 H
+ATOM 144 1HB GLU H 10 -19.219 4.563 -77.413 1.00 0.00 H
+ATOM 145 2HB GLU H 10 -19.196 6.191 -76.751 1.00 0.00 H
+ATOM 146 1HG GLU H 10 -16.746 6.146 -76.651 1.00 0.00 H
+ATOM 147 2HG GLU H 10 -16.735 4.484 -77.235 1.00 0.00 H
+ATOM 148 N VAL H 11 -20.264 5.978 -74.041 1.00 87.75 N
+ATOM 149 CA VAL H 11 -21.534 6.375 -73.448 1.00 87.61 C
+ATOM 150 C VAL H 11 -21.925 7.723 -74.040 1.00 82.29 C
+ATOM 151 O VAL H 11 -21.100 8.641 -74.106 1.00 85.27 O
+ATOM 152 CB VAL H 11 -21.450 6.435 -71.909 1.00 86.15 C
+ATOM 153 CG1 VAL H 11 -20.226 7.220 -71.459 1.00 93.55 C
+ATOM 154 CG2 VAL H 11 -22.720 7.027 -71.320 1.00 86.86 C
+ATOM 155 H VAL H 11 -19.468 6.595 -73.959 1.00 0.00 H
+ATOM 156 HA VAL H 11 -22.288 5.634 -73.717 1.00 0.00 H
+ATOM 157 HB VAL H 11 -21.316 5.425 -71.522 1.00 0.00 H
+ATOM 158 1HG1 VAL H 11 -20.191 7.247 -70.370 1.00 0.00 H
+ATOM 159 2HG1 VAL H 11 -19.325 6.738 -71.839 1.00 0.00 H
+ATOM 160 3HG1 VAL H 11 -20.285 8.238 -71.844 1.00 0.00 H
+ATOM 161 1HG2 VAL H 11 -22.637 7.058 -70.234 1.00 0.00 H
+ATOM 162 2HG2 VAL H 11 -22.862 8.038 -71.703 1.00 0.00 H
+ATOM 163 3HG2 VAL H 11 -23.574 6.410 -71.601 1.00 0.00 H
+ATOM 164 N LYS H 12 -23.174 7.830 -74.490 1.00 80.66 N
+ATOM 165 CA LYS H 12 -23.678 9.023 -75.153 1.00 85.03 C
+ATOM 166 C LYS H 12 -25.029 9.415 -74.572 1.00 85.13 C
+ATOM 167 O LYS H 12 -25.766 8.577 -74.045 1.00 81.98 O
+ATOM 168 CB LYS H 12 -23.819 8.810 -76.672 1.00 80.36 C
+ATOM 169 CG LYS H 12 -22.551 8.356 -77.375 1.00 80.31 C
+ATOM 170 CD LYS H 12 -21.484 9.441 -77.364 1.00 88.00 C
+ATOM 171 CE LYS H 12 -20.259 9.016 -78.160 1.00 96.11 C
+ATOM 172 NZ LYS H 12 -19.174 10.037 -78.155 1.00 88.93 N
+ATOM 173 H LYS H 12 -23.791 7.041 -74.360 1.00 0.00 H
+ATOM 174 HA LYS H 12 -22.969 9.836 -74.989 1.00 0.00 H
+ATOM 175 1HB LYS H 12 -24.589 8.062 -76.865 1.00 0.00 H
+ATOM 176 2HB LYS H 12 -24.141 9.740 -77.141 1.00 0.00 H
+ATOM 177 1HG LYS H 12 -22.156 7.469 -76.877 1.00 0.00 H
+ATOM 178 2HG LYS H 12 -22.780 8.099 -78.409 1.00 0.00 H
+ATOM 179 1HD LYS H 12 -21.891 10.356 -77.797 1.00 0.00 H
+ATOM 180 2HD LYS H 12 -21.186 9.647 -76.336 1.00 0.00 H
+ATOM 181 1HE LYS H 12 -19.858 8.092 -77.745 1.00 0.00 H
+ATOM 182 2HE LYS H 12 -20.544 8.830 -79.195 1.00 0.00 H
+ATOM 183 1HZ LYS H 12 -18.391 9.700 -78.697 1.00 0.00 H
+ATOM 184 2HZ LYS H 12 -19.518 10.897 -78.559 1.00 0.00 H
+ATOM 185 3HZ LYS H 12 -18.876 10.208 -77.205 1.00 0.00 H
+ATOM 186 N LYS H 13 -25.348 10.707 -74.677 1.00 84.36 N
+ATOM 187 CA LYS H 13 -26.678 11.123 -74.268 1.00 84.25 C
+ATOM 188 C LYS H 13 -27.654 10.991 -75.435 1.00114.11 C
+ATOM 189 O LYS H 13 -27.245 11.032 -76.600 1.00120.14 O
+ATOM 190 CB LYS H 13 -26.657 12.561 -73.747 1.00 88.00 C
+ATOM 191 CG LYS H 13 -25.849 12.756 -72.471 1.00 0.00 C
+ATOM 192 CD LYS H 13 -25.900 14.202 -72.000 1.00 0.00 C
+ATOM 193 CE LYS H 13 -25.094 14.398 -70.725 1.00 0.00 C
+ATOM 194 NZ LYS H 13 -25.122 15.812 -70.261 1.00 0.00 N
+ATOM 195 H LYS H 13 -24.702 11.400 -75.028 1.00 0.00 H
+ATOM 196 HA LYS H 13 -27.006 10.480 -73.450 1.00 0.00 H
+ATOM 197 1HB LYS H 13 -26.241 13.219 -74.511 1.00 0.00 H
+ATOM 198 2HB LYS H 13 -27.677 12.892 -73.551 1.00 0.00 H
+ATOM 199 1HG LYS H 13 -26.247 12.112 -71.686 1.00 0.00 H
+ATOM 200 2HG LYS H 13 -24.811 12.479 -72.652 1.00 0.00 H
+ATOM 201 1HD LYS H 13 -25.499 14.853 -72.778 1.00 0.00 H
+ATOM 202 2HD LYS H 13 -26.935 14.486 -71.811 1.00 0.00 H
+ATOM 203 1HE LYS H 13 -25.497 13.763 -69.938 1.00 0.00 H
+ATOM 204 2HE LYS H 13 -24.058 14.108 -70.901 1.00 0.00 H
+ATOM 205 1HZ LYS H 13 -24.576 15.900 -69.416 1.00 0.00 H
+ATOM 206 2HZ LYS H 13 -24.732 16.410 -70.977 1.00 0.00 H
+ATOM 207 3HZ LYS H 13 -26.075 16.087 -70.076 1.00 0.00 H
+ATOM 208 N PRO H 14 -28.945 10.811 -75.151 1.00 98.28 N
+ATOM 209 CA PRO H 14 -29.928 10.707 -76.235 1.00 85.06 C
+ATOM 210 C PRO H 14 -29.891 11.924 -77.146 1.00 90.88 C
+ATOM 211 O PRO H 14 -29.620 13.047 -76.714 1.00 91.47 O
+ATOM 212 CB PRO H 14 -31.264 10.604 -75.493 1.00 78.67 C
+ATOM 213 CG PRO H 14 -30.907 10.004 -74.181 1.00 92.51 C
+ATOM 214 CD PRO H 14 -29.551 10.555 -73.833 1.00102.35 C
+ATOM 215 HA PRO H 14 -29.732 9.793 -76.815 1.00 0.00 H
+ATOM 216 1HB PRO H 14 -31.719 11.601 -75.397 1.00 0.00 H
+ATOM 217 2HB PRO H 14 -31.967 9.984 -76.069 1.00 0.00 H
+ATOM 218 1HG PRO H 14 -31.663 10.265 -73.426 1.00 0.00 H
+ATOM 219 2HG PRO H 14 -30.898 8.907 -74.255 1.00 0.00 H
+ATOM 220 1HD PRO H 14 -29.669 11.482 -73.253 1.00 0.00 H
+ATOM 221 2HD PRO H 14 -28.987 9.806 -73.257 1.00 0.00 H
+ATOM 222 N GLY H 15 -30.162 11.683 -78.430 1.00 90.27 N
+ATOM 223 CA GLY H 15 -30.119 12.708 -79.445 1.00 82.50 C
+ATOM 224 C GLY H 15 -28.778 12.858 -80.138 1.00 97.45 C
+ATOM 225 O GLY H 15 -28.736 13.284 -81.297 1.00102.13 O
+ATOM 226 H GLY H 15 -30.407 10.739 -78.694 1.00 0.00 H
+ATOM 227 1HA GLY H 15 -30.868 12.496 -80.208 1.00 0.00 H
+ATOM 228 2HA GLY H 15 -30.375 13.670 -79.002 1.00 0.00 H
+ATOM 229 N ALA H 16 -27.683 12.522 -79.458 1.00100.91 N
+ATOM 230 CA ALA H 16 -26.351 12.633 -80.034 1.00 98.13 C
+ATOM 231 C ALA H 16 -26.070 11.444 -80.945 1.00 98.86 C
+ATOM 232 O ALA H 16 -26.922 10.584 -81.175 1.00 99.61 O
+ATOM 233 CB ALA H 16 -25.297 12.730 -78.935 1.00 97.79 C
+ATOM 234 H ALA H 16 -27.783 12.180 -78.513 1.00 0.00 H
+ATOM 235 HA ALA H 16 -26.316 13.542 -80.635 1.00 0.00 H
+ATOM 236 1HB ALA H 16 -24.308 12.812 -79.386 1.00 0.00 H
+ATOM 237 2HB ALA H 16 -25.491 13.610 -78.322 1.00 0.00 H
+ATOM 238 3HB ALA H 16 -25.338 11.838 -78.312 1.00 0.00 H
+ATOM 239 N SER H 17 -24.850 11.389 -81.463 1.00100.13 N
+ATOM 240 CA SER H 17 -24.427 10.333 -82.367 1.00101.08 C
+ATOM 241 C SER H 17 -23.196 9.633 -81.808 1.00106.30 C
+ATOM 242 O SER H 17 -22.547 10.108 -80.871 1.00120.81 O
+ATOM 243 CB SER H 17 -24.127 10.889 -83.764 1.00100.23 C
+ATOM 244 OG SER H 17 -22.980 11.716 -83.737 1.00109.52 O
+ATOM 245 H SER H 17 -24.194 12.115 -81.214 1.00 0.00 H
+ATOM 246 HA SER H 17 -25.236 9.606 -82.453 1.00 0.00 H
+ATOM 247 1HB SER H 17 -23.971 10.064 -84.458 1.00 0.00 H
+ATOM 248 2HB SER H 17 -24.984 11.458 -84.120 1.00 0.00 H
+ATOM 249 HG SER H 17 -22.676 11.717 -82.826 1.00 0.00 H
+ATOM 250 N VAL H 18 -22.881 8.489 -82.408 1.00 97.73 N
+ATOM 251 CA VAL H 18 -21.742 7.676 -82.002 1.00 93.59 C
+ATOM 252 C VAL H 18 -21.055 7.154 -83.256 1.00 88.24 C
+ATOM 253 O VAL H 18 -21.716 6.826 -84.248 1.00 77.22 O
+ATOM 254 CB VAL H 18 -22.183 6.522 -81.078 1.00 86.81 C
+ATOM 255 CG1 VAL H 18 -23.291 5.712 -81.727 1.00 73.22 C
+ATOM 256 CG2 VAL H 18 -21.011 5.631 -80.736 1.00 86.88 C
+ATOM 257 H VAL H 18 -23.459 8.178 -83.175 1.00 0.00 H
+ATOM 258 HA VAL H 18 -21.044 8.308 -81.452 1.00 0.00 H
+ATOM 259 HB VAL H 18 -22.592 6.941 -80.159 1.00 0.00 H
+ATOM 260 1HG1 VAL H 18 -23.589 4.903 -81.060 1.00 0.00 H
+ATOM 261 2HG1 VAL H 18 -24.148 6.357 -81.919 1.00 0.00 H
+ATOM 262 3HG1 VAL H 18 -22.932 5.293 -82.667 1.00 0.00 H
+ATOM 263 1HG2 VAL H 18 -21.345 4.825 -80.083 1.00 0.00 H
+ATOM 264 2HG2 VAL H 18 -20.596 5.209 -81.651 1.00 0.00 H
+ATOM 265 3HG2 VAL H 18 -20.245 6.216 -80.226 1.00 0.00 H
+ATOM 266 N LYS H 19 -19.724 7.095 -83.221 1.00 90.63 N
+ATOM 267 CA LYS H 19 -18.933 6.587 -84.338 1.00 91.04 C
+ATOM 268 C LYS H 19 -17.975 5.525 -83.816 1.00 93.13 C
+ATOM 269 O LYS H 19 -17.065 5.831 -83.038 1.00101.67 O
+ATOM 270 CB LYS H 19 -18.177 7.712 -85.044 1.00 90.62 C
+ATOM 271 CG LYS H 19 -17.401 7.249 -86.268 1.00 90.73 C
+ATOM 272 CD LYS H 19 -17.019 8.410 -87.172 1.00 87.22 C
+ATOM 273 CE LYS H 19 -16.345 7.911 -88.442 1.00102.70 C
+ATOM 274 NZ LYS H 19 -16.068 9.001 -89.418 1.00109.95 N
+ATOM 275 H LYS H 19 -19.251 7.415 -82.388 1.00 0.00 H
+ATOM 276 HA LYS H 19 -19.609 6.126 -85.059 1.00 0.00 H
+ATOM 277 1HB LYS H 19 -18.881 8.483 -85.357 1.00 0.00 H
+ATOM 278 2HB LYS H 19 -17.475 8.172 -84.348 1.00 0.00 H
+ATOM 279 1HG LYS H 19 -16.490 6.740 -85.951 1.00 0.00 H
+ATOM 280 2HG LYS H 19 -18.008 6.547 -86.839 1.00 0.00 H
+ATOM 281 1HD LYS H 19 -17.914 8.974 -87.438 1.00 0.00 H
+ATOM 282 2HD LYS H 19 -16.336 9.074 -86.642 1.00 0.00 H
+ATOM 283 1HE LYS H 19 -15.401 7.431 -88.188 1.00 0.00 H
+ATOM 284 2HE LYS H 19 -16.984 7.173 -88.927 1.00 0.00 H
+ATOM 285 1HZ LYS H 19 -15.623 8.614 -90.238 1.00 0.00 H
+ATOM 286 2HZ LYS H 19 -16.936 9.444 -89.684 1.00 0.00 H
+ATOM 287 3HZ LYS H 19 -15.457 9.685 -88.995 1.00 0.00 H
+ATOM 288 N VAL H 20 -18.181 4.285 -84.255 1.00 87.44 N
+ATOM 289 CA VAL H 20 -17.388 3.129 -83.856 1.00 86.91 C
+ATOM 290 C VAL H 20 -16.466 2.743 -85.002 1.00 95.52 C
+ATOM 291 O VAL H 20 -16.883 2.716 -86.168 1.00106.47 O
+ATOM 292 CB VAL H 20 -18.302 1.952 -83.465 1.00 84.00 C
+ATOM 293 CG1 VAL H 20 -17.480 0.732 -83.083 1.00 88.80 C
+ATOM 294 CG2 VAL H 20 -19.227 2.360 -82.329 1.00 83.77 C
+ATOM 295 H VAL H 20 -18.942 4.158 -84.907 1.00 0.00 H
+ATOM 296 HA VAL H 20 -16.787 3.405 -82.989 1.00 0.00 H
+ATOM 297 HB VAL H 20 -18.898 1.664 -84.331 1.00 0.00 H
+ATOM 298 1HG1 VAL H 20 -18.148 -0.086 -82.811 1.00 0.00 H
+ATOM 299 2HG1 VAL H 20 -16.863 0.430 -83.929 1.00 0.00 H
+ATOM 300 3HG1 VAL H 20 -16.841 0.975 -82.234 1.00 0.00 H
+ATOM 301 1HG2 VAL H 20 -19.868 1.520 -82.062 1.00 0.00 H
+ATOM 302 2HG2 VAL H 20 -18.633 2.653 -81.463 1.00 0.00 H
+ATOM 303 3HG2 VAL H 20 -19.844 3.201 -82.646 1.00 0.00 H
+ATOM 304 N SER H 21 -15.212 2.438 -84.675 1.00 91.50 N
+ATOM 305 CA SER H 21 -14.222 2.021 -85.656 1.00 85.92 C
+ATOM 306 C SER H 21 -13.892 0.542 -85.488 1.00 87.90 C
+ATOM 307 O SER H 21 -14.087 -0.048 -84.422 1.00 89.03 O
+ATOM 308 CB SER H 21 -12.945 2.862 -85.541 1.00 86.99 C
+ATOM 309 OG SER H 21 -12.332 2.699 -84.277 1.00 97.63 O
+ATOM 310 H SER H 21 -14.945 2.501 -83.703 1.00 0.00 H
+ATOM 311 HA SER H 21 -14.640 2.166 -86.653 1.00 0.00 H
+ATOM 312 1HB SER H 21 -12.245 2.570 -86.324 1.00 0.00 H
+ATOM 313 2HB SER H 21 -13.187 3.913 -85.694 1.00 0.00 H
+ATOM 314 HG SER H 21 -12.886 2.083 -83.792 1.00 0.00 H
+ATOM 315 N CYS H 22 -13.378 -0.050 -86.569 1.00 94.89 N
+ATOM 316 CA CYS H 22 -13.069 -1.480 -86.604 1.00 93.39 C
+ATOM 317 C CYS H 22 -11.858 -1.669 -87.514 1.00 91.80 C
+ATOM 318 O CYS H 22 -11.998 -1.685 -88.741 1.00 95.47 O
+ATOM 319 CB CYS H 22 -14.267 -2.280 -87.093 1.00 90.02 C
+ATOM 320 SG CYS H 22 -14.041 -4.068 -87.163 1.00 94.35 S
+ATOM 321 H CYS H 22 -13.198 0.512 -87.388 1.00 0.00 H
+ATOM 322 HA CYS H 22 -12.825 -1.806 -85.593 1.00 0.00 H
+ATOM 323 1HB CYS H 22 -15.121 -2.090 -86.443 1.00 0.00 H
+ATOM 324 2HB CYS H 22 -14.539 -1.951 -88.096 1.00 0.00 H
+ATOM 325 N GLU H 23 -10.681 -1.810 -86.909 1.00 86.45 N
+ATOM 326 CA GLU H 23 -9.438 -1.968 -87.654 1.00 81.35 C
+ATOM 327 C GLU H 23 -9.177 -3.452 -87.883 1.00 87.17 C
+ATOM 328 O GLU H 23 -9.080 -4.226 -86.924 1.00 84.70 O
+ATOM 329 CB GLU H 23 -8.266 -1.330 -86.905 1.00 76.40 C
+ATOM 330 CG GLU H 23 -6.935 -1.404 -87.640 1.00 0.00 C
+ATOM 331 CD GLU H 23 -5.808 -0.769 -86.874 1.00 0.00 C
+ATOM 332 OE1 GLU H 23 -6.051 -0.267 -85.803 1.00 0.00 O
+ATOM 333 OE2 GLU H 23 -4.702 -0.785 -87.361 1.00 0.00 O
+ATOM 334 H GLU H 23 -10.652 -1.807 -85.899 1.00 0.00 H
+ATOM 335 HA GLU H 23 -9.548 -1.473 -88.620 1.00 0.00 H
+ATOM 336 1HB GLU H 23 -8.485 -0.279 -86.714 1.00 0.00 H
+ATOM 337 2HB GLU H 23 -8.142 -1.820 -85.939 1.00 0.00 H
+ATOM 338 1HG GLU H 23 -6.690 -2.450 -87.822 1.00 0.00 H
+ATOM 339 2HG GLU H 23 -7.037 -0.910 -88.605 1.00 0.00 H
+ATOM 340 N THR H 24 -9.068 -3.846 -89.148 1.00 91.96 N
+ATOM 341 CA THR H 24 -8.877 -5.237 -89.525 1.00 92.00 C
+ATOM 342 C THR H 24 -7.448 -5.457 -90.000 1.00102.61 C
+ATOM 343 O THR H 24 -6.783 -4.531 -90.473 1.00104.78 O
+ATOM 344 CB THR H 24 -9.852 -5.646 -90.632 1.00 94.90 C
+ATOM 345 OG1 THR H 24 -9.413 -5.097 -91.880 1.00 98.45 O
+ATOM 346 CG2 THR H 24 -11.246 -5.122 -90.330 1.00 98.68 C
+ATOM 347 H THR H 24 -9.121 -3.143 -89.871 1.00 0.00 H
+ATOM 348 HA THR H 24 -9.067 -5.861 -88.652 1.00 0.00 H
+ATOM 349 HB THR H 24 -9.885 -6.733 -90.704 1.00 0.00 H
+ATOM 350 HG1 THR H 24 -8.606 -4.596 -91.742 1.00 0.00 H
+ATOM 351 1HG2 THR H 24 -11.928 -5.421 -91.126 1.00 0.00 H
+ATOM 352 2HG2 THR H 24 -11.592 -5.533 -89.382 1.00 0.00 H
+ATOM 353 3HG2 THR H 24 -11.220 -4.035 -90.265 1.00 0.00 H
+ATOM 354 N SER H 25 -6.979 -6.697 -89.870 1.00104.28 N
+ATOM 355 CA SER H 25 -5.648 -7.053 -90.341 1.00106.87 C
+ATOM 356 C SER H 25 -5.601 -8.546 -90.626 1.00109.28 C
+ATOM 357 O SER H 25 -6.357 -9.327 -90.043 1.00109.81 O
+ATOM 358 CB SER H 25 -4.565 -6.677 -89.323 1.00112.09 C
+ATOM 359 OG SER H 25 -4.487 -5.273 -89.151 1.00123.98 O
+ATOM 360 H SER H 25 -7.554 -7.406 -89.438 1.00 0.00 H
+ATOM 361 HA SER H 25 -5.449 -6.505 -91.263 1.00 0.00 H
+ATOM 362 1HB SER H 25 -4.786 -7.149 -88.366 1.00 0.00 H
+ATOM 363 2HB SER H 25 -3.601 -7.056 -89.660 1.00 0.00 H
+ATOM 364 HG SER H 25 -5.152 -4.898 -89.733 1.00 0.00 H
+ATOM 365 N GLY H 26 -4.702 -8.930 -91.530 1.00110.40 N
+ATOM 366 CA GLY H 26 -4.461 -10.326 -91.836 1.00109.33 C
+ATOM 367 C GLY H 26 -4.939 -10.784 -93.196 1.00104.38 C
+ATOM 368 O GLY H 26 -4.785 -11.969 -93.516 1.00 98.62 O
+ATOM 369 H GLY H 26 -4.172 -8.221 -92.017 1.00 0.00 H
+ATOM 370 1HA GLY H 26 -3.392 -10.532 -91.778 1.00 0.00 H
+ATOM 371 2HA GLY H 26 -4.949 -10.951 -91.090 1.00 0.00 H
+ATOM 372 N TYR H 27 -5.509 -9.900 -94.008 1.00101.24 N
+ATOM 373 CA TYR H 27 -5.994 -10.292 -95.323 1.00106.63 C
+ATOM 374 C TYR H 27 -6.068 -9.057 -96.209 1.00106.12 C
+ATOM 375 O TYR H 27 -5.989 -7.921 -95.736 1.00113.89 O
+ATOM 376 CB TYR H 27 -7.358 -10.986 -95.231 1.00109.01 C
+ATOM 377 CG TYR H 27 -8.450 -10.147 -94.602 1.00106.40 C
+ATOM 378 CD1 TYR H 27 -8.687 -10.192 -93.237 1.00 99.48 C
+ATOM 379 CD2 TYR H 27 -9.247 -9.315 -95.375 1.00117.22 C
+ATOM 380 CE1 TYR H 27 -9.686 -9.431 -92.657 1.00 99.04 C
+ATOM 381 CE2 TYR H 27 -10.245 -8.547 -94.806 1.00116.23 C
+ATOM 382 CZ TYR H 27 -10.462 -8.609 -93.448 1.00104.43 C
+ATOM 383 OH TYR H 27 -11.457 -7.846 -92.883 1.00 98.17 O
+ATOM 384 H TYR H 27 -5.610 -8.939 -93.713 1.00 0.00 H
+ATOM 385 HA TYR H 27 -5.283 -10.994 -95.759 1.00 0.00 H
+ATOM 386 1HB TYR H 27 -7.690 -11.270 -96.231 1.00 0.00 H
+ATOM 387 2HB TYR H 27 -7.262 -11.900 -94.646 1.00 0.00 H
+ATOM 388 HD1 TYR H 27 -8.081 -10.836 -92.599 1.00 0.00 H
+ATOM 389 HD2 TYR H 27 -9.092 -9.259 -96.453 1.00 0.00 H
+ATOM 390 HE1 TYR H 27 -9.855 -9.482 -91.582 1.00 0.00 H
+ATOM 391 HE2 TYR H 27 -10.856 -7.897 -95.432 1.00 0.00 H
+ATOM 392 HH TYR H 27 -11.896 -7.336 -93.568 1.00 0.00 H
+ATOM 393 N THR H 28 -6.210 -9.298 -97.510 1.00 97.99 N
+ATOM 394 CA THR H 28 -6.472 -8.210 -98.442 1.00105.14 C
+ATOM 395 C THR H 28 -7.846 -7.625 -98.140 1.00 98.20 C
+ATOM 396 O THR H 28 -8.862 -8.323 -98.224 1.00 90.63 O
+ATOM 397 CB THR H 28 -6.390 -8.700 -99.886 1.00112.52 C
+ATOM 398 OG1 THR H 28 -7.307 -9.782-100.084 1.00121.35 O
+ATOM 399 CG2 THR H 28 -4.979 -9.176-100.211 1.00112.67 C
+ATOM 400 H THR H 28 -6.137 -10.241 -97.863 1.00 0.00 H
+ATOM 401 HA THR H 28 -5.715 -7.439 -98.295 1.00 0.00 H
+ATOM 402 HB THR H 28 -6.657 -7.888-100.562 1.00 0.00 H
+ATOM 403 HG1 THR H 28 -7.772 -9.961 -99.263 1.00 0.00 H
+ATOM 404 1HG2 THR H 28 -4.940 -9.521-101.244 1.00 0.00 H
+ATOM 405 2HG2 THR H 28 -4.277 -8.353-100.076 1.00 0.00 H
+ATOM 406 3HG2 THR H 28 -4.709 -9.995 -99.545 1.00 0.00 H
+ATOM 407 N PHE H 29 -7.871 -6.341 -97.785 1.00 99.39 N
+ATOM 408 CA PHE H 29 -9.079 -5.750 -97.222 1.00102.99 C
+ATOM 409 C PHE H 29 -10.213 -5.695 -98.239 1.00104.49 C
+ATOM 410 O PHE H 29 -11.359 -6.031 -97.915 1.00107.12 O
+ATOM 411 CB PHE H 29 -8.762 -4.355 -96.689 1.00110.39 C
+ATOM 412 CG PHE H 29 -9.908 -3.705 -95.985 1.00109.60 C
+ATOM 413 CD1 PHE H 29 -10.445 -4.271 -94.845 1.00114.74 C
+ATOM 414 CD2 PHE H 29 -10.444 -2.522 -96.458 1.00109.02 C
+ATOM 415 CE1 PHE H 29 -11.500 -3.673 -94.191 1.00120.77 C
+ATOM 416 CE2 PHE H 29 -11.496 -1.921 -95.809 1.00108.36 C
+ATOM 417 CZ PHE H 29 -12.026 -2.495 -94.674 1.00116.55 C
+ATOM 418 H PHE H 29 -7.050 -5.764 -97.903 1.00 0.00 H
+ATOM 419 HA PHE H 29 -9.420 -6.378 -96.398 1.00 0.00 H
+ATOM 420 1HB PHE H 29 -7.925 -4.413 -95.995 1.00 0.00 H
+ATOM 421 2HB PHE H 29 -8.460 -3.711 -97.514 1.00 0.00 H
+ATOM 422 HD1 PHE H 29 -10.024 -5.201 -94.463 1.00 0.00 H
+ATOM 423 HD2 PHE H 29 -10.026 -2.066 -97.356 1.00 0.00 H
+ATOM 424 HE1 PHE H 29 -11.915 -4.132 -93.294 1.00 0.00 H
+ATOM 425 HE2 PHE H 29 -11.912 -0.990 -96.193 1.00 0.00 H
+ATOM 426 HZ PHE H 29 -12.860 -2.019 -94.161 1.00 0.00 H
+ATOM 427 N THR H 30 -9.916 -5.281 -99.473 1.00105.01 N
+ATOM 428 CA THR H 30 -10.972 -5.088-100.464 1.00102.06 C
+ATOM 429 C THR H 30 -11.666 -6.395-100.826 1.00102.39 C
+ATOM 430 O THR H 30 -12.825 -6.381-101.256 1.00 96.93 O
+ATOM 431 CB THR H 30 -10.400 -4.439-101.725 1.00104.25 C
+ATOM 432 OG1 THR H 30 -9.413 -5.302-102.303 1.00107.28 O
+ATOM 433 CG2 THR H 30 -9.762 -3.104-101.394 1.00102.06 C
+ATOM 434 H THR H 30 -8.958 -5.097 -99.733 1.00 0.00 H
+ATOM 435 HA THR H 30 -11.727 -4.426-100.040 1.00 0.00 H
+ATOM 436 HB THR H 30 -11.200 -4.283-102.449 1.00 0.00 H
+ATOM 437 HG1 THR H 30 -9.331 -6.096-101.769 1.00 0.00 H
+ATOM 438 1HG2 THR H 30 -9.361 -2.657-102.303 1.00 0.00 H
+ATOM 439 2HG2 THR H 30 -10.511 -2.440-100.963 1.00 0.00 H
+ATOM 440 3HG2 THR H 30 -8.955 -3.254-100.678 1.00 0.00 H
+ATOM 441 N SER H 31 -10.984 -7.528-100.659 1.00105.30 N
+ATOM 442 CA SER H 31 -11.528 -8.816-101.073 1.00 99.19 C
+ATOM 443 C SER H 31 -12.650 -9.311-100.169 1.00 89.00 C
+ATOM 444 O SER H 31 -13.239 -10.358-100.459 1.00 84.26 O
+ATOM 445 CB SER H 31 -10.408 -9.856-101.129 1.00103.25 C
+ATOM 446 OG SER H 31 -10.851 -11.063-101.724 1.00110.35 O
+ATOM 447 H SER H 31 -10.068 -7.494-100.235 1.00 0.00 H
+ATOM 448 HA SER H 31 -11.960 -8.705-102.069 1.00 0.00 H
+ATOM 449 1HB SER H 31 -9.570 -9.457-101.700 1.00 0.00 H
+ATOM 450 2HB SER H 31 -10.050 -10.059-100.121 1.00 0.00 H
+ATOM 451 HG SER H 31 -11.773 -10.923-101.951 1.00 0.00 H
+ATOM 452 N TYR H 32 -12.965 -8.598 -99.093 1.00 88.96 N
+ATOM 453 CA TYR H 32 -14.027 -8.993 -98.186 1.00 86.88 C
+ATOM 454 C TYR H 32 -14.946 -7.806 -97.930 1.00 93.51 C
+ATOM 455 O TYR H 32 -14.583 -6.647 -98.154 1.00107.63 O
+ATOM 456 CB TYR H 32 -13.469 -9.514 -96.852 1.00 91.28 C
+ATOM 457 CG TYR H 32 -12.788 -10.867 -96.924 1.00 90.88 C
+ATOM 458 CD1 TYR H 32 -13.423 -12.016 -96.464 1.00 86.26 C
+ATOM 459 CD2 TYR H 32 -11.506 -10.993 -97.442 1.00 91.99 C
+ATOM 460 CE1 TYR H 32 -12.799 -13.254 -96.524 1.00 85.73 C
+ATOM 461 CE2 TYR H 32 -10.874 -12.225 -97.506 1.00 92.25 C
+ATOM 462 CZ TYR H 32 -11.524 -13.352 -97.046 1.00 88.54 C
+ATOM 463 OH TYR H 32 -10.894 -14.577 -97.111 1.00 83.72 O
+ATOM 464 H TYR H 32 -12.445 -7.753 -98.904 1.00 0.00 H
+ATOM 465 HA TYR H 32 -14.598 -9.797 -98.651 1.00 0.00 H
+ATOM 466 1HB TYR H 32 -12.742 -8.802 -96.458 1.00 0.00 H
+ATOM 467 2HB TYR H 32 -14.277 -9.592 -96.126 1.00 0.00 H
+ATOM 468 HD1 TYR H 32 -14.429 -11.953 -96.047 1.00 0.00 H
+ATOM 469 HD2 TYR H 32 -10.977 -10.113 -97.807 1.00 0.00 H
+ATOM 470 HE1 TYR H 32 -13.314 -14.142 -96.158 1.00 0.00 H
+ATOM 471 HE2 TYR H 32 -9.867 -12.301 -97.918 1.00 0.00 H
+ATOM 472 HH TYR H 32 -10.022 -14.467 -97.498 1.00 0.00 H
+ATOM 473 N GLY H 33 -16.150 -8.111 -97.455 1.00 73.67 N
+ATOM 474 CA GLY H 33 -17.079 -7.094 -97.022 1.00 78.33 C
+ATOM 475 C GLY H 33 -17.178 -7.030 -95.507 1.00 85.75 C
+ATOM 476 O GLY H 33 -16.784 -7.961 -94.800 1.00 89.90 O
+ATOM 477 H GLY H 33 -16.421 -9.082 -97.396 1.00 0.00 H
+ATOM 478 1HA GLY H 33 -16.762 -6.124 -97.406 1.00 0.00 H
+ATOM 479 2HA GLY H 33 -18.064 -7.299 -97.441 1.00 0.00 H
+ATOM 480 N ILE H 34 -17.720 -5.919 -95.011 1.00 76.11 N
+ATOM 481 CA ILE H 34 -17.858 -5.685 -93.578 1.00 69.24 C
+ATOM 482 C ILE H 34 -19.329 -5.472 -93.255 1.00 65.30 C
+ATOM 483 O ILE H 34 -19.985 -4.621 -93.864 1.00 72.18 O
+ATOM 484 CB ILE H 34 -17.035 -4.467 -93.121 1.00 66.90 C
+ATOM 485 CG1 ILE H 34 -15.560 -4.650 -93.489 1.00 63.43 C
+ATOM 486 CG2 ILE H 34 -17.190 -4.252 -91.623 1.00 67.98 C
+ATOM 487 CD1 ILE H 34 -14.896 -5.813 -92.789 1.00 0.00 C
+ATOM 488 H ILE H 34 -18.046 -5.215 -95.658 1.00 0.00 H
+ATOM 489 HA ILE H 34 -17.504 -6.569 -93.048 1.00 0.00 H
+ATOM 490 HB ILE H 34 -17.382 -3.576 -93.644 1.00 0.00 H
+ATOM 491 1HG1 ILE H 34 -15.470 -4.802 -94.564 1.00 0.00 H
+ATOM 492 2HG1 ILE H 34 -15.008 -3.743 -93.240 1.00 0.00 H
+ATOM 493 1HG2 ILE H 34 -16.602 -3.388 -91.316 1.00 0.00 H
+ATOM 494 2HG2 ILE H 34 -18.239 -4.079 -91.387 1.00 0.00 H
+ATOM 495 3HG2 ILE H 34 -16.840 -5.137 -91.090 1.00 0.00 H
+ATOM 496 1HD1 ILE H 34 -13.853 -5.878 -93.101 1.00 0.00 H
+ATOM 497 2HD1 ILE H 34 -14.944 -5.664 -91.710 1.00 0.00 H
+ATOM 498 3HD1 ILE H 34 -15.410 -6.737 -93.051 1.00 0.00 H
+ATOM 499 N SER H 35 -19.844 -6.249 -92.306 1.00 67.20 N
+ATOM 500 CA SER H 35 -21.206 -6.116 -91.817 1.00 73.58 C
+ATOM 501 C SER H 35 -21.174 -5.705 -90.352 1.00 72.13 C
+ATOM 502 O SER H 35 -20.176 -5.902 -89.653 1.00 74.68 O
+ATOM 503 CB SER H 35 -21.988 -7.427 -91.969 1.00 81.22 C
+ATOM 504 OG SER H 35 -21.695 -8.045 -93.211 1.00 88.48 O
+ATOM 505 H SER H 35 -19.248 -6.964 -91.914 1.00 0.00 H
+ATOM 506 HA SER H 35 -21.711 -5.349 -92.405 1.00 0.00 H
+ATOM 507 1HB SER H 35 -21.731 -8.101 -91.152 1.00 0.00 H
+ATOM 508 2HB SER H 35 -23.056 -7.223 -91.901 1.00 0.00 H
+ATOM 509 HG SER H 35 -21.065 -7.469 -93.651 1.00 0.00 H
+ATOM 510 N TRP H 36 -22.283 -5.134 -89.885 1.00 71.60 N
+ATOM 511 CA TRP H 36 -22.398 -4.718 -88.493 1.00 59.59 C
+ATOM 512 C TRP H 36 -23.633 -5.349 -87.865 1.00 63.66 C
+ATOM 513 O TRP H 36 -24.719 -5.312 -88.452 1.00 75.93 O
+ATOM 514 CB TRP H 36 -22.451 -3.192 -88.383 1.00 68.84 C
+ATOM 515 CG TRP H 36 -21.126 -2.525 -88.630 1.00 73.03 C
+ATOM 516 CD1 TRP H 36 -20.603 -2.164 -89.835 1.00 90.66 C
+ATOM 517 CD2 TRP H 36 -20.158 -2.141 -87.643 1.00 72.52 C
+ATOM 518 NE1 TRP H 36 -19.372 -1.577 -89.662 1.00 88.99 N
+ATOM 519 CE2 TRP H 36 -19.076 -1.555 -88.326 1.00 82.06 C
+ATOM 520 CE3 TRP H 36 -20.101 -2.241 -86.251 1.00 82.00 C
+ATOM 521 CZ2 TRP H 36 -17.951 -1.069 -87.664 1.00 87.79 C
+ATOM 522 CZ3 TRP H 36 -18.982 -1.757 -85.595 1.00 82.98 C
+ATOM 523 CH2 TRP H 36 -17.923 -1.178 -86.302 1.00 82.69 C
+ATOM 524 H TRP H 36 -23.063 -4.985 -90.509 1.00 0.00 H
+ATOM 525 HA TRP H 36 -21.521 -5.073 -87.952 1.00 0.00 H
+ATOM 526 1HB TRP H 36 -23.171 -2.800 -89.102 1.00 0.00 H
+ATOM 527 2HB TRP H 36 -22.796 -2.911 -87.388 1.00 0.00 H
+ATOM 528 HD1 TRP H 36 -21.090 -2.318 -90.796 1.00 0.00 H
+ATOM 529 HE1 TRP H 36 -18.781 -1.221 -90.399 1.00 0.00 H
+ATOM 530 HE3 TRP H 36 -20.923 -2.689 -85.693 1.00 0.00 H
+ATOM 531 HZ2 TRP H 36 -17.116 -0.614 -88.198 1.00 0.00 H
+ATOM 532 HZ3 TRP H 36 -18.947 -1.840 -84.508 1.00 0.00 H
+ATOM 533 HH2 TRP H 36 -17.057 -0.807 -85.753 1.00 0.00 H
+ATOM 534 N VAL H 37 -23.465 -5.922 -86.669 1.00 57.91 N
+ATOM 535 CA VAL H 37 -24.535 -6.636 -85.973 1.00 57.52 C
+ATOM 536 C VAL H 37 -24.530 -6.229 -84.505 1.00 60.95 C
+ATOM 537 O VAL H 37 -23.529 -6.428 -83.810 1.00 67.05 O
+ATOM 538 CB VAL H 37 -24.381 -8.163 -86.085 1.00 56.85 C
+ATOM 539 CG1 VAL H 37 -25.296 -8.861 -85.081 1.00 54.90 C
+ATOM 540 CG2 VAL H 37 -24.678 -8.632 -87.503 1.00 59.97 C
+ATOM 541 H VAL H 37 -22.556 -5.854 -86.235 1.00 0.00 H
+ATOM 542 HA VAL H 37 -25.487 -6.362 -86.429 1.00 0.00 H
+ATOM 543 HB VAL H 37 -23.358 -8.436 -85.826 1.00 0.00 H
+ATOM 544 1HG1 VAL H 37 -25.177 -9.941 -85.170 1.00 0.00 H
+ATOM 545 2HG1 VAL H 37 -25.032 -8.550 -84.071 1.00 0.00 H
+ATOM 546 3HG1 VAL H 37 -26.332 -8.593 -85.285 1.00 0.00 H
+ATOM 547 1HG2 VAL H 37 -24.563 -9.714 -87.560 1.00 0.00 H
+ATOM 548 2HG2 VAL H 37 -25.700 -8.361 -87.769 1.00 0.00 H
+ATOM 549 3HG2 VAL H 37 -23.984 -8.156 -88.196 1.00 0.00 H
+ATOM 550 N ARG H 38 -25.648 -5.701 -84.019 1.00 61.34 N
+ATOM 551 CA ARG H 38 -25.758 -5.274 -82.632 1.00 67.71 C
+ATOM 552 C ARG H 38 -26.678 -6.204 -81.850 1.00 73.86 C
+ATOM 553 O ARG H 38 -27.531 -6.894 -82.414 1.00 75.00 O
+ATOM 554 CB ARG H 38 -26.280 -3.838 -82.536 1.00 73.48 C
+ATOM 555 CG ARG H 38 -27.752 -3.701 -82.861 1.00 69.18 C
+ATOM 556 CD ARG H 38 -28.249 -2.304 -82.558 1.00 73.63 C
+ATOM 557 NE ARG H 38 -29.680 -2.174 -82.804 1.00 76.05 N
+ATOM 558 CZ ARG H 38 -30.355 -1.038 -82.682 1.00 88.88 C
+ATOM 559 NH1 ARG H 38 -29.725 0.070 -82.318 1.00 88.72 N
+ATOM 560 NH2 ARG H 38 -31.658 -1.007 -82.924 1.00104.51 N
+ATOM 561 H ARG H 38 -26.444 -5.594 -84.631 1.00 0.00 H
+ATOM 562 HA ARG H 38 -24.767 -5.309 -82.179 1.00 0.00 H
+ATOM 563 1HB ARG H 38 -26.117 -3.459 -81.528 1.00 0.00 H
+ATOM 564 2HB ARG H 38 -25.720 -3.201 -83.220 1.00 0.00 H
+ATOM 565 1HG ARG H 38 -27.911 -3.906 -83.920 1.00 0.00 H
+ATOM 566 2HG ARG H 38 -28.324 -4.412 -82.264 1.00 0.00 H
+ATOM 567 1HD ARG H 38 -28.059 -2.070 -81.511 1.00 0.00 H
+ATOM 568 2HD ARG H 38 -27.727 -1.587 -83.190 1.00 0.00 H
+ATOM 569 HE ARG H 38 -30.186 -3.003 -83.085 1.00 0.00 H
+ATOM 570 1HH1 ARG H 38 -28.732 0.049 -82.134 1.00 0.00 H
+ATOM 571 2HH1 ARG H 38 -30.238 0.935 -82.225 1.00 0.00 H
+ATOM 572 1HH2 ARG H 38 -32.141 -1.851 -83.202 1.00 0.00 H
+ATOM 573 2HH2 ARG H 38 -32.168 -0.141 -82.830 1.00 0.00 H
+ATOM 574 N GLN H 39 -26.496 -6.206 -80.527 1.00 73.12 N
+ATOM 575 CA GLN H 39 -27.315 -7.000 -79.615 1.00 72.08 C
+ATOM 576 C GLN H 39 -27.596 -6.183 -78.364 1.00 72.80 C
+ATOM 577 O GLN H 39 -26.663 -5.743 -77.687 1.00 86.66 O
+ATOM 578 CB GLN H 39 -26.626 -8.316 -79.240 1.00 67.13 C
+ATOM 579 CG GLN H 39 -27.440 -9.180 -78.281 1.00 64.56 C
+ATOM 580 CD GLN H 39 -26.698 -10.424 -77.826 1.00 63.84 C
+ATOM 581 OE1 GLN H 39 -25.473 -10.416 -77.679 1.00 63.92 O
+ATOM 582 NE2 GLN H 39 -27.438 -11.509 -77.621 1.00 62.60 N
+ATOM 583 H GLN H 39 -25.757 -5.630 -80.150 1.00 0.00 H
+ATOM 584 HA GLN H 39 -28.254 -7.239 -80.113 1.00 0.00 H
+ATOM 585 1HB GLN H 39 -26.433 -8.896 -80.143 1.00 0.00 H
+ATOM 586 2HB GLN H 39 -25.663 -8.103 -78.775 1.00 0.00 H
+ATOM 587 1HG GLN H 39 -27.684 -8.592 -77.396 1.00 0.00 H
+ATOM 588 2HG GLN H 39 -28.354 -9.498 -78.782 1.00 0.00 H
+ATOM 589 1HE2 GLN H 39 -27.006 -12.360 -77.320 1.00 0.00 H
+ATOM 590 2HE2 GLN H 39 -28.427 -11.475 -77.767 1.00 0.00 H
+ATOM 591 N ALA H 40 -28.888 -5.990 -78.053 1.00 72.82 N
+ATOM 592 CA ALA H 40 -29.338 -5.272 -76.873 1.00 77.41 C
+ATOM 593 C ALA H 40 -29.554 -6.239 -75.713 1.00 85.05 C
+ATOM 594 O ALA H 40 -29.865 -7.416 -75.929 1.00 99.80 O
+ATOM 595 CB ALA H 40 -30.635 -4.522 -77.165 1.00 80.95 C
+ATOM 596 H ALA H 40 -29.574 -6.373 -78.687 1.00 0.00 H
+ATOM 597 HA ALA H 40 -28.568 -4.550 -76.602 1.00 0.00 H
+ATOM 598 1HB ALA H 40 -30.957 -3.990 -76.270 1.00 0.00 H
+ATOM 599 2HB ALA H 40 -30.469 -3.808 -77.971 1.00 0.00 H
+ATOM 600 3HB ALA H 40 -31.406 -5.231 -77.462 1.00 0.00 H
+ATOM 601 N PRO H 41 -29.382 -5.764 -74.479 1.00 81.87 N
+ATOM 602 CA PRO H 41 -29.564 -6.640 -73.312 1.00 95.61 C
+ATOM 603 C PRO H 41 -30.943 -7.282 -73.302 1.00101.23 C
+ATOM 604 O PRO H 41 -31.970 -6.598 -73.340 1.00 97.13 O
+ATOM 605 CB PRO H 41 -29.369 -5.689 -72.124 1.00100.62 C
+ATOM 606 CG PRO H 41 -29.528 -4.308 -72.696 1.00 90.02 C
+ATOM 607 CD PRO H 41 -28.996 -4.401 -74.082 1.00 85.12 C
+ATOM 608 HA PRO H 41 -28.788 -7.420 -73.321 1.00 0.00 H
+ATOM 609 1HB PRO H 41 -30.112 -5.906 -71.342 1.00 0.00 H
+ATOM 610 2HB PRO H 41 -28.376 -5.845 -71.676 1.00 0.00 H
+ATOM 611 1HG PRO H 41 -30.586 -4.007 -72.674 1.00 0.00 H
+ATOM 612 2HG PRO H 41 -28.977 -3.578 -72.085 1.00 0.00 H
+ATOM 613 1HD PRO H 41 -29.476 -3.637 -74.712 1.00 0.00 H
+ATOM 614 2HD PRO H 41 -27.905 -4.262 -74.067 1.00 0.00 H
+ATOM 615 N GLY H 42 -30.956 -8.612 -73.252 1.00 93.97 N
+ATOM 616 CA GLY H 42 -32.185 -9.373 -73.281 1.00 93.17 C
+ATOM 617 C GLY H 42 -32.702 -9.703 -74.661 1.00 90.16 C
+ATOM 618 O GLY H 42 -33.795 -10.271 -74.773 1.00 93.87 O
+ATOM 619 H GLY H 42 -30.075 -9.102 -73.192 1.00 0.00 H
+ATOM 620 1HA GLY H 42 -32.044 -10.313 -72.748 1.00 0.00 H
+ATOM 621 2HA GLY H 42 -32.966 -8.822 -72.759 1.00 0.00 H
+ATOM 622 N HIS H 43 -31.958 -9.370 -75.713 1.00 81.78 N
+ATOM 623 CA HIS H 43 -32.387 -9.593 -77.085 1.00 82.68 C
+ATOM 624 C HIS H 43 -31.321 -10.378 -77.837 1.00 80.59 C
+ATOM 625 O HIS H 43 -30.204 -10.583 -77.352 1.00 81.50 O
+ATOM 626 CB HIS H 43 -32.673 -8.270 -77.805 1.00 87.43 C
+ATOM 627 CG HIS H 43 -33.845 -7.525 -77.253 1.00 94.02 C
+ATOM 628 ND1 HIS H 43 -33.877 -7.039 -75.965 1.00103.13 N
+ATOM 629 CD2 HIS H 43 -35.028 -7.181 -77.815 1.00100.48 C
+ATOM 630 CE1 HIS H 43 -35.030 -6.428 -75.756 1.00114.77 C
+ATOM 631 NE2 HIS H 43 -35.745 -6.498 -76.863 1.00112.87 N
+ATOM 632 H HIS H 43 -31.058 -8.945 -75.542 1.00 0.00 H
+ATOM 633 HA HIS H 43 -33.307 -10.177 -77.088 1.00 0.00 H
+ATOM 634 1HB HIS H 43 -31.797 -7.623 -77.740 1.00 0.00 H
+ATOM 635 2HB HIS H 43 -32.859 -8.463 -78.861 1.00 0.00 H
+ATOM 636 HD2 HIS H 43 -35.351 -7.402 -78.833 1.00 0.00 H
+ATOM 637 HE1 HIS H 43 -35.338 -5.948 -74.827 1.00 0.00 H
+ATOM 638 HE2 HIS H 43 -36.670 -6.113 -76.994 1.00 0.00 H
+ATOM 639 N GLY H 44 -31.683 -10.813 -79.043 1.00 67.77 N
+ATOM 640 CA GLY H 44 -30.790 -11.567 -79.894 1.00 74.19 C
+ATOM 641 C GLY H 44 -30.058 -10.687 -80.890 1.00 81.25 C
+ATOM 642 O GLY H 44 -30.047 -9.458 -80.802 1.00 82.64 O
+ATOM 643 H GLY H 44 -32.616 -10.606 -79.370 1.00 0.00 H
+ATOM 644 1HA GLY H 44 -30.059 -12.093 -79.279 1.00 0.00 H
+ATOM 645 2HA GLY H 44 -31.357 -12.323 -80.437 1.00 0.00 H
+ATOM 646 N LEU H 45 -29.437 -11.344 -81.863 1.00 81.06 N
+ATOM 647 CA LEU H 45 -28.633 -10.631 -82.845 1.00 78.97 C
+ATOM 648 C LEU H 45 -29.526 -9.905 -83.843 1.00 69.83 C
+ATOM 649 O LEU H 45 -30.602 -10.388 -84.207 1.00 65.62 O
+ATOM 650 CB LEU H 45 -27.704 -11.603 -83.570 1.00 79.75 C
+ATOM 651 CG LEU H 45 -26.859 -12.468 -82.634 1.00 72.47 C
+ATOM 652 CD1 LEU H 45 -25.883 -13.335 -83.420 1.00 74.87 C
+ATOM 653 CD2 LEU H 45 -26.129 -11.591 -81.625 1.00 58.91 C
+ATOM 654 H LEU H 45 -29.518 -12.349 -81.930 1.00 0.00 H
+ATOM 655 HA LEU H 45 -28.028 -9.890 -82.324 1.00 0.00 H
+ATOM 656 1HB LEU H 45 -28.307 -12.257 -84.198 1.00 0.00 H
+ATOM 657 2HB LEU H 45 -27.036 -11.031 -84.213 1.00 0.00 H
+ATOM 658 HG LEU H 45 -27.505 -13.165 -82.100 1.00 0.00 H
+ATOM 659 1HD1 LEU H 45 -25.295 -13.940 -82.729 1.00 0.00 H
+ATOM 660 2HD1 LEU H 45 -26.438 -13.990 -84.092 1.00 0.00 H
+ATOM 661 3HD1 LEU H 45 -25.217 -12.698 -84.001 1.00 0.00 H
+ATOM 662 1HD2 LEU H 45 -25.531 -12.218 -80.963 1.00 0.00 H
+ATOM 663 2HD2 LEU H 45 -25.477 -10.895 -82.153 1.00 0.00 H
+ATOM 664 3HD2 LEU H 45 -26.856 -11.032 -81.036 1.00 0.00 H
+ATOM 665 N GLU H 46 -29.074 -8.730 -84.279 1.00 65.14 N
+ATOM 666 CA GLU H 46 -29.831 -7.888 -85.198 1.00 61.74 C
+ATOM 667 C GLU H 46 -28.870 -7.305 -86.221 1.00 64.91 C
+ATOM 668 O GLU H 46 -27.920 -6.610 -85.853 1.00 62.36 O
+ATOM 669 CB GLU H 46 -30.568 -6.773 -84.447 1.00 65.56 C
+ATOM 670 CG GLU H 46 -31.321 -5.795 -85.336 1.00 99.34 C
+ATOM 671 CD GLU H 46 -32.035 -4.707 -84.547 1.00119.92 C
+ATOM 672 OE1 GLU H 46 -32.134 -4.830 -83.308 1.00120.52 O
+ATOM 673 OE2 GLU H 46 -32.490 -3.722 -85.167 1.00132.76 O
+ATOM 674 H GLU H 46 -28.170 -8.416 -83.956 1.00 0.00 H
+ATOM 675 HA GLU H 46 -30.572 -8.508 -85.705 1.00 0.00 H
+ATOM 676 1HB GLU H 46 -31.287 -7.213 -83.756 1.00 0.00 H
+ATOM 677 2HB GLU H 46 -29.854 -6.200 -83.855 1.00 0.00 H
+ATOM 678 1HG GLU H 46 -30.616 -5.327 -86.022 1.00 0.00 H
+ATOM 679 2HG GLU H 46 -32.050 -6.346 -85.928 1.00 0.00 H
+ATOM 680 N TRP H 47 -29.109 -7.594 -87.497 1.00 80.72 N
+ATOM 681 CA TRP H 47 -28.271 -7.073 -88.569 1.00 73.86 C
+ATOM 682 C TRP H 47 -28.600 -5.606 -88.811 1.00 84.03 C
+ATOM 683 O TRP H 47 -29.774 -5.226 -88.875 1.00 94.46 O
+ATOM 684 CB TRP H 47 -28.478 -7.889 -89.843 1.00 66.00 C
+ATOM 685 CG TRP H 47 -27.671 -7.450 -91.037 1.00 72.34 C
+ATOM 686 CD1 TRP H 47 -26.359 -7.737 -91.297 1.00 77.10 C
+ATOM 687 CD2 TRP H 47 -28.141 -6.688 -92.154 1.00 77.37 C
+ATOM 688 NE1 TRP H 47 -25.981 -7.182 -92.498 1.00 68.98 N
+ATOM 689 CE2 TRP H 47 -27.058 -6.534 -93.043 1.00 74.43 C
+ATOM 690 CE3 TRP H 47 -29.372 -6.113 -92.485 1.00 75.89 C
+ATOM 691 CZ2 TRP H 47 -27.171 -5.832 -94.239 1.00 85.16 C
+ATOM 692 CZ3 TRP H 47 -29.480 -5.415 -93.668 1.00 77.89 C
+ATOM 693 CH2 TRP H 47 -28.387 -5.279 -94.531 1.00 90.35 C
+ATOM 694 H TRP H 47 -29.891 -8.190 -87.729 1.00 0.00 H
+ATOM 695 HA TRP H 47 -27.228 -7.156 -88.264 1.00 0.00 H
+ATOM 696 1HB TRP H 47 -28.228 -8.933 -89.651 1.00 0.00 H
+ATOM 697 2HB TRP H 47 -29.528 -7.852 -90.132 1.00 0.00 H
+ATOM 698 HD1 TRP H 47 -25.708 -8.320 -90.648 1.00 0.00 H
+ATOM 699 HE1 TRP H 47 -25.061 -7.242 -92.910 1.00 0.00 H
+ATOM 700 HE3 TRP H 47 -30.229 -6.218 -91.821 1.00 0.00 H
+ATOM 701 HZ2 TRP H 47 -26.332 -5.721 -94.927 1.00 0.00 H
+ATOM 702 HZ3 TRP H 47 -30.444 -4.969 -93.915 1.00 0.00 H
+ATOM 703 HH2 TRP H 47 -28.511 -4.717 -95.457 1.00 0.00 H
+ATOM 704 N MET H 48 -27.563 -4.782 -88.935 1.00 80.19 N
+ATOM 705 CA MET H 48 -27.729 -3.353 -89.172 1.00 73.25 C
+ATOM 706 C MET H 48 -27.388 -2.921 -90.587 1.00 79.89 C
+ATOM 707 O MET H 48 -28.049 -2.030 -91.125 1.00 75.99 O
+ATOM 708 CB MET H 48 -26.878 -2.548 -88.190 1.00 74.86 C
+ATOM 709 CG MET H 48 -27.393 -2.571 -86.773 1.00 84.04 C
+ATOM 710 SD MET H 48 -26.420 -1.470 -85.741 1.00 91.15 S
+ATOM 711 CE MET H 48 -24.804 -2.202 -85.949 1.00 91.57 C
+ATOM 712 H MET H 48 -26.631 -5.164 -88.862 1.00 0.00 H
+ATOM 713 HA MET H 48 -28.777 -3.096 -89.018 1.00 0.00 H
+ATOM 714 1HB MET H 48 -25.861 -2.937 -88.187 1.00 0.00 H
+ATOM 715 2HB MET H 48 -26.830 -1.508 -88.517 1.00 0.00 H
+ATOM 716 1HG MET H 48 -28.437 -2.260 -86.760 1.00 0.00 H
+ATOM 717 2HG MET H 48 -27.336 -3.587 -86.382 1.00 0.00 H
+ATOM 718 1HE MET H 48 -24.072 -1.638 -85.371 1.00 0.00 H
+ATOM 719 2HE MET H 48 -24.825 -3.235 -85.600 1.00 0.00 H
+ATOM 720 3HE MET H 48 -24.528 -2.181 -87.004 1.00 0.00 H
+ATOM 721 N GLY H 49 -26.373 -3.514 -91.203 1.00 81.95 N
+ATOM 722 CA GLY H 49 -26.002 -3.112 -92.546 1.00 82.38 C
+ATOM 723 C GLY H 49 -24.739 -3.806 -93.007 1.00 75.57 C
+ATOM 724 O GLY H 49 -23.990 -4.399 -92.217 1.00 79.92 O
+ATOM 725 H GLY H 49 -25.850 -4.248 -90.747 1.00 0.00 H
+ATOM 726 1HA GLY H 49 -26.816 -3.344 -93.233 1.00 0.00 H
+ATOM 727 2HA GLY H 49 -25.855 -2.033 -92.575 1.00 0.00 H
+ATOM 728 N TRP H 50 -24.515 -3.708 -94.315 1.00 78.11 N
+ATOM 729 CA TRP H 50 -23.364 -4.296 -94.983 1.00 78.69 C
+ATOM 730 C TRP H 50 -22.737 -3.262 -95.907 1.00 79.21 C
+ATOM 731 O TRP H 50 -23.447 -2.475 -96.546 1.00 70.93 O
+ATOM 732 CB TRP H 50 -23.770 -5.547 -95.776 1.00 77.00 C
+ATOM 733 CG TRP H 50 -22.639 -6.216 -96.493 1.00 79.78 C
+ATOM 734 CD1 TRP H 50 -21.623 -6.933 -95.932 1.00 83.04 C
+ATOM 735 CD2 TRP H 50 -22.422 -6.255 -97.909 1.00 79.73 C
+ATOM 736 NE1 TRP H 50 -20.778 -7.403 -96.908 1.00 80.38 N
+ATOM 737 CE2 TRP H 50 -21.247 -7.001 -98.130 1.00 83.59 C
+ATOM 738 CE3 TRP H 50 -23.101 -5.726 -99.009 1.00 78.18 C
+ATOM 739 CZ2 TRP H 50 -20.740 -7.231 -99.404 1.00 87.05 C
+ATOM 740 CZ3 TRP H 50 -22.595 -5.955-100.272 1.00 85.71 C
+ATOM 741 CH2 TRP H 50 -21.426 -6.702-100.460 1.00 86.43 C
+ATOM 742 H TRP H 50 -25.191 -3.193 -94.861 1.00 0.00 H
+ATOM 743 HA TRP H 50 -22.637 -4.589 -94.226 1.00 0.00 H
+ATOM 744 1HB TRP H 50 -24.217 -6.277 -95.101 1.00 0.00 H
+ATOM 745 2HB TRP H 50 -24.525 -5.280 -96.516 1.00 0.00 H
+ATOM 746 HD1 TRP H 50 -21.499 -7.108 -94.865 1.00 0.00 H
+ATOM 747 HE1 TRP H 50 -19.946 -7.954 -96.751 1.00 0.00 H
+ATOM 748 HE3 TRP H 50 -24.013 -5.146 -98.872 1.00 0.00 H
+ATOM 749 HZ2 TRP H 50 -19.832 -7.811 -99.570 1.00 0.00 H
+ATOM 750 HZ3 TRP H 50 -23.132 -5.536-101.124 1.00 0.00 H
+ATOM 751 HH2 TRP H 50 -21.057 -6.863-101.473 1.00 0.00 H
+ATOM 752 N ILE H 51 -21.404 -3.259 -95.961 1.00 78.85 N
+ATOM 753 CA ILE H 51 -20.645 -2.355 -96.815 1.00 71.18 C
+ATOM 754 C ILE H 51 -19.567 -3.149 -97.541 1.00 89.22 C
+ATOM 755 O ILE H 51 -18.902 -4.013 -96.952 1.00 92.53 O
+ATOM 756 CB ILE H 51 -20.024 -1.183 -96.023 1.00 72.80 C
+ATOM 757 CG1 ILE H 51 -19.273 -0.239 -96.969 1.00 76.69 C
+ATOM 758 CG2 ILE H 51 -19.092 -1.693 -94.938 1.00 70.28 C
+ATOM 759 CD1 ILE H 51 -18.719 1.003 -96.304 1.00 79.03 C
+ATOM 760 H ILE H 51 -20.908 -3.918 -95.379 1.00 0.00 H
+ATOM 761 HA ILE H 51 -21.320 -1.933 -97.558 1.00 0.00 H
+ATOM 762 HB ILE H 51 -20.817 -0.599 -95.556 1.00 0.00 H
+ATOM 763 1HG1 ILE H 51 -18.442 -0.772 -97.430 1.00 0.00 H
+ATOM 764 2HG1 ILE H 51 -19.940 0.080 -97.770 1.00 0.00 H
+ATOM 765 1HG2 ILE H 51 -18.668 -0.848 -94.396 1.00 0.00 H
+ATOM 766 2HG2 ILE H 51 -19.649 -2.324 -94.247 1.00 0.00 H
+ATOM 767 3HG2 ILE H 51 -18.288 -2.273 -95.392 1.00 0.00 H
+ATOM 768 1HD1 ILE H 51 -18.204 1.614 -97.046 1.00 0.00 H
+ATOM 769 2HD1 ILE H 51 -19.536 1.577 -95.866 1.00 0.00 H
+ATOM 770 3HD1 ILE H 51 -18.018 0.715 -95.522 1.00 0.00 H
+ATOM 771 N SER H 52 -19.415 -2.858 -98.832 1.00 87.44 N
+ATOM 772 CA SER H 52 -18.427 -3.477 -99.706 1.00 89.95 C
+ATOM 773 C SER H 52 -17.391 -2.418-100.063 1.00 93.42 C
+ATOM 774 O SER H 52 -17.695 -1.469-100.793 1.00 93.74 O
+ATOM 775 CB SER H 52 -19.097 -4.043-100.957 1.00 87.92 C
+ATOM 776 OG SER H 52 -18.185 -4.154-102.036 1.00 94.13 O
+ATOM 777 H SER H 52 -20.037 -2.158 -99.211 1.00 0.00 H
+ATOM 778 HA SER H 52 -17.951 -4.296 -99.165 1.00 0.00 H
+ATOM 779 1HB SER H 52 -19.512 -5.026-100.734 1.00 0.00 H
+ATOM 780 2HB SER H 52 -19.924 -3.398-101.250 1.00 0.00 H
+ATOM 781 HG SER H 52 -17.342 -3.835-101.704 1.00 0.00 H
+ATOM 782 N ALA H 53 -16.171 -2.579 -99.541 1.00 94.99 N
+ATOM 783 CA ALA H 53 -15.110 -1.617 -99.823 1.00 96.41 C
+ATOM 784 C ALA H 53 -14.776 -1.564-101.307 1.00108.39 C
+ATOM 785 O ALA H 53 -14.378 -0.510-101.817 1.00112.08 O
+ATOM 786 CB ALA H 53 -13.860 -1.963 -99.015 1.00 90.11 C
+ATOM 787 H ALA H 53 -15.972 -3.370 -98.945 1.00 0.00 H
+ATOM 788 HA ALA H 53 -15.462 -0.628 -99.528 1.00 0.00 H
+ATOM 789 1HB ALA H 53 -13.074 -1.239 -99.232 1.00 0.00 H
+ATOM 790 2HB ALA H 53 -14.095 -1.935 -97.951 1.00 0.00 H
+ATOM 791 3HB ALA H 53 -13.518 -2.961 -99.284 1.00 0.00 H
+ATOM 792 N TYR H 54 -14.929 -2.687-102.012 1.00110.47 N
+ATOM 793 CA TYR H 54 -14.647 -2.727-103.443 1.00103.52 C
+ATOM 794 C TYR H 54 -15.550 -1.764-104.203 1.00110.21 C
+ATOM 795 O TYR H 54 -15.078 -0.821-104.848 1.00117.17 O
+ATOM 796 CB TYR H 54 -14.819 -4.156-103.962 1.00 97.44 C
+ATOM 797 CG TYR H 54 -14.208 -4.402-105.320 1.00116.50 C
+ATOM 798 CD1 TYR H 54 -12.858 -4.703-105.449 1.00129.07 C
+ATOM 799 CD2 TYR H 54 -14.980 -4.347-106.472 1.00129.24 C
+ATOM 800 CE1 TYR H 54 -12.289 -4.932-106.690 1.00136.93 C
+ATOM 801 CE2 TYR H 54 -14.420 -4.575-107.719 1.00145.00 C
+ATOM 802 CZ TYR H 54 -13.074 -4.867-107.821 1.00146.56 C
+ATOM 803 OH TYR H 54 -12.511 -5.096-109.057 1.00154.59 O
+ATOM 804 H TYR H 54 -15.246 -3.527-101.549 1.00 0.00 H
+ATOM 805 HA TYR H 54 -13.615 -2.413-103.601 1.00 0.00 H
+ATOM 806 1HB TYR H 54 -14.366 -4.856-103.259 1.00 0.00 H
+ATOM 807 2HB TYR H 54 -15.880 -4.395-104.024 1.00 0.00 H
+ATOM 808 HD1 TYR H 54 -12.226 -4.763-104.563 1.00 0.00 H
+ATOM 809 HD2 TYR H 54 -16.044 -4.121-106.405 1.00 0.00 H
+ATOM 810 HE1 TYR H 54 -11.228 -5.167-106.768 1.00 0.00 H
+ATOM 811 HE2 TYR H 54 -15.041 -4.523-108.613 1.00 0.00 H
+ATOM 812 HH TYR H 54 -13.186 -5.015-109.735 1.00 0.00 H
+ATOM 813 N ASN H 55 -16.860 -1.983-104.125 1.00110.31 N
+ATOM 814 CA ASN H 55 -17.821 -1.194-104.882 1.00106.22 C
+ATOM 815 C ASN H 55 -18.249 0.084-104.173 1.00103.74 C
+ATOM 816 O ASN H 55 -18.749 1.002-104.833 1.00 97.97 O
+ATOM 817 CB ASN H 55 -19.038 -2.039-105.211 1.00103.37 C
+ATOM 818 CG ASN H 55 -18.734 -3.129-106.201 1.00103.12 C
+ATOM 819 OD1 ASN H 55 -18.124 -2.881-107.248 1.00 0.00 O
+ATOM 820 ND2 ASN H 55 -19.147 -4.331-105.891 1.00 0.00 N
+ATOM 821 H ASN H 55 -17.195 -2.720-103.521 1.00 0.00 H
+ATOM 822 HA ASN H 55 -17.357 -0.893-105.823 1.00 0.00 H
+ATOM 823 1HB ASN H 55 -19.425 -2.492-104.297 1.00 0.00 H
+ATOM 824 2HB ASN H 55 -19.823 -1.403-105.619 1.00 0.00 H
+ATOM 825 1HD2 ASN H 55 -18.973 -5.096-106.513 1.00 0.00 H
+ATOM 826 2HD2 ASN H 55 -19.636 -4.486-105.034 1.00 0.00 H
+ATOM 827 N GLY H 56 -18.059 0.176-102.860 1.00107.64 N
+ATOM 828 CA GLY H 56 -18.651 1.261-102.108 1.00104.21 C
+ATOM 829 C GLY H 56 -20.124 1.083-101.826 1.00 96.58 C
+ATOM 830 O GLY H 56 -20.748 1.991-101.264 1.00 90.86 O
+ATOM 831 H GLY H 56 -17.499 -0.511-102.375 1.00 0.00 H
+ATOM 832 1HA GLY H 56 -18.132 1.369-101.155 1.00 0.00 H
+ATOM 833 2HA GLY H 56 -18.519 2.195-102.653 1.00 0.00 H
+ATOM 834 N TYR H 57 -20.695 -0.061-102.201 1.00 91.40 N
+ATOM 835 CA TYR H 57 -22.110 -0.322-101.983 1.00 86.20 C
+ATOM 836 C TYR H 57 -22.404 -0.434-100.494 1.00 98.74 C
+ATOM 837 O TYR H 57 -21.598 -0.960 -99.721 1.00108.82 O
+ATOM 838 CB TYR H 57 -22.523 -1.606-102.705 1.00 84.76 C
+ATOM 839 CG TYR H 57 -24.000 -1.941-102.622 1.00 84.01 C
+ATOM 840 CD1 TYR H 57 -24.920 -1.327-103.464 1.00 92.02 C
+ATOM 841 CD2 TYR H 57 -24.471 -2.894-101.726 1.00 79.84 C
+ATOM 842 CE1 TYR H 57 -26.270 -1.634-103.402 1.00 94.46 C
+ATOM 843 CE2 TYR H 57 -25.820 -3.209-101.657 1.00 89.05 C
+ATOM 844 CZ TYR H 57 -26.714 -2.577-102.499 1.00100.38 C
+ATOM 845 OH TYR H 57 -28.056 -2.886-102.435 1.00106.54 O
+ATOM 846 H TYR H 57 -20.128 -0.766-102.649 1.00 0.00 H
+ATOM 847 HA TYR H 57 -22.682 0.512-102.391 1.00 0.00 H
+ATOM 848 1HB TYR H 57 -22.262 -1.530-103.761 1.00 0.00 H
+ATOM 849 2HB TYR H 57 -21.971 -2.449-102.291 1.00 0.00 H
+ATOM 850 HD1 TYR H 57 -24.584 -0.588-104.192 1.00 0.00 H
+ATOM 851 HD2 TYR H 57 -23.776 -3.407-101.061 1.00 0.00 H
+ATOM 852 HE1 TYR H 57 -26.973 -1.140-104.072 1.00 0.00 H
+ATOM 853 HE2 TYR H 57 -26.170 -3.952-100.940 1.00 0.00 H
+ATOM 854 HH TYR H 57 -28.198 -3.553-101.759 1.00 0.00 H
+ATOM 855 N THR H 58 -23.562 0.079-100.092 1.00 98.17 N
+ATOM 856 CA THR H 58 -24.006 0.009 -98.708 1.00 90.97 C
+ATOM 857 C THR H 58 -25.473 -0.383 -98.683 1.00 89.31 C
+ATOM 858 O THR H 58 -26.245 0.027 -99.553 1.00103.83 O
+ATOM 859 CB THR H 58 -23.816 1.346 -97.978 1.00 87.91 C
+ATOM 860 OG1 THR H 58 -24.442 2.399 -98.724 1.00 87.98 O
+ATOM 861 CG2 THR H 58 -22.338 1.659 -97.797 1.00 88.77 C
+ATOM 862 H THR H 58 -24.151 0.533-100.775 1.00 0.00 H
+ATOM 863 HA THR H 58 -23.410 -0.744 -98.191 1.00 0.00 H
+ATOM 864 HB THR H 58 -24.291 1.296 -96.998 1.00 0.00 H
+ATOM 865 HG1 THR H 58 -24.842 2.034 -99.517 1.00 0.00 H
+ATOM 866 1HG2 THR H 58 -22.229 2.611 -97.277 1.00 0.00 H
+ATOM 867 2HG2 THR H 58 -21.868 0.869 -97.211 1.00 0.00 H
+ATOM 868 3HG2 THR H 58 -21.858 1.722 -98.773 1.00 0.00 H
+ATOM 869 N ASN H 59 -25.854 -1.181 -97.689 1.00 81.28 N
+ATOM 870 CA ASN H 59 -27.260 -1.509 -97.490 1.00 85.52 C
+ATOM 871 C ASN H 59 -27.549 -1.540 -95.997 1.00 89.47 C
+ATOM 872 O ASN H 59 -26.863 -2.237 -95.242 1.00 72.11 O
+ATOM 873 CB ASN H 59 -27.620 -2.846 -98.151 1.00 88.66 C
+ATOM 874 CG ASN H 59 -29.096 -2.951 -98.493 1.00 91.56 C
+ATOM 875 OD1 ASN H 59 -29.961 -2.660 -97.668 1.00 92.46 O
+ATOM 876 ND2 ASN H 59 -29.390 -3.351 -99.725 1.00 92.05 N
+ATOM 877 H ASN H 59 -25.165 -1.568 -97.060 1.00 0.00 H
+ATOM 878 HA ASN H 59 -27.866 -0.727 -97.949 1.00 0.00 H
+ATOM 879 1HB ASN H 59 -27.038 -2.968 -99.065 1.00 0.00 H
+ATOM 880 2HB ASN H 59 -27.355 -3.665 -97.482 1.00 0.00 H
+ATOM 881 1HD2 ASN H 59 -30.346 -3.439-100.008 1.00 0.00 H
+ATOM 882 2HD2 ASN H 59 -28.657 -3.564-100.370 1.00 0.00 H
+ATOM 883 N TYR H 60 -28.551 -0.769 -95.578 1.00 94.79 N
+ATOM 884 CA TYR H 60 -28.915 -0.611 -94.179 1.00 82.84 C
+ATOM 885 C TYR H 60 -30.318 -1.153 -93.944 1.00 83.36 C
+ATOM 886 O TYR H 60 -31.123 -1.277 -94.870 1.00104.47 O
+ATOM 887 CB TYR H 60 -28.857 0.861 -93.752 1.00 81.49 C
+ATOM 888 CG TYR H 60 -27.585 1.570 -94.154 1.00 82.32 C
+ATOM 889 CD1 TYR H 60 -26.345 0.965 -93.999 1.00 80.01 C
+ATOM 890 CD2 TYR H 60 -27.628 2.840 -94.708 1.00 86.87 C
+ATOM 891 CE1 TYR H 60 -25.182 1.615 -94.375 1.00 80.23 C
+ATOM 892 CE2 TYR H 60 -26.476 3.496 -95.086 1.00 88.08 C
+ATOM 893 CZ TYR H 60 -25.256 2.881 -94.919 1.00 84.75 C
+ATOM 894 OH TYR H 60 -24.109 3.541 -95.299 1.00 90.85 O
+ATOM 895 H TYR H 60 -29.078 -0.273 -96.283 1.00 0.00 H
+ATOM 896 HA TYR H 60 -28.204 -1.171 -93.571 1.00 0.00 H
+ATOM 897 1HB TYR H 60 -29.698 1.401 -94.191 1.00 0.00 H
+ATOM 898 2HB TYR H 60 -28.953 0.930 -92.669 1.00 0.00 H
+ATOM 899 HD1 TYR H 60 -26.277 -0.037 -93.576 1.00 0.00 H
+ATOM 900 HD2 TYR H 60 -28.586 3.340 -94.851 1.00 0.00 H
+ATOM 901 HE1 TYR H 60 -24.218 1.124 -94.246 1.00 0.00 H
+ATOM 902 HE2 TYR H 60 -26.534 4.497 -95.514 1.00 0.00 H
+ATOM 903 HH TYR H 60 -24.340 4.403 -95.654 1.00 0.00 H
+ATOM 904 N ALA H 61 -30.607 -1.468 -92.687 1.00 76.80 N
+ATOM 905 CA ALA H 61 -31.918 -1.979 -92.320 1.00 82.65 C
+ATOM 906 C ALA H 61 -32.911 -0.832 -92.210 1.00 82.53 C
+ATOM 907 O ALA H 61 -32.610 0.205 -91.611 1.00 84.76 O
+ATOM 908 CB ALA H 61 -31.845 -2.746 -91.001 1.00 75.04 C
+ATOM 909 H ALA H 61 -29.906 -1.352 -91.969 1.00 0.00 H
+ATOM 910 HA ALA H 61 -32.248 -2.660 -93.105 1.00 0.00 H
+ATOM 911 1HB ALA H 61 -32.835 -3.121 -90.743 1.00 0.00 H
+ATOM 912 2HB ALA H 61 -31.156 -3.584 -91.105 1.00 0.00 H
+ATOM 913 3HB ALA H 61 -31.492 -2.082 -90.214 1.00 0.00 H
+ATOM 914 N GLN H 62 -34.096 -1.016 -92.794 1.00104.30 N
+ATOM 915 CA GLN H 62 -35.142 -0.007 -92.686 1.00103.92 C
+ATOM 916 C GLN H 62 -35.635 0.167 -91.256 1.00102.04 C
+ATOM 917 O GLN H 62 -36.318 1.156 -90.968 1.00 96.22 O
+ATOM 918 CB GLN H 62 -36.319 -0.368 -93.596 1.00101.59 C
+ATOM 919 CG GLN H 62 -37.093 -1.598 -93.154 1.00 0.00 C
+ATOM 920 CD GLN H 62 -38.203 -1.962 -94.122 1.00 0.00 C
+ATOM 921 OE1 GLN H 62 -39.031 -1.121 -94.484 1.00 0.00 O
+ATOM 922 NE2 GLN H 62 -38.228 -3.220 -94.547 1.00 0.00 N
+ATOM 923 H GLN H 62 -34.279 -1.860 -93.318 1.00 0.00 H
+ATOM 924 HA GLN H 62 -34.730 0.953 -92.996 1.00 0.00 H
+ATOM 925 1HB GLN H 62 -37.015 0.470 -93.641 1.00 0.00 H
+ATOM 926 2HB GLN H 62 -35.955 -0.545 -94.608 1.00 0.00 H
+ATOM 927 1HG GLN H 62 -36.407 -2.442 -93.088 1.00 0.00 H
+ATOM 928 2HG GLN H 62 -37.540 -1.402 -92.179 1.00 0.00 H
+ATOM 929 1HE2 GLN H 62 -38.938 -3.519 -95.186 1.00 0.00 H
+ATOM 930 2HE2 GLN H 62 -37.538 -3.869 -94.228 1.00 0.00 H
+ATOM 931 N LYS H 63 -35.301 -0.759 -90.357 1.00 96.62 N
+ATOM 932 CA LYS H 63 -35.677 -0.634 -88.956 1.00 97.72 C
+ATOM 933 C LYS H 63 -34.934 0.489 -88.243 1.00106.70 C
+ATOM 934 O LYS H 63 -35.349 0.882 -87.147 1.00119.53 O
+ATOM 935 CB LYS H 63 -35.434 -1.958 -88.229 1.00 84.92 C
+ATOM 936 CG LYS H 63 -36.374 -3.083 -88.640 1.00 0.00 C
+ATOM 937 CD LYS H 63 -36.111 -4.345 -87.832 1.00 0.00 C
+ATOM 938 CE LYS H 63 -37.127 -5.431 -88.154 1.00 0.00 C
+ATOM 939 NZ LYS H 63 -37.002 -5.912 -89.557 1.00 0.00 N
+ATOM 940 H LYS H 63 -34.774 -1.568 -90.655 1.00 0.00 H
+ATOM 941 HA LYS H 63 -36.740 -0.395 -88.903 1.00 0.00 H
+ATOM 942 1HB LYS H 63 -34.412 -2.291 -88.413 1.00 0.00 H
+ATOM 943 2HB LYS H 63 -35.541 -1.808 -87.155 1.00 0.00 H
+ATOM 944 1HG LYS H 63 -37.407 -2.770 -88.483 1.00 0.00 H
+ATOM 945 2HG LYS H 63 -36.236 -3.304 -89.698 1.00 0.00 H
+ATOM 946 1HD LYS H 63 -35.110 -4.718 -88.055 1.00 0.00 H
+ATOM 947 2HD LYS H 63 -36.165 -4.114 -86.769 1.00 0.00 H
+ATOM 948 1HE LYS H 63 -36.984 -6.274 -87.480 1.00 0.00 H
+ATOM 949 2HE LYS H 63 -38.134 -5.042 -88.006 1.00 0.00 H
+ATOM 950 1HZ LYS H 63 -37.692 -6.629 -89.730 1.00 0.00 H
+ATOM 951 2HZ LYS H 63 -37.152 -5.141 -90.193 1.00 0.00 H
+ATOM 952 3HZ LYS H 63 -36.078 -6.293 -89.702 1.00 0.00 H
+ATOM 953 N LEU H 64 -33.863 1.020 -88.830 1.00101.82 N
+ATOM 954 CA LEU H 64 -33.036 2.022 -88.175 1.00 91.40 C
+ATOM 955 C LEU H 64 -33.308 3.437 -88.668 1.00 96.71 C
+ATOM 956 O LEU H 64 -32.535 4.347 -88.354 1.00108.68 O
+ATOM 957 CB LEU H 64 -31.558 1.670 -88.348 1.00 87.09 C
+ATOM 958 CG LEU H 64 -31.197 0.338 -87.683 1.00 86.28 C
+ATOM 959 CD1 LEU H 64 -29.736 -0.016 -87.868 1.00 78.72 C
+ATOM 960 CD2 LEU H 64 -31.553 0.358 -86.200 1.00 96.14 C
+ATOM 961 H LEU H 64 -33.620 0.714 -89.761 1.00 0.00 H
+ATOM 962 HA LEU H 64 -33.276 2.027 -87.112 1.00 0.00 H
+ATOM 963 1HB LEU H 64 -31.336 1.616 -89.413 1.00 0.00 H
+ATOM 964 2HB LEU H 64 -30.957 2.468 -87.913 1.00 0.00 H
+ATOM 965 HG LEU H 64 -31.747 -0.470 -88.165 1.00 0.00 H
+ATOM 966 1HD1 LEU H 64 -29.528 -0.968 -87.380 1.00 0.00 H
+ATOM 967 2HD1 LEU H 64 -29.513 -0.098 -88.932 1.00 0.00 H
+ATOM 968 3HD1 LEU H 64 -29.115 0.762 -87.426 1.00 0.00 H
+ATOM 969 1HD2 LEU H 64 -31.288 -0.599 -85.749 1.00 0.00 H
+ATOM 970 2HD2 LEU H 64 -31.002 1.158 -85.704 1.00 0.00 H
+ATOM 971 3HD2 LEU H 64 -32.623 0.529 -86.085 1.00 0.00 H
+ATOM 972 N GLN H 65 -34.388 3.640 -89.429 1.00 85.97 N
+ATOM 973 CA GLN H 65 -34.842 4.969 -89.849 1.00 89.82 C
+ATOM 974 C GLN H 65 -33.742 5.761 -90.550 1.00 89.43 C
+ATOM 975 O GLN H 65 -33.694 6.989 -90.464 1.00 92.40 O
+ATOM 976 CB GLN H 65 -35.395 5.766 -88.665 1.00 92.74 C
+ATOM 977 CG GLN H 65 -36.680 5.212 -88.068 1.00107.37 C
+ATOM 978 CD GLN H 65 -36.459 4.548 -86.716 1.00108.92 C
+ATOM 979 OE1 GLN H 65 -35.329 4.238 -86.341 1.00109.96 O
+ATOM 980 NE2 GLN H 65 -37.542 4.339 -85.974 1.00101.23 N
+ATOM 981 H GLN H 65 -34.909 2.826 -89.723 1.00 0.00 H
+ATOM 982 HA GLN H 65 -35.640 4.846 -90.581 1.00 0.00 H
+ATOM 983 1HB GLN H 65 -34.650 5.802 -87.870 1.00 0.00 H
+ATOM 984 2HB GLN H 65 -35.590 6.792 -88.977 1.00 0.00 H
+ATOM 985 1HG GLN H 65 -37.388 6.030 -87.934 1.00 0.00 H
+ATOM 986 2HG GLN H 65 -37.094 4.468 -88.749 1.00 0.00 H
+ATOM 987 1HE2 GLN H 65 -37.458 3.906 -85.076 1.00 0.00 H
+ATOM 988 2HE2 GLN H 65 -38.442 4.614 -86.313 1.00 0.00 H
+ATOM 989 N GLY H 66 -32.845 5.063 -91.242 1.00102.14 N
+ATOM 990 CA GLY H 66 -31.794 5.735 -91.987 1.00102.92 C
+ATOM 991 C GLY H 66 -30.849 6.552 -91.138 1.00100.96 C
+ATOM 992 O GLY H 66 -30.272 7.529 -91.628 1.00 88.24 O
+ATOM 993 H GLY H 66 -32.889 4.054 -91.254 1.00 0.00 H
+ATOM 994 1HA GLY H 66 -31.205 4.997 -92.531 1.00 0.00 H
+ATOM 995 2HA GLY H 66 -32.240 6.398 -92.727 1.00 0.00 H
+ATOM 996 N ARG H 67 -30.679 6.183 -89.872 1.00111.32 N
+ATOM 997 CA ARG H 67 -29.761 6.864 -88.970 1.00103.98 C
+ATOM 998 C ARG H 67 -28.335 6.336 -89.066 1.00108.95 C
+ATOM 999 O ARG H 67 -27.461 6.826 -88.346 1.00 82.64 O
+ATOM 1000 CB ARG H 67 -30.246 6.733 -87.523 1.00 85.63 C
+ATOM 1001 CG ARG H 67 -31.629 7.305 -87.252 1.00 91.35 C
+ATOM 1002 CD ARG H 67 -32.081 6.956 -85.841 1.00 89.30 C
+ATOM 1003 NE ARG H 67 -32.252 5.516 -85.677 1.00 86.09 N
+ATOM 1004 CZ ARG H 67 -32.269 4.889 -84.505 1.00 85.12 C
+ATOM 1005 NH1 ARG H 67 -32.116 5.573 -83.380 1.00 94.91 N
+ATOM 1006 NH2 ARG H 67 -32.430 3.574 -84.459 1.00 82.73 N
+ATOM 1007 H ARG H 67 -31.213 5.397 -89.530 1.00 0.00 H
+ATOM 1008 HA ARG H 67 -29.734 7.921 -89.237 1.00 0.00 H
+ATOM 1009 1HB ARG H 67 -30.265 5.682 -87.240 1.00 0.00 H
+ATOM 1010 2HB ARG H 67 -29.546 7.238 -86.857 1.00 0.00 H
+ATOM 1011 1HG ARG H 67 -31.601 8.390 -87.357 1.00 0.00 H
+ATOM 1012 2HG ARG H 67 -32.341 6.889 -87.966 1.00 0.00 H
+ATOM 1013 1HD ARG H 67 -31.335 7.299 -85.125 1.00 0.00 H
+ATOM 1014 2HD ARG H 67 -33.033 7.443 -85.633 1.00 0.00 H
+ATOM 1015 HE ARG H 67 -32.365 4.958 -86.513 1.00 0.00 H
+ATOM 1016 1HH1 ARG H 67 -31.986 6.574 -83.411 1.00 0.00 H
+ATOM 1017 2HH1 ARG H 67 -32.129 5.093 -82.492 1.00 0.00 H
+ATOM 1018 1HH2 ARG H 67 -32.540 3.048 -85.315 1.00 0.00 H
+ATOM 1019 2HH2 ARG H 67 -32.443 3.098 -83.569 1.00 0.00 H
+ATOM 1020 N VAL H 68 -28.076 5.361 -89.936 1.00109.79 N
+ATOM 1021 CA VAL H 68 -26.792 4.672 -89.978 1.00 97.49 C
+ATOM 1022 C VAL H 68 -25.982 5.184 -91.156 1.00102.65 C
+ATOM 1023 O VAL H 68 -26.526 5.565 -92.200 1.00110.02 O
+ATOM 1024 CB VAL H 68 -26.986 3.146 -90.064 1.00 83.09 C
+ATOM 1025 CG1 VAL H 68 -25.739 2.423 -89.575 1.00 71.31 C
+ATOM 1026 CG2 VAL H 68 -28.204 2.738 -89.276 1.00 78.42 C
+ATOM 1027 H VAL H 68 -28.799 5.093 -90.588 1.00 0.00 H
+ATOM 1028 HA VAL H 68 -26.248 4.898 -89.060 1.00 0.00 H
+ATOM 1029 HB VAL H 68 -27.117 2.864 -91.109 1.00 0.00 H
+ATOM 1030 1HG1 VAL H 68 -25.893 1.346 -89.643 1.00 0.00 H
+ATOM 1031 2HG1 VAL H 68 -24.888 2.707 -90.193 1.00 0.00 H
+ATOM 1032 3HG1 VAL H 68 -25.543 2.696 -88.538 1.00 0.00 H
+ATOM 1033 1HG2 VAL H 68 -28.335 1.658 -89.342 1.00 0.00 H
+ATOM 1034 2HG2 VAL H 68 -28.075 3.025 -88.232 1.00 0.00 H
+ATOM 1035 3HG2 VAL H 68 -29.084 3.236 -89.683 1.00 0.00 H
+ATOM 1036 N THR H 69 -24.661 5.190 -90.988 1.00102.81 N
+ATOM 1037 CA THR H 69 -23.753 5.618 -92.050 1.00101.20 C
+ATOM 1038 C THR H 69 -22.456 4.836 -91.898 1.00 94.62 C
+ATOM 1039 O THR H 69 -21.731 5.023 -90.917 1.00 91.40 O
+ATOM 1040 CB THR H 69 -23.498 7.123 -91.988 1.00101.83 C
+ATOM 1041 OG1 THR H 69 -24.717 7.831 -92.244 1.00111.05 O
+ATOM 1042 CG2 THR H 69 -22.460 7.526 -93.021 1.00 91.69 C
+ATOM 1043 H THR H 69 -24.277 4.891 -90.103 1.00 0.00 H
+ATOM 1044 HA THR H 69 -24.213 5.389 -93.012 1.00 0.00 H
+ATOM 1045 HB THR H 69 -23.139 7.390 -90.994 1.00 0.00 H
+ATOM 1046 HG1 THR H 69 -25.426 7.202 -92.398 1.00 0.00 H
+ATOM 1047 1HG2 THR H 69 -22.289 8.601 -92.964 1.00 0.00 H
+ATOM 1048 2HG2 THR H 69 -21.527 6.999 -92.824 1.00 0.00 H
+ATOM 1049 3HG2 THR H 69 -22.819 7.268 -94.017 1.00 0.00 H
+ATOM 1050 N MET H 70 -22.164 3.969 -92.862 1.00 88.92 N
+ATOM 1051 CA MET H 70 -20.956 3.155 -92.839 1.00 80.38 C
+ATOM 1052 C MET H 70 -19.956 3.701 -93.846 1.00 87.91 C
+ATOM 1053 O MET H 70 -20.321 4.015 -94.983 1.00 94.19 O
+ATOM 1054 CB MET H 70 -21.272 1.694 -93.156 1.00 68.88 C
+ATOM 1055 CG MET H 70 -22.160 1.034 -92.129 1.00 73.28 C
+ATOM 1056 SD MET H 70 -22.578 -0.667 -92.522 1.00 71.91 S
+ATOM 1057 CE MET H 70 -23.594 -1.057 -91.104 1.00 73.27 C
+ATOM 1058 H MET H 70 -22.806 3.875 -93.636 1.00 0.00 H
+ATOM 1059 HA MET H 70 -20.525 3.204 -91.839 1.00 0.00 H
+ATOM 1060 1HB MET H 70 -21.763 1.631 -94.126 1.00 0.00 H
+ATOM 1061 2HB MET H 70 -20.343 1.127 -93.222 1.00 0.00 H
+ATOM 1062 1HG MET H 70 -21.663 1.041 -91.160 1.00 0.00 H
+ATOM 1063 2HG MET H 70 -23.090 1.594 -92.038 1.00 0.00 H
+ATOM 1064 1HE MET H 70 -23.946 -2.086 -91.180 1.00 0.00 H
+ATOM 1065 2HE MET H 70 -23.007 -0.940 -90.192 1.00 0.00 H
+ATOM 1066 3HE MET H 70 -24.450 -0.383 -91.073 1.00 0.00 H
+ATOM 1067 N THR H 71 -18.700 3.815 -93.426 1.00 92.61 N
+ATOM 1068 CA THR H 71 -17.621 4.264 -94.290 1.00 95.21 C
+ATOM 1069 C THR H 71 -16.458 3.288 -94.183 1.00 99.78 C
+ATOM 1070 O THR H 71 -16.440 2.394 -93.331 1.00101.04 O
+ATOM 1071 CB THR H 71 -17.164 5.688 -93.939 1.00102.32 C
+ATOM 1072 OG1 THR H 71 -16.855 5.767 -92.543 1.00113.94 O
+ATOM 1073 CG2 THR H 71 -18.256 6.693 -94.267 1.00104.99 C
+ATOM 1074 H THR H 71 -18.495 3.578 -92.466 1.00 0.00 H
+ATOM 1075 HA THR H 71 -17.981 4.270 -95.319 1.00 0.00 H
+ATOM 1076 HB THR H 71 -16.268 5.934 -94.509 1.00 0.00 H
+ATOM 1077 HG1 THR H 71 -17.002 4.911 -92.134 1.00 0.00 H
+ATOM 1078 1HG2 THR H 71 -17.915 7.696 -94.012 1.00 0.00 H
+ATOM 1079 2HG2 THR H 71 -18.486 6.646 -95.331 1.00 0.00 H
+ATOM 1080 3HG2 THR H 71 -19.151 6.458 -93.693 1.00 0.00 H
+ATOM 1081 N THR H 72 -15.472 3.478 -95.058 1.00104.79 N
+ATOM 1082 CA THR H 72 -14.364 2.541 -95.174 1.00108.40 C
+ATOM 1083 C THR H 72 -13.112 3.270 -95.638 1.00112.85 C
+ATOM 1084 O THR H 72 -13.155 4.019 -96.619 1.00131.42 O
+ATOM 1085 CB THR H 72 -14.713 1.414 -96.153 1.00113.35 C
+ATOM 1086 OG1 THR H 72 -15.571 0.466 -95.508 1.00111.24 O
+ATOM 1087 CG2 THR H 72 -13.460 0.720 -96.638 1.00122.12 C
+ATOM 1088 H THR H 72 -15.493 4.292 -95.656 1.00 0.00 H
+ATOM 1089 HA THR H 72 -14.176 2.104 -94.193 1.00 0.00 H
+ATOM 1090 HB THR H 72 -15.245 1.828 -97.009 1.00 0.00 H
+ATOM 1091 HG1 THR H 72 -15.737 0.748 -94.605 1.00 0.00 H
+ATOM 1092 1HG2 THR H 72 -13.730 -0.076 -97.332 1.00 0.00 H
+ATOM 1093 2HG2 THR H 72 -12.818 1.441 -97.144 1.00 0.00 H
+ATOM 1094 3HG2 THR H 72 -12.928 0.295 -95.788 1.00 0.00 H
+ATOM 1095 N ASP H 73 -12.005 3.047 -94.930 1.00100.45 N
+ATOM 1096 CA ASP H 73 -10.689 3.533 -95.331 1.00101.71 C
+ATOM 1097 C ASP H 73 -9.879 2.328 -95.794 1.00104.27 C
+ATOM 1098 O ASP H 73 -9.508 1.470 -94.983 1.00106.38 O
+ATOM 1099 CB ASP H 73 -9.994 4.269 -94.186 1.00116.83 C
+ATOM 1100 CG ASP H 73 -8.813 5.109 -94.655 1.00125.31 C
+ATOM 1101 OD1 ASP H 73 -8.094 4.677 -95.580 1.00127.27 O
+ATOM 1102 OD2 ASP H 73 -8.605 6.207 -94.094 1.00127.50 O
+ATOM 1103 H ASP H 73 -12.094 2.515 -94.076 1.00 0.00 H
+ATOM 1104 HA ASP H 73 -10.816 4.232 -96.158 1.00 0.00 H
+ATOM 1105 1HB ASP H 73 -10.710 4.921 -93.685 1.00 0.00 H
+ATOM 1106 2HB ASP H 73 -9.639 3.546 -93.451 1.00 0.00 H
+ATOM 1107 N THR H 74 -9.614 2.268 -97.100 1.00110.47 N
+ATOM 1108 CA THR H 74 -8.913 1.130 -97.684 1.00110.65 C
+ATOM 1109 C THR H 74 -7.410 1.212 -97.447 1.00115.38 C
+ATOM 1110 O THR H 74 -6.765 0.189 -97.187 1.00109.30 O
+ATOM 1111 CB THR H 74 -9.209 1.054 -99.182 1.00110.45 C
+ATOM 1112 OG1 THR H 74 -10.623 0.936 -99.385 1.00102.99 O
+ATOM 1113 CG2 THR H 74 -8.513 -0.144 -99.800 1.00116.87 C
+ATOM 1114 H THR H 74 -9.905 3.027 -97.699 1.00 0.00 H
+ATOM 1115 HA THR H 74 -9.272 0.219 -97.205 1.00 0.00 H
+ATOM 1116 HB THR H 74 -8.857 1.963 -99.669 1.00 0.00 H
+ATOM 1117 HG1 THR H 74 -11.068 0.931 -98.534 1.00 0.00 H
+ATOM 1118 1HG2 THR H 74 -8.734 -0.183-100.866 1.00 0.00 H
+ATOM 1119 2HG2 THR H 74 -7.437 -0.054 -99.655 1.00 0.00 H
+ATOM 1120 3HG2 THR H 74 -8.868 -1.057 -99.323 1.00 0.00 H
+ATOM 1121 N SER H 75 -6.838 2.417 -97.537 1.00122.07 N
+ATOM 1122 CA SER H 75 -5.401 2.574 -97.333 1.00123.82 C
+ATOM 1123 C SER H 75 -4.982 2.126 -95.939 1.00127.19 C
+ATOM 1124 O SER H 75 -3.856 1.650 -95.752 1.00125.36 O
+ATOM 1125 CB SER H 75 -4.991 4.027 -97.574 1.00120.15 C
+ATOM 1126 OG SER H 75 -5.705 4.909 -96.727 1.00111.55 O
+ATOM 1127 H SER H 75 -7.397 3.231 -97.748 1.00 0.00 H
+ATOM 1128 HA SER H 75 -4.878 1.938 -98.048 1.00 0.00 H
+ATOM 1129 1HB SER H 75 -3.922 4.137 -97.396 1.00 0.00 H
+ATOM 1130 2HB SER H 75 -5.178 4.290 -98.614 1.00 0.00 H
+ATOM 1131 HG SER H 75 -6.285 4.356 -96.198 1.00 0.00 H
+ATOM 1132 N THR H 76 -5.872 2.263 -94.955 1.00131.62 N
+ATOM 1133 CA THR H 76 -5.636 1.770 -93.606 1.00136.33 C
+ATOM 1134 C THR H 76 -6.432 0.513 -93.281 1.00132.07 C
+ATOM 1135 O THR H 76 -6.243 -0.053 -92.198 1.00130.05 O
+ATOM 1136 CB THR H 76 -5.968 2.856 -92.571 1.00139.59 C
+ATOM 1137 OG1 THR H 76 -7.381 3.092 -92.561 1.00134.19 O
+ATOM 1138 CG2 THR H 76 -5.245 4.152 -92.907 1.00145.25 C
+ATOM 1139 H THR H 76 -6.743 2.729 -95.163 1.00 0.00 H
+ATOM 1140 HA THR H 76 -4.581 1.510 -93.512 1.00 0.00 H
+ATOM 1141 HB THR H 76 -5.660 2.521 -91.581 1.00 0.00 H
+ATOM 1142 HG1 THR H 76 -7.805 2.518 -93.204 1.00 0.00 H
+ATOM 1143 1HG2 THR H 76 -5.492 4.909 -92.163 1.00 0.00 H
+ATOM 1144 2HG2 THR H 76 -4.169 3.979 -92.906 1.00 0.00 H
+ATOM 1145 3HG2 THR H 76 -5.556 4.497 -93.892 1.00 0.00 H
+ATOM 1146 N SER H 77 -7.313 0.072 -94.184 1.00129.44 N
+ATOM 1147 CA SER H 77 -8.096 -1.156 -94.023 1.00117.33 C
+ATOM 1148 C SER H 77 -8.890 -1.152 -92.715 1.00 94.22 C
+ATOM 1149 O SER H 77 -8.871 -2.114 -91.944 1.00 79.30 O
+ATOM 1150 CB SER H 77 -7.202 -2.396 -94.122 1.00127.10 C
+ATOM 1151 OG SER H 77 -6.300 -2.476 -93.033 1.00141.77 O
+ATOM 1152 H SER H 77 -7.435 0.627 -95.019 1.00 0.00 H
+ATOM 1153 HA SER H 77 -8.837 -1.202 -94.823 1.00 0.00 H
+ATOM 1154 1HB SER H 77 -7.823 -3.291 -94.143 1.00 0.00 H
+ATOM 1155 2HB SER H 77 -6.640 -2.366 -95.055 1.00 0.00 H
+ATOM 1156 HG SER H 77 -6.478 -1.708 -92.485 1.00 0.00 H
+ATOM 1157 N THR H 78 -9.603 -0.053 -92.471 1.00 89.64 N
+ATOM 1158 CA THR H 78 -10.453 0.068 -91.295 1.00 97.81 C
+ATOM 1159 C THR H 78 -11.861 0.456 -91.724 1.00 95.43 C
+ATOM 1160 O THR H 78 -12.054 1.140 -92.733 1.00 92.20 O
+ATOM 1161 CB THR H 78 -9.914 1.108 -90.292 1.00109.39 C
+ATOM 1162 OG1 THR H 78 -9.983 2.417 -90.869 1.00124.82 O
+ATOM 1163 CG2 THR H 78 -8.468 0.806 -89.925 1.00109.72 C
+ATOM 1164 H THR H 78 -9.551 0.718 -93.122 1.00 0.00 H
+ATOM 1165 HA THR H 78 -10.484 -0.898 -90.790 1.00 0.00 H
+ATOM 1166 HB THR H 78 -10.521 1.090 -89.387 1.00 0.00 H
+ATOM 1167 HG1 THR H 78 -10.350 2.357 -91.754 1.00 0.00 H
+ATOM 1168 1HG2 THR H 78 -8.109 1.552 -89.216 1.00 0.00 H
+ATOM 1169 2HG2 THR H 78 -8.407 -0.184 -89.473 1.00 0.00 H
+ATOM 1170 3HG2 THR H 78 -7.852 0.833 -90.823 1.00 0.00 H
+ATOM 1171 N ALA H 79 -12.844 0.011 -90.947 1.00 92.06 N
+ATOM 1172 CA ALA H 79 -14.246 0.303 -91.202 1.00 88.53 C
+ATOM 1173 C ALA H 79 -14.791 1.236 -90.128 1.00 90.50 C
+ATOM 1174 O ALA H 79 -14.315 1.243 -88.990 1.00100.12 O
+ATOM 1175 CB ALA H 79 -15.079 -0.982 -91.245 1.00 85.03 C
+ATOM 1176 H ALA H 79 -12.597 -0.554 -90.147 1.00 0.00 H
+ATOM 1177 HA ALA H 79 -14.318 0.795 -92.172 1.00 0.00 H
+ATOM 1178 1HB ALA H 79 -16.123 -0.733 -91.437 1.00 0.00 H
+ATOM 1179 2HB ALA H 79 -14.708 -1.630 -92.040 1.00 0.00 H
+ATOM 1180 3HB ALA H 79 -15.000 -1.499 -90.290 1.00 0.00 H
+ATOM 1181 N TYR H 80 -15.796 2.030 -90.498 1.00 93.78 N
+ATOM 1182 CA TYR H 80 -16.407 2.968 -89.568 1.00 95.86 C
+ATOM 1183 C TYR H 80 -17.922 2.885 -89.663 1.00 97.66 C
+ATOM 1184 O TYR H 80 -18.481 2.727 -90.753 1.00107.86 O
+ATOM 1185 CB TYR H 80 -15.957 4.411 -89.834 1.00 98.24 C
+ATOM 1186 CG TYR H 80 -14.466 4.626 -89.736 1.00 97.24 C
+ATOM 1187 CD1 TYR H 80 -13.865 4.932 -88.522 1.00 86.53 C
+ATOM 1188 CD2 TYR H 80 -13.660 4.537 -90.863 1.00102.65 C
+ATOM 1189 CE1 TYR H 80 -12.500 5.132 -88.433 1.00 98.51 C
+ATOM 1190 CE2 TYR H 80 -12.297 4.736 -90.784 1.00111.13 C
+ATOM 1191 CZ TYR H 80 -11.722 5.033 -89.568 1.00115.96 C
+ATOM 1192 OH TYR H 80 -10.362 5.231 -89.494 1.00129.88 O
+ATOM 1193 H TYR H 80 -16.142 1.980 -91.445 1.00 0.00 H
+ATOM 1194 HA TYR H 80 -16.101 2.701 -88.556 1.00 0.00 H
+ATOM 1195 1HB TYR H 80 -16.274 4.713 -90.833 1.00 0.00 H
+ATOM 1196 2HB TYR H 80 -16.439 5.080 -89.121 1.00 0.00 H
+ATOM 1197 HD1 TYR H 80 -14.471 5.018 -87.620 1.00 0.00 H
+ATOM 1198 HD2 TYR H 80 -14.102 4.307 -91.832 1.00 0.00 H
+ATOM 1199 HE1 TYR H 80 -12.046 5.371 -87.472 1.00 0.00 H
+ATOM 1200 HE2 TYR H 80 -11.682 4.659 -91.681 1.00 0.00 H
+ATOM 1201 HH TYR H 80 -9.976 5.126 -90.367 1.00 0.00 H
+ATOM 1202 N MET H 81 -18.579 3.002 -88.513 1.00 87.30 N
+ATOM 1203 CA MET H 81 -20.030 3.002 -88.420 1.00 86.43 C
+ATOM 1204 C MET H 81 -20.470 4.199 -87.589 1.00 94.78 C
+ATOM 1205 O MET H 81 -19.874 4.496 -86.552 1.00 93.63 O
+ATOM 1206 CB MET H 81 -20.535 1.694 -87.797 1.00 86.90 C
+ATOM 1207 CG MET H 81 -22.018 1.428 -87.968 1.00 94.06 C
+ATOM 1208 SD MET H 81 -23.016 2.297 -86.749 1.00109.31 S
+ATOM 1209 CE MET H 81 -23.165 1.042 -85.486 1.00106.95 C
+ATOM 1210 H MET H 81 -18.032 3.095 -87.669 1.00 0.00 H
+ATOM 1211 HA MET H 81 -20.441 3.087 -89.426 1.00 0.00 H
+ATOM 1212 1HB MET H 81 -20.000 0.853 -88.235 1.00 0.00 H
+ATOM 1213 2HB MET H 81 -20.324 1.695 -86.727 1.00 0.00 H
+ATOM 1214 1HG MET H 81 -22.332 1.744 -88.962 1.00 0.00 H
+ATOM 1215 2HG MET H 81 -22.209 0.359 -87.874 1.00 0.00 H
+ATOM 1216 1HE MET H 81 -23.759 1.428 -84.658 1.00 0.00 H
+ATOM 1217 2HE MET H 81 -23.653 0.161 -85.904 1.00 0.00 H
+ATOM 1218 3HE MET H 81 -22.173 0.770 -85.125 1.00 0.00 H
+ATOM 1219 N GLU H 82 -21.507 4.893 -88.052 1.00102.00 N
+ATOM 1220 CA GLU H 82 -22.036 6.060 -87.360 1.00100.52 C
+ATOM 1221 C GLU H 82 -23.529 5.880 -87.155 1.00 93.82 C
+ATOM 1222 O GLU H 82 -24.260 5.591 -88.109 1.00104.76 O
+ATOM 1223 CB GLU H 82 -21.766 7.352 -88.143 1.00117.99 C
+ATOM 1224 CG GLU H 82 -22.535 8.563 -87.623 1.00132.98 C
+ATOM 1225 CD GLU H 82 -22.284 9.819 -88.441 1.00149.04 C
+ATOM 1226 OE1 GLU H 82 -21.194 9.935 -89.040 1.00156.26 O
+ATOM 1227 OE2 GLU H 82 -23.176 10.693 -88.483 1.00152.95 O
+ATOM 1228 H GLU H 82 -21.939 4.595 -88.915 1.00 0.00 H
+ATOM 1229 HA GLU H 82 -21.542 6.141 -86.391 1.00 0.00 H
+ATOM 1230 1HB GLU H 82 -20.702 7.585 -88.105 1.00 0.00 H
+ATOM 1231 2HB GLU H 82 -22.032 7.205 -89.190 1.00 0.00 H
+ATOM 1232 1HG GLU H 82 -23.601 8.339 -87.641 1.00 0.00 H
+ATOM 1233 2HG GLU H 82 -22.248 8.746 -86.588 1.00 0.00 H
+ATOM 1234 N LEU H 83 -23.976 6.047 -85.911 1.00 79.27 N
+ATOM 1235 CA LEU H 83 -25.390 5.987 -85.556 1.00 79.77 C
+ATOM 1236 C LEU H 83 -25.787 7.328 -84.950 1.00 83.75 C
+ATOM 1237 O LEU H 83 -25.300 7.699 -83.874 1.00 85.12 O
+ATOM 1238 CB LEU H 83 -25.666 4.835 -84.590 1.00 77.65 C
+ATOM 1239 CG LEU H 83 -27.139 4.495 -84.358 1.00 77.99 C
+ATOM 1240 CD1 LEU H 83 -27.857 4.251 -85.675 1.00 77.48 C
+ATOM 1241 CD2 LEU H 83 -27.268 3.288 -83.447 1.00 76.17 C
+ATOM 1242 H LEU H 83 -23.294 6.223 -85.187 1.00 0.00 H
+ATOM 1243 HA LEU H 83 -25.968 5.819 -86.464 1.00 0.00 H
+ATOM 1244 1HB LEU H 83 -25.177 3.939 -84.969 1.00 0.00 H
+ATOM 1245 2HB LEU H 83 -25.228 5.080 -83.622 1.00 0.00 H
+ATOM 1246 HG LEU H 83 -27.640 5.345 -83.893 1.00 0.00 H
+ATOM 1247 1HD1 LEU H 83 -28.903 4.011 -85.481 1.00 0.00 H
+ATOM 1248 2HD1 LEU H 83 -27.800 5.148 -86.292 1.00 0.00 H
+ATOM 1249 3HD1 LEU H 83 -27.386 3.419 -86.197 1.00 0.00 H
+ATOM 1250 1HD2 LEU H 83 -28.323 3.060 -83.292 1.00 0.00 H
+ATOM 1251 2HD2 LEU H 83 -26.776 2.431 -83.907 1.00 0.00 H
+ATOM 1252 3HD2 LEU H 83 -26.799 3.505 -82.487 1.00 0.00 H
+ATOM 1253 N ARG H 84 -26.658 8.053 -85.646 1.00 86.03 N
+ATOM 1254 CA ARG H 84 -27.152 9.353 -85.219 1.00 96.01 C
+ATOM 1255 C ARG H 84 -28.527 9.209 -84.576 1.00 96.39 C
+ATOM 1256 O ARG H 84 -29.174 8.163 -84.661 1.00 99.99 O
+ATOM 1257 CB ARG H 84 -27.230 10.319 -86.407 1.00106.49 C
+ATOM 1258 CG ARG H 84 -25.975 10.385 -87.256 1.00101.87 C
+ATOM 1259 CD ARG H 84 -26.205 11.213 -88.513 1.00 98.55 C
+ATOM 1260 NE ARG H 84 -27.303 10.681 -89.315 1.00112.61 N
+ATOM 1261 CZ ARG H 84 -27.172 9.719 -90.224 1.00116.78 C
+ATOM 1262 NH1 ARG H 84 -28.231 9.302 -90.907 1.00117.58 N
+ATOM 1263 NH2 ARG H 84 -25.987 9.164 -90.448 1.00106.90 N
+ATOM 1264 H ARG H 84 -26.986 7.665 -86.519 1.00 0.00 H
+ATOM 1265 HA ARG H 84 -26.458 9.762 -84.484 1.00 0.00 H
+ATOM 1266 1HB ARG H 84 -28.054 10.030 -87.057 1.00 0.00 H
+ATOM 1267 2HB ARG H 84 -27.437 11.326 -86.044 1.00 0.00 H
+ATOM 1268 1HG ARG H 84 -25.170 10.842 -86.680 1.00 0.00 H
+ATOM 1269 2HG ARG H 84 -25.682 9.377 -87.552 1.00 0.00 H
+ATOM 1270 1HD ARG H 84 -26.449 12.238 -88.234 1.00 0.00 H
+ATOM 1271 2HD ARG H 84 -25.302 11.208 -89.122 1.00 0.00 H
+ATOM 1272 HE ARG H 84 -28.224 11.071 -89.168 1.00 0.00 H
+ATOM 1273 1HH1 ARG H 84 -29.137 9.715 -90.736 1.00 0.00 H
+ATOM 1274 2HH1 ARG H 84 -28.131 8.572 -91.597 1.00 0.00 H
+ATOM 1275 1HH2 ARG H 84 -25.178 9.472 -89.926 1.00 0.00 H
+ATOM 1276 2HH2 ARG H 84 -25.894 8.435 -91.139 1.00 0.00 H
+ATOM 1277 N SER H 85 -28.974 10.292 -83.938 1.00 95.61 N
+ATOM 1278 CA SER H 85 -30.280 10.342 -83.283 1.00101.36 C
+ATOM 1279 C SER H 85 -30.458 9.166 -82.324 1.00109.03 C
+ATOM 1280 O SER H 85 -31.434 8.414 -82.390 1.00119.52 O
+ATOM 1281 CB SER H 85 -31.406 10.382 -84.317 1.00 98.77 C
+ATOM 1282 OG SER H 85 -31.309 11.539 -85.127 1.00120.81 O
+ATOM 1283 H SER H 85 -28.379 11.107 -83.911 1.00 0.00 H
+ATOM 1284 HA SER H 85 -30.331 11.251 -82.681 1.00 0.00 H
+ATOM 1285 1HB SER H 85 -31.357 9.491 -84.943 1.00 0.00 H
+ATOM 1286 2HB SER H 85 -32.368 10.371 -83.807 1.00 0.00 H
+ATOM 1287 HG SER H 85 -30.539 12.018 -84.812 1.00 0.00 H
+ATOM 1288 N LEU H 86 -29.489 9.008 -81.425 1.00 97.48 N
+ATOM 1289 CA LEU H 86 -29.487 7.875 -80.513 1.00 93.68 C
+ATOM 1290 C LEU H 86 -30.663 7.944 -79.546 1.00 96.27 C
+ATOM 1291 O LEU H 86 -30.986 9.003 -79.002 1.00 99.02 O
+ATOM 1292 CB LEU H 86 -28.175 7.826 -79.733 1.00 90.41 C
+ATOM 1293 CG LEU H 86 -26.925 7.469 -80.535 1.00 91.85 C
+ATOM 1294 CD1 LEU H 86 -25.674 7.680 -79.698 1.00 92.85 C
+ATOM 1295 CD2 LEU H 86 -27.006 6.037 -81.024 1.00 87.92 C
+ATOM 1296 H LEU H 86 -28.740 9.684 -81.372 1.00 0.00 H
+ATOM 1297 HA LEU H 86 -29.581 6.961 -81.098 1.00 0.00 H
+ATOM 1298 1HB LEU H 86 -28.004 8.801 -79.280 1.00 0.00 H
+ATOM 1299 2HB LEU H 86 -28.272 7.090 -78.935 1.00 0.00 H
+ATOM 1300 HG LEU H 86 -26.842 8.134 -81.395 1.00 0.00 H
+ATOM 1301 1HD1 LEU H 86 -24.794 7.420 -80.287 1.00 0.00 H
+ATOM 1302 2HD1 LEU H 86 -25.611 8.725 -79.395 1.00 0.00 H
+ATOM 1303 3HD1 LEU H 86 -25.718 7.046 -78.813 1.00 0.00 H
+ATOM 1304 1HD2 LEU H 86 -26.109 5.796 -81.595 1.00 0.00 H
+ATOM 1305 2HD2 LEU H 86 -27.084 5.364 -80.169 1.00 0.00 H
+ATOM 1306 3HD2 LEU H 86 -27.883 5.919 -81.660 1.00 0.00 H
+ATOM 1307 N ARG H 87 -31.304 6.800 -79.341 1.00 98.08 N
+ATOM 1308 CA ARG H 87 -32.360 6.633 -78.358 1.00107.51 C
+ATOM 1309 C ARG H 87 -31.906 5.620 -77.317 1.00116.79 C
+ATOM 1310 O ARG H 87 -30.911 4.914 -77.498 1.00122.69 O
+ATOM 1311 CB ARG H 87 -33.664 6.179 -79.026 1.00110.12 C
+ATOM 1312 CG ARG H 87 -34.261 7.197 -79.985 1.00121.79 C
+ATOM 1313 CD ARG H 87 -34.735 6.538 -81.271 1.00120.21 C
+ATOM 1314 NE ARG H 87 -35.566 5.365 -81.020 1.00118.37 N
+ATOM 1315 CZ ARG H 87 -36.087 4.603 -81.976 1.00122.89 C
+ATOM 1316 NH1 ARG H 87 -35.863 4.892 -83.250 1.00119.75 N
+ATOM 1317 NH2 ARG H 87 -36.829 3.552 -81.660 1.00129.73 N
+ATOM 1318 H ARG H 87 -31.031 6.010 -79.908 1.00 0.00 H
+ATOM 1319 HA ARG H 87 -32.537 7.594 -77.874 1.00 0.00 H
+ATOM 1320 1HB ARG H 87 -33.487 5.259 -79.581 1.00 0.00 H
+ATOM 1321 2HB ARG H 87 -34.409 5.962 -78.260 1.00 0.00 H
+ATOM 1322 1HG ARG H 87 -35.114 7.685 -79.513 1.00 0.00 H
+ATOM 1323 2HG ARG H 87 -33.508 7.945 -80.237 1.00 0.00 H
+ATOM 1324 1HD ARG H 87 -35.323 7.250 -81.849 1.00 0.00 H
+ATOM 1325 2HD ARG H 87 -33.873 6.221 -81.856 1.00 0.00 H
+ATOM 1326 HE ARG H 87 -35.755 5.120 -80.057 1.00 0.00 H
+ATOM 1327 1HH1 ARG H 87 -35.296 5.692 -83.494 1.00 0.00 H
+ATOM 1328 2HH1 ARG H 87 -36.259 4.313 -83.976 1.00 0.00 H
+ATOM 1329 1HH2 ARG H 87 -37.000 3.328 -80.689 1.00 0.00 H
+ATOM 1330 2HH2 ARG H 87 -37.223 2.975 -82.388 1.00 0.00 H
+ATOM 1331 N SER H 88 -32.644 5.553 -76.206 1.00113.94 N
+ATOM 1332 CA SER H 88 -32.369 4.523 -75.212 1.00102.21 C
+ATOM 1333 C SER H 88 -32.505 3.122 -75.795 1.00102.79 C
+ATOM 1334 O SER H 88 -31.887 2.186 -75.279 1.00 97.80 O
+ATOM 1335 CB SER H 88 -33.299 4.682 -74.011 1.00104.34 C
+ATOM 1336 OG SER H 88 -34.650 4.501 -74.391 1.00116.46 O
+ATOM 1337 H SER H 88 -33.395 6.208 -76.041 1.00 0.00 H
+ATOM 1338 HA SER H 88 -31.338 4.635 -74.873 1.00 0.00 H
+ATOM 1339 1HB SER H 88 -33.032 3.954 -73.245 1.00 0.00 H
+ATOM 1340 2HB SER H 88 -33.169 5.673 -73.579 1.00 0.00 H
+ATOM 1341 HG SER H 88 -34.638 4.319 -75.334 1.00 0.00 H
+ATOM 1342 N ASP H 89 -33.294 2.963 -76.863 1.00110.40 N
+ATOM 1343 CA ASP H 89 -33.399 1.670 -77.532 1.00112.99 C
+ATOM 1344 C ASP H 89 -32.052 1.202 -78.063 1.00104.09 C
+ATOM 1345 O ASP H 89 -31.806 -0.005 -78.151 1.00117.04 O
+ATOM 1346 CB ASP H 89 -34.402 1.745 -78.686 1.00133.97 C
+ATOM 1347 CG ASP H 89 -35.770 2.230 -78.250 1.00155.37 C
+ATOM 1348 OD1 ASP H 89 -36.612 1.383 -77.886 1.00166.26 O
+ATOM 1349 OD2 ASP H 89 -36.007 3.456 -78.285 1.00160.60 O
+ATOM 1350 H ASP H 89 -33.827 3.745 -77.216 1.00 0.00 H
+ATOM 1351 HA ASP H 89 -33.753 0.934 -76.809 1.00 0.00 H
+ATOM 1352 1HB ASP H 89 -34.023 2.419 -79.455 1.00 0.00 H
+ATOM 1353 2HB ASP H 89 -34.510 0.759 -79.139 1.00 0.00 H
+ATOM 1354 N ASP H 90 -31.174 2.136 -78.421 1.00 91.17 N
+ATOM 1355 CA ASP H 90 -29.915 1.804 -79.076 1.00 79.99 C
+ATOM 1356 C ASP H 90 -28.814 1.401 -78.104 1.00 79.27 C
+ATOM 1357 O ASP H 90 -27.712 1.068 -78.553 1.00 77.28 O
+ATOM 1358 CB ASP H 90 -29.445 2.985 -79.930 1.00 84.68 C
+ATOM 1359 CG ASP H 90 -30.395 3.291 -81.075 1.00 96.69 C
+ATOM 1360 OD1 ASP H 90 -31.080 2.359 -81.549 1.00 83.72 O
+ATOM 1361 OD2 ASP H 90 -30.464 4.466 -81.495 1.00110.28 O
+ATOM 1362 H ASP H 90 -31.390 3.104 -78.232 1.00 0.00 H
+ATOM 1363 HA ASP H 90 -30.079 0.942 -79.724 1.00 0.00 H
+ATOM 1364 1HB ASP H 90 -29.351 3.872 -79.304 1.00 0.00 H
+ATOM 1365 2HB ASP H 90 -28.458 2.768 -80.340 1.00 0.00 H
+ATOM 1366 N THR H 91 -29.072 1.428 -76.797 1.00 81.20 N
+ATOM 1367 CA THR H 91 -28.105 0.917 -75.834 1.00 83.27 C
+ATOM 1368 C THR H 91 -27.883 -0.567 -76.088 1.00 82.50 C
+ATOM 1369 O THR H 91 -28.794 -1.374 -75.873 1.00 81.57 O
+ATOM 1370 CB THR H 91 -28.586 1.148 -74.399 1.00 83.81 C
+ATOM 1371 OG1 THR H 91 -28.746 2.552 -74.165 1.00 96.77 O
+ATOM 1372 CG2 THR H 91 -27.582 0.588 -73.407 1.00 83.93 C
+ATOM 1373 H THR H 91 -29.947 1.806 -76.462 1.00 0.00 H
+ATOM 1374 HA THR H 91 -27.164 1.451 -75.972 1.00 0.00 H
+ATOM 1375 HB THR H 91 -29.547 0.655 -74.254 1.00 0.00 H
+ATOM 1376 HG1 THR H 91 -28.516 3.037 -74.961 1.00 0.00 H
+ATOM 1377 1HG2 THR H 91 -27.939 0.760 -72.392 1.00 0.00 H
+ATOM 1378 2HG2 THR H 91 -27.464 -0.482 -73.574 1.00 0.00 H
+ATOM 1379 3HG2 THR H 91 -26.622 1.084 -73.542 1.00 0.00 H
+ATOM 1380 N ALA H 92 -26.692 -0.939 -76.552 1.00 67.97 N
+ATOM 1381 CA ALA H 92 -26.443 -2.319 -76.964 1.00 66.67 C
+ATOM 1382 C ALA H 92 -24.949 -2.509 -77.202 1.00 60.84 C
+ATOM 1383 O ALA H 92 -24.146 -1.585 -77.031 1.00 67.78 O
+ATOM 1384 CB ALA H 92 -27.243 -2.676 -78.219 1.00 79.58 C
+ATOM 1385 H ALA H 92 -25.946 -0.262 -76.623 1.00 0.00 H
+ATOM 1386 HA ALA H 92 -26.759 -2.977 -76.154 1.00 0.00 H
+ATOM 1387 1HB ALA H 92 -27.037 -3.709 -78.501 1.00 0.00 H
+ATOM 1388 2HB ALA H 92 -28.308 -2.561 -78.017 1.00 0.00 H
+ATOM 1389 3HB ALA H 92 -26.955 -2.014 -79.034 1.00 0.00 H
+ATOM 1390 N VAL H 93 -24.585 -3.727 -77.602 1.00 56.44 N
+ATOM 1391 CA VAL H 93 -23.221 -4.074 -77.989 1.00 69.73 C
+ATOM 1392 C VAL H 93 -23.166 -4.182 -79.507 1.00 76.05 C
+ATOM 1393 O VAL H 93 -23.966 -4.904 -80.117 1.00 66.28 O
+ATOM 1394 CB VAL H 93 -22.768 -5.388 -77.331 1.00 67.35 C
+ATOM 1395 CG1 VAL H 93 -21.409 -5.812 -77.872 1.00 65.85 C
+ATOM 1396 CG2 VAL H 93 -22.724 -5.240 -75.823 1.00 73.97 C
+ATOM 1397 H VAL H 93 -25.302 -4.438 -77.634 1.00 0.00 H
+ATOM 1398 HA VAL H 93 -22.554 -3.278 -77.656 1.00 0.00 H
+ATOM 1399 HB VAL H 93 -23.473 -6.177 -77.593 1.00 0.00 H
+ATOM 1400 1HG1 VAL H 93 -21.103 -6.744 -77.396 1.00 0.00 H
+ATOM 1401 2HG1 VAL H 93 -21.477 -5.960 -78.950 1.00 0.00 H
+ATOM 1402 3HG1 VAL H 93 -20.674 -5.037 -77.657 1.00 0.00 H
+ATOM 1403 1HG2 VAL H 93 -22.402 -6.179 -75.375 1.00 0.00 H
+ATOM 1404 2HG2 VAL H 93 -22.022 -4.450 -75.555 1.00 0.00 H
+ATOM 1405 3HG2 VAL H 93 -23.717 -4.983 -75.453 1.00 0.00 H
+ATOM 1406 N TYR H 94 -22.217 -3.480 -80.117 1.00 76.46 N
+ATOM 1407 CA TYR H 94 -22.092 -3.409 -81.565 1.00 67.73 C
+ATOM 1408 C TYR H 94 -20.888 -4.224 -82.014 1.00 73.25 C
+ATOM 1409 O TYR H 94 -19.779 -4.046 -81.496 1.00 82.04 O
+ATOM 1410 CB TYR H 94 -21.982 -1.953 -82.024 1.00 64.14 C
+ATOM 1411 CG TYR H 94 -23.234 -1.158 -81.719 1.00 69.70 C
+ATOM 1412 CD1 TYR H 94 -23.503 -0.710 -80.431 1.00 77.78 C
+ATOM 1413 CD2 TYR H 94 -24.155 -0.872 -82.714 1.00 60.98 C
+ATOM 1414 CE1 TYR H 94 -24.651 0.004 -80.147 1.00 80.92 C
+ATOM 1415 CE2 TYR H 94 -25.304 -0.155 -82.440 1.00 70.18 C
+ATOM 1416 CZ TYR H 94 -25.546 0.280 -81.155 1.00 78.00 C
+ATOM 1417 OH TYR H 94 -26.688 0.994 -80.874 1.00 93.32 O
+ATOM 1418 H TYR H 94 -21.558 -2.977 -79.541 1.00 0.00 H
+ATOM 1419 HA TYR H 94 -22.985 -3.848 -82.011 1.00 0.00 H
+ATOM 1420 1HB TYR H 94 -21.132 -1.479 -81.531 1.00 0.00 H
+ATOM 1421 2HB TYR H 94 -21.796 -1.923 -83.097 1.00 0.00 H
+ATOM 1422 HD1 TYR H 94 -22.802 -0.921 -79.623 1.00 0.00 H
+ATOM 1423 HD2 TYR H 94 -23.980 -1.215 -83.734 1.00 0.00 H
+ATOM 1424 HE1 TYR H 94 -24.842 0.346 -79.130 1.00 0.00 H
+ATOM 1425 HE2 TYR H 94 -26.014 0.063 -83.238 1.00 0.00 H
+ATOM 1426 HH TYR H 94 -27.203 1.101 -81.677 1.00 0.00 H
+ATOM 1427 N TYR H 95 -21.124 -5.125 -82.966 1.00 73.23 N
+ATOM 1428 CA TYR H 95 -20.127 -6.050 -83.485 1.00 69.06 C
+ATOM 1429 C TYR H 95 -19.825 -5.728 -84.943 1.00 74.38 C
+ATOM 1430 O TYR H 95 -20.723 -5.367 -85.714 1.00 69.81 O
+ATOM 1431 CB TYR H 95 -20.605 -7.505 -83.387 1.00 69.86 C
+ATOM 1432 CG TYR H 95 -20.721 -8.073 -81.988 1.00 70.33 C
+ATOM 1433 CD1 TYR H 95 -19.592 -8.413 -81.255 1.00 62.43 C
+ATOM 1434 CD2 TYR H 95 -21.967 -8.311 -81.418 1.00 74.79 C
+ATOM 1435 CE1 TYR H 95 -19.700 -8.945 -79.981 1.00 71.42 C
+ATOM 1436 CE2 TYR H 95 -22.084 -8.844 -80.148 1.00 72.49 C
+ATOM 1437 CZ TYR H 95 -20.949 -9.159 -79.435 1.00 75.99 C
+ATOM 1438 OH TYR H 95 -21.069 -9.689 -78.171 1.00 80.50 O
+ATOM 1439 H TYR H 95 -22.062 -5.152 -83.339 1.00 0.00 H
+ATOM 1440 HA TYR H 95 -19.219 -5.950 -82.890 1.00 0.00 H
+ATOM 1441 1HB TYR H 95 -21.588 -7.598 -83.851 1.00 0.00 H
+ATOM 1442 2HB TYR H 95 -19.921 -8.150 -83.937 1.00 0.00 H
+ATOM 1443 HD1 TYR H 95 -18.600 -8.262 -81.681 1.00 0.00 H
+ATOM 1444 HD2 TYR H 95 -22.875 -8.078 -81.975 1.00 0.00 H
+ATOM 1445 HE1 TYR H 95 -18.802 -9.206 -79.421 1.00 0.00 H
+ATOM 1446 HE2 TYR H 95 -23.071 -9.013 -79.717 1.00 0.00 H
+ATOM 1447 HH TYR H 95 -21.999 -9.771 -77.947 1.00 0.00 H
+ATOM 1448 N CYS H 96 -18.557 -5.893 -85.312 1.00 81.48 N
+ATOM 1449 CA CYS H 96 -18.067 -5.684 -86.668 1.00 79.66 C
+ATOM 1450 C CYS H 96 -17.551 -7.014 -87.202 1.00 77.74 C
+ATOM 1451 O CYS H 96 -16.590 -7.570 -86.660 1.00 81.55 O
+ATOM 1452 CB CYS H 96 -16.971 -4.619 -86.673 1.00 93.89 C
+ATOM 1453 SG CYS H 96 -15.785 -4.688 -88.026 1.00118.30 S
+ATOM 1454 H CYS H 96 -17.908 -6.181 -84.593 1.00 0.00 H
+ATOM 1455 HA CYS H 96 -18.896 -5.338 -87.286 1.00 0.00 H
+ATOM 1456 1HB CYS H 96 -17.426 -3.629 -86.706 1.00 0.00 H
+ATOM 1457 2HB CYS H 96 -16.396 -4.684 -85.750 1.00 0.00 H
+ATOM 1458 N ALA H 97 -18.192 -7.526 -88.250 1.00 77.41 N
+ATOM 1459 CA ALA H 97 -17.848 -8.823 -88.815 1.00 68.82 C
+ATOM 1460 C ALA H 97 -17.437 -8.681 -90.273 1.00 68.47 C
+ATOM 1461 O ALA H 97 -17.774 -7.703 -90.944 1.00 79.47 O
+ATOM 1462 CB ALA H 97 -19.019 -9.805 -88.705 1.00 67.82 C
+ATOM 1463 H ALA H 97 -18.943 -6.992 -88.664 1.00 0.00 H
+ATOM 1464 HA ALA H 97 -17.006 -9.225 -88.252 1.00 0.00 H
+ATOM 1465 1HB ALA H 97 -18.731 -10.764 -89.135 1.00 0.00 H
+ATOM 1466 2HB ALA H 97 -19.282 -9.942 -87.656 1.00 0.00 H
+ATOM 1467 3HB ALA H 97 -19.878 -9.409 -89.245 1.00 0.00 H
+ATOM 1468 N ARG H 98 -16.698 -9.675 -90.760 1.00 66.37 N
+ATOM 1469 CA ARG H 98 -16.283 -9.734 -92.154 1.00 75.20 C
+ATOM 1470 C ARG H 98 -16.939 -10.921 -92.846 1.00 75.78 C
+ATOM 1471 O ARG H 98 -17.304 -11.912 -92.209 1.00 80.58 O
+ATOM 1472 CB ARG H 98 -14.762 -9.855 -92.289 1.00 68.73 C
+ATOM 1473 CG ARG H 98 -14.257 -11.282 -92.170 1.00 66.93 C
+ATOM 1474 CD ARG H 98 -12.940 -11.487 -92.891 1.00 74.15 C
+ATOM 1475 NE ARG H 98 -12.596 -12.904 -92.977 1.00 72.77 N
+ATOM 1476 CZ ARG H 98 -11.451 -13.367 -93.465 1.00 80.69 C
+ATOM 1477 NH1 ARG H 98 -10.535 -12.523 -93.919 1.00 91.48 N
+ATOM 1478 NH2 ARG H 98 -11.223 -14.673 -93.505 1.00 78.91 N
+ATOM 1479 H ARG H 98 -16.418 -10.414 -90.132 1.00 0.00 H
+ATOM 1480 HA ARG H 98 -16.593 -8.812 -92.647 1.00 0.00 H
+ATOM 1481 1HB ARG H 98 -14.450 -9.460 -93.255 1.00 0.00 H
+ATOM 1482 2HB ARG H 98 -14.279 -9.254 -91.518 1.00 0.00 H
+ATOM 1483 1HG ARG H 98 -14.108 -11.529 -91.119 1.00 0.00 H
+ATOM 1484 2HG ARG H 98 -14.989 -11.965 -92.603 1.00 0.00 H
+ATOM 1485 1HD ARG H 98 -13.013 -11.087 -93.902 1.00 0.00 H
+ATOM 1486 2HD ARG H 98 -12.146 -10.970 -92.352 1.00 0.00 H
+ATOM 1487 HE ARG H 98 -13.276 -13.574 -92.642 1.00 0.00 H
+ATOM 1488 1HH1 ARG H 98 -10.708 -11.528 -93.894 1.00 0.00 H
+ATOM 1489 2HH1 ARG H 98 -9.664 -12.875 -94.290 1.00 0.00 H
+ATOM 1490 1HH2 ARG H 98 -11.922 -15.319 -93.163 1.00 0.00 H
+ATOM 1491 2HH2 ARG H 98 -10.352 -15.022 -93.876 1.00 0.00 H
+ATOM 1492 N ASP H 99 -17.085 -10.811 -94.163 1.00 74.11 N
+ATOM 1493 CA ASP H 99 -17.606 -11.907 -94.964 1.00 84.55 C
+ATOM 1494 C ASP H 99 -16.897 -11.924 -96.307 1.00 87.63 C
+ATOM 1495 O ASP H 99 -16.401 -10.902 -96.786 1.00 87.69 O
+ATOM 1496 CB ASP H 99 -19.127 -11.803 -95.166 1.00112.35 C
+ATOM 1497 CG ASP H 99 -19.538 -10.562 -95.947 1.00125.91 C
+ATOM 1498 OD1 ASP H 99 -18.737 -9.611 -96.047 1.00127.92 O
+ATOM 1499 OD2 ASP H 99 -20.676 -10.538 -96.461 1.00129.67 O
+ATOM 1500 H ASP H 99 -16.829 -9.947 -94.619 1.00 0.00 H
+ATOM 1501 HA ASP H 99 -17.401 -12.843 -94.444 1.00 0.00 H
+ATOM 1502 1HB ASP H 99 -19.484 -12.684 -95.699 1.00 0.00 H
+ATOM 1503 2HB ASP H 99 -19.623 -11.784 -94.195 1.00 0.00 H
+ATOM 1504 N LEU H 100 -16.850 -13.106 -96.914 1.00 84.45 N
+ATOM 1505 CA LEU H 100 -16.254 -13.229 -98.236 1.00 80.44 C
+ATOM 1506 C LEU H 100 -17.168 -12.561 -99.256 1.00 90.01 C
+ATOM 1507 O LEU H 100 -18.024 -13.219 -99.855 1.00 91.49 O
+ATOM 1508 CB LEU H 100 -16.013 -14.699 -98.587 1.00 85.04 C
+ATOM 1509 CG LEU H 100 -15.169 -14.973 -99.833 1.00 75.56 C
+ATOM 1510 CD1 LEU H 100 -14.028 -13.970 -99.909 1.00 84.72 C
+ATOM 1511 CD2 LEU H 100 -14.620 -16.385 -99.812 1.00 76.52 C
+ATOM 1512 H LEU H 100 -17.226 -13.929 -96.465 1.00 0.00 H
+ATOM 1513 HA LEU H 100 -15.295 -12.712 -98.232 1.00 0.00 H
+ATOM 1514 1HB LEU H 100 -15.515 -15.180 -97.747 1.00 0.00 H
+ATOM 1515 2HB LEU H 100 -16.978 -15.183 -98.736 1.00 0.00 H
+ATOM 1516 HG LEU H 100 -15.785 -14.849-100.724 1.00 0.00 H
+ATOM 1517 1HD1 LEU H 100 -13.428 -14.167-100.798 1.00 0.00 H
+ATOM 1518 2HD1 LEU H 100 -14.434 -12.960 -99.964 1.00 0.00 H
+ATOM 1519 3HD1 LEU H 100 -13.403 -14.063 -99.022 1.00 0.00 H
+ATOM 1520 1HD2 LEU H 100 -14.024 -16.557-100.709 1.00 0.00 H
+ATOM 1521 2HD2 LEU H 100 -13.995 -16.519 -98.929 1.00 0.00 H
+ATOM 1522 3HD2 LEU H 100 -15.446 -17.096 -99.783 1.00 0.00 H
+ATOM 1523 N ARG H 101 -17.001 -11.249 -99.439 1.00 97.69 N
+ATOM 1524 CA ARG H 101 -17.809 -10.446-100.355 1.00101.87 C
+ATOM 1525 C ARG H 101 -19.304 -10.654-100.148 1.00107.56 C
+ATOM 1526 O ARG H 101 -19.832 -10.364 -99.070 1.00136.29 O
+ATOM 1527 CB ARG H 101 -17.427 -10.743-101.804 1.00119.68 C
+ATOM 1528 CG ARG H 101 -15.999 -10.353-102.133 1.00134.67 C
+ATOM 1529 CD ARG H 101 -15.753 -8.860-101.904 1.00129.94 C
+ATOM 1530 NE ARG H 101 -16.510 -8.017-102.828 1.00124.21 N
+ATOM 1531 CZ ARG H 101 -16.146 -7.771-104.085 1.00120.00 C
+ATOM 1532 NH1 ARG H 101 -16.895 -6.992-104.853 1.00129.67 N
+ATOM 1533 NH2 ARG H 101 -15.035 -8.306-104.576 1.00103.15 N
+ATOM 1534 H ARG H 101 -16.270 -10.801 -98.906 1.00 0.00 H
+ATOM 1535 HA ARG H 101 -17.617 -9.392-100.153 1.00 0.00 H
+ATOM 1536 1HB ARG H 101 -17.551 -11.807-102.002 1.00 0.00 H
+ATOM 1537 2HB ARG H 101 -18.097 -10.205-102.475 1.00 0.00 H
+ATOM 1538 1HG ARG H 101 -15.313 -10.915-101.499 1.00 0.00 H
+ATOM 1539 2HG ARG H 101 -15.792 -10.578-103.180 1.00 0.00 H
+ATOM 1540 1HD ARG H 101 -16.049 -8.594-100.890 1.00 0.00 H
+ATOM 1541 2HD ARG H 101 -14.695 -8.640-102.042 1.00 0.00 H
+ATOM 1542 HE ARG H 101 -17.364 -7.595-102.488 1.00 0.00 H
+ATOM 1543 1HH1 ARG H 101 -17.743 -6.584-104.485 1.00 0.00 H
+ATOM 1544 2HH1 ARG H 101 -16.618 -6.806-105.806 1.00 0.00 H
+ATOM 1545 1HH2 ARG H 101 -14.462 -8.903-103.995 1.00 0.00 H
+ATOM 1546 2HH2 ARG H 101 -14.763 -8.117-105.529 1.00 0.00 H
+ATOM 1547 N GLY H 102 -19.996 -11.152-101.165 1.00 74.67 N
+ATOM 1548 CA GLY H 102 -21.433 -11.297-101.087 1.00 84.09 C
+ATOM 1549 C GLY H 102 -21.943 -12.541-100.401 1.00 86.11 C
+ATOM 1550 O GLY H 102 -23.143 -12.817-100.464 1.00 97.07 O
+ATOM 1551 H GLY H 102 -19.518 -11.436-102.008 1.00 0.00 H
+ATOM 1552 1HA GLY H 102 -21.857 -10.444-100.557 1.00 0.00 H
+ATOM 1553 2HA GLY H 102 -21.854 -11.292-102.092 1.00 0.00 H
+ATOM 1554 N THR H 103 -21.074 -13.305 -99.736 1.00 71.06 N
+ATOM 1555 CA THR H 103 -21.513 -14.558 -99.130 1.00 74.41 C
+ATOM 1556 C THR H 103 -22.339 -14.329 -97.870 1.00 70.77 C
+ATOM 1557 O THR H 103 -23.263 -15.102 -97.596 1.00 67.84 O
+ATOM 1558 CB THR H 103 -20.311 -15.445 -98.803 1.00 80.72 C
+ATOM 1559 OG1 THR H 103 -19.340 -14.690 -98.064 1.00 86.91 O
+ATOM 1560 CG2 THR H 103 -19.677 -15.980-100.082 1.00 79.86 C
+ATOM 1561 H THR H 103 -20.107 -13.027 -99.645 1.00 0.00 H
+ATOM 1562 HA THR H 103 -22.149 -15.083 -99.843 1.00 0.00 H
+ATOM 1563 HB THR H 103 -20.635 -16.283 -98.187 1.00 0.00 H
+ATOM 1564 HG1 THR H 103 -19.661 -13.794 -97.938 1.00 0.00 H
+ATOM 1565 1HG2 THR H 103 -18.824 -16.609 -99.829 1.00 0.00 H
+ATOM 1566 2HG2 THR H 103 -20.411 -16.567-100.634 1.00 0.00 H
+ATOM 1567 3HG2 THR H 103 -19.343 -15.146-100.698 1.00 0.00 H
+ATOM 1568 N ASN H 104 -22.023 -13.285 -97.100 1.00 66.94 N
+ATOM 1569 CA ASN H 104 -22.668 -13.016 -95.813 1.00 78.62 C
+ATOM 1570 C ASN H 104 -22.422 -14.149 -94.819 1.00 86.72 C
+ATOM 1571 O ASN H 104 -23.233 -14.400 -93.924 1.00 93.47 O
+ATOM 1572 CB ASN H 104 -24.170 -12.754 -95.978 1.00 89.50 C
+ATOM 1573 CG ASN H 104 -24.461 -11.608 -96.932 1.00 98.73 C
+ATOM 1574 OD1 ASN H 104 -23.656 -10.689 -97.084 1.00107.89 O
+ATOM 1575 ND2 ASN H 104 -25.615 -11.661 -97.582 1.00 97.68 N
+ATOM 1576 H ASN H 104 -21.304 -12.658 -97.431 1.00 0.00 H
+ATOM 1577 HA ASN H 104 -22.214 -12.124 -95.378 1.00 0.00 H
+ATOM 1578 1HB ASN H 104 -24.658 -13.655 -96.351 1.00 0.00 H
+ATOM 1579 2HB ASN H 104 -24.608 -12.523 -95.007 1.00 0.00 H
+ATOM 1580 1HD2 ASN H 104 -25.861 -10.934 -98.224 1.00 0.00 H
+ATOM 1581 2HD2 ASN H 104 -26.239 -12.427 -97.431 1.00 0.00 H
+ATOM 1582 N TYR H 105 -21.300 -14.847 -94.979 1.00 86.92 N
+ATOM 1583 CA TYR H 105 -20.856 -15.866 -94.034 1.00 80.56 C
+ATOM 1584 C TYR H 105 -19.746 -15.257 -93.184 1.00 79.53 C
+ATOM 1585 O TYR H 105 -18.618 -15.080 -93.657 1.00 89.90 O
+ATOM 1586 CB TYR H 105 -20.387 -17.120 -94.766 1.00 65.16 C
+ATOM 1587 CG TYR H 105 -21.520 -17.928 -95.364 1.00 67.35 C
+ATOM 1588 CD1 TYR H 105 -22.660 -18.214 -94.624 1.00 68.43 C
+ATOM 1589 CD2 TYR H 105 -21.459 -18.388 -96.673 1.00 76.01 C
+ATOM 1590 CE1 TYR H 105 -23.700 -18.950 -95.166 1.00 69.94 C
+ATOM 1591 CE2 TYR H 105 -22.494 -19.122 -97.223 1.00 78.61 C
+ATOM 1592 CZ TYR H 105 -23.611 -19.400 -96.464 1.00 76.81 C
+ATOM 1593 OH TYR H 105 -24.646 -20.129 -97.006 1.00 86.00 O
+ATOM 1594 H TYR H 105 -20.737 -14.655 -95.795 1.00 0.00 H
+ATOM 1595 HA TYR H 105 -21.697 -16.134 -93.394 1.00 0.00 H
+ATOM 1596 1HB TYR H 105 -19.704 -16.839 -95.569 1.00 0.00 H
+ATOM 1597 2HB TYR H 105 -19.836 -17.759 -94.077 1.00 0.00 H
+ATOM 1598 HD1 TYR H 105 -22.747 -17.857 -93.597 1.00 0.00 H
+ATOM 1599 HD2 TYR H 105 -20.584 -18.173 -97.286 1.00 0.00 H
+ATOM 1600 HE1 TYR H 105 -24.586 -19.163 -94.568 1.00 0.00 H
+ATOM 1601 HE2 TYR H 105 -22.424 -19.478 -98.251 1.00 0.00 H
+ATOM 1602 HH TYR H 105 -24.431 -20.363 -97.912 1.00 0.00 H
+ATOM 1603 N PHE H 106 -20.074 -14.935 -91.934 1.00 76.07 N
+ATOM 1604 CA PHE H 106 -19.204 -14.156 -91.052 1.00 76.65 C
+ATOM 1605 C PHE H 106 -18.265 -15.094 -90.306 1.00 79.16 C
+ATOM 1606 O PHE H 106 -18.622 -15.652 -89.265 1.00 78.91 O
+ATOM 1607 CB PHE H 106 -20.041 -13.333 -90.082 1.00 71.16 C
+ATOM 1608 CG PHE H 106 -21.101 -12.513 -90.751 1.00 76.01 C
+ATOM 1609 CD1 PHE H 106 -20.781 -11.679 -91.808 1.00 75.97 C
+ATOM 1610 CD2 PHE H 106 -22.421 -12.592 -90.339 1.00 74.84 C
+ATOM 1611 CE1 PHE H 106 -21.750 -10.925 -92.428 1.00 61.34 C
+ATOM 1612 CE2 PHE H 106 -23.399 -11.838 -90.961 1.00 73.81 C
+ATOM 1613 CZ PHE H 106 -23.062 -11.002 -92.005 1.00 61.10 C
+ATOM 1614 H PHE H 106 -20.970 -15.249 -91.589 1.00 0.00 H
+ATOM 1615 HA PHE H 106 -18.608 -13.478 -91.664 1.00 0.00 H
+ATOM 1616 1HB PHE H 106 -20.523 -13.996 -89.365 1.00 0.00 H
+ATOM 1617 2HB PHE H 106 -19.392 -12.661 -89.521 1.00 0.00 H
+ATOM 1618 HD1 PHE H 106 -19.747 -11.624 -92.149 1.00 0.00 H
+ATOM 1619 HD2 PHE H 106 -22.686 -13.253 -89.513 1.00 0.00 H
+ATOM 1620 HE1 PHE H 106 -21.482 -10.267 -93.254 1.00 0.00 H
+ATOM 1621 HE2 PHE H 106 -24.435 -11.902 -90.628 1.00 0.00 H
+ATOM 1622 HZ PHE H 106 -23.829 -10.403 -92.494 1.00 0.00 H
+ATOM 1623 N ASP H 107 -17.046 -15.249 -90.825 1.00 76.67 N
+ATOM 1624 CA ASP H 107 -16.098 -16.169 -90.209 1.00 77.59 C
+ATOM 1625 C ASP H 107 -15.407 -15.541 -88.998 1.00 71.29 C
+ATOM 1626 O ASP H 107 -15.392 -16.133 -87.913 1.00 74.68 O
+ATOM 1627 CB ASP H 107 -15.077 -16.643 -91.248 1.00 70.83 C
+ATOM 1628 CG ASP H 107 -14.489 -15.503 -92.056 1.00 84.78 C
+ATOM 1629 OD1 ASP H 107 -15.043 -14.386 -92.003 1.00 86.12 O
+ATOM 1630 OD2 ASP H 107 -13.476 -15.727 -92.750 1.00 89.68 O
+ATOM 1631 H ASP H 107 -16.767 -14.733 -91.647 1.00 0.00 H
+ATOM 1632 HA ASP H 107 -16.648 -17.033 -89.835 1.00 0.00 H
+ATOM 1633 1HB ASP H 107 -14.266 -17.171 -90.746 1.00 0.00 H
+ATOM 1634 2HB ASP H 107 -15.553 -17.347 -91.931 1.00 0.00 H
+ATOM 1635 N TYR H 108 -14.837 -14.347 -89.154 1.00 63.13 N
+ATOM 1636 CA TYR H 108 -14.097 -13.690 -88.083 1.00 65.86 C
+ATOM 1637 C TYR H 108 -14.791 -12.398 -87.668 1.00 69.90 C
+ATOM 1638 O TYR H 108 -15.246 -11.624 -88.516 1.00 68.19 O
+ATOM 1639 CB TYR H 108 -12.651 -13.388 -88.500 1.00 73.29 C
+ATOM 1640 CG TYR H 108 -11.776 -14.612 -88.678 1.00 89.71 C
+ATOM 1641 CD1 TYR H 108 -12.214 -15.876 -88.302 1.00 92.66 C
+ATOM 1642 CD2 TYR H 108 -10.501 -14.499 -89.211 1.00 99.87 C
+ATOM 1643 CE1 TYR H 108 -11.410 -16.991 -88.468 1.00 97.50 C
+ATOM 1644 CE2 TYR H 108 -9.690 -15.606 -89.378 1.00 99.88 C
+ATOM 1645 CZ TYR H 108 -10.147 -16.848 -89.006 1.00 96.61 C
+ATOM 1646 OH TYR H 108 -9.336 -17.947 -89.175 1.00 97.96 O
+ATOM 1647 H TYR H 108 -14.923 -13.885 -90.048 1.00 0.00 H
+ATOM 1648 HA TYR H 108 -14.069 -14.358 -87.222 1.00 0.00 H
+ATOM 1649 1HB TYR H 108 -12.651 -12.839 -89.443 1.00 0.00 H
+ATOM 1650 2HB TYR H 108 -12.182 -12.751 -87.751 1.00 0.00 H
+ATOM 1651 HD1 TYR H 108 -13.206 -16.002 -87.868 1.00 0.00 H
+ATOM 1652 HD2 TYR H 108 -10.119 -13.522 -89.507 1.00 0.00 H
+ATOM 1653 HE1 TYR H 108 -11.772 -17.974 -88.167 1.00 0.00 H
+ATOM 1654 HE2 TYR H 108 -8.692 -15.492 -89.802 1.00 0.00 H
+ATOM 1655 HH TYR H 108 -8.500 -17.671 -89.559 1.00 0.00 H
+ATOM 1656 N TRP H 109 -14.844 -12.160 -86.360 1.00 70.84 N
+ATOM 1657 CA TRP H 109 -15.549 -11.027 -85.778 1.00 67.58 C
+ATOM 1658 C TRP H 109 -14.593 -10.135 -84.995 1.00 72.02 C
+ATOM 1659 O TRP H 109 -13.423 -10.463 -84.777 1.00 67.12 O
+ATOM 1660 CB TRP H 109 -16.670 -11.497 -84.843 1.00 59.48 C
+ATOM 1661 CG TRP H 109 -17.773 -12.249 -85.505 1.00 64.73 C
+ATOM 1662 CD1 TRP H 109 -17.660 -13.382 -86.252 1.00 73.07 C
+ATOM 1663 CD2 TRP H 109 -19.171 -11.947 -85.440 1.00 62.75 C
+ATOM 1664 NE1 TRP H 109 -18.899 -13.794 -86.676 1.00 76.93 N
+ATOM 1665 CE2 TRP H 109 -19.845 -12.931 -86.188 1.00 65.19 C
+ATOM 1666 CE3 TRP H 109 -19.918 -10.935 -84.830 1.00 60.64 C
+ATOM 1667 CZ2 TRP H 109 -21.227 -12.932 -86.343 1.00 59.20 C
+ATOM 1668 CZ3 TRP H 109 -21.289 -10.939 -84.983 1.00 55.06 C
+ATOM 1669 CH2 TRP H 109 -21.930 -11.930 -85.734 1.00 64.94 C
+ATOM 1670 H TRP H 109 -14.365 -12.808 -85.750 1.00 0.00 H
+ATOM 1671 HA TRP H 109 -15.996 -10.446 -86.585 1.00 0.00 H
+ATOM 1672 1HB TRP H 109 -16.252 -12.142 -84.070 1.00 0.00 H
+ATOM 1673 2HB TRP H 109 -17.114 -10.635 -84.346 1.00 0.00 H
+ATOM 1674 HD1 TRP H 109 -16.723 -13.887 -86.480 1.00 0.00 H
+ATOM 1675 HE1 TRP H 109 -19.085 -14.601 -87.254 1.00 0.00 H
+ATOM 1676 HE3 TRP H 109 -19.426 -10.160 -84.243 1.00 0.00 H
+ATOM 1677 HZ2 TRP H 109 -21.744 -13.696 -86.923 1.00 0.00 H
+ATOM 1678 HZ3 TRP H 109 -21.862 -10.146 -84.502 1.00 0.00 H
+ATOM 1679 HH2 TRP H 109 -23.015 -11.900 -85.835 1.00 0.00 H
+ATOM 1680 N GLY H 110 -15.122 -8.981 -84.568 1.00 70.32 N
+ATOM 1681 CA GLY H 110 -14.470 -8.173 -83.561 1.00 72.39 C
+ATOM 1682 C GLY H 110 -14.972 -8.521 -82.168 1.00 83.67 C
+ATOM 1683 O GLY H 110 -15.913 -9.293 -81.997 1.00 90.27 O
+ATOM 1684 H GLY H 110 -15.999 -8.667 -84.959 1.00 0.00 H
+ATOM 1685 1HA GLY H 110 -13.392 -8.327 -83.613 1.00 0.00 H
+ATOM 1686 2HA GLY H 110 -14.654 -7.119 -83.765 1.00 0.00 H
+ATOM 1687 N GLN H 111 -14.321 -7.939 -81.160 1.00 83.53 N
+ATOM 1688 CA GLN H 111 -14.697 -8.234 -79.783 1.00 68.17 C
+ATOM 1689 C GLN H 111 -15.995 -7.551 -79.370 1.00 79.10 C
+ATOM 1690 O GLN H 111 -16.585 -7.936 -78.354 1.00 84.21 O
+ATOM 1691 CB GLN H 111 -13.570 -7.832 -78.828 1.00 56.03 C
+ATOM 1692 CG GLN H 111 -13.460 -6.339 -78.565 1.00 74.49 C
+ATOM 1693 CD GLN H 111 -12.703 -5.599 -79.648 1.00 84.57 C
+ATOM 1694 OE1 GLN H 111 -12.381 -6.161 -80.694 1.00 94.01 O
+ATOM 1695 NE2 GLN H 111 -12.408 -4.330 -79.398 1.00 82.17 N
+ATOM 1696 H GLN H 111 -13.566 -7.292 -81.336 1.00 0.00 H
+ATOM 1697 HA GLN H 111 -14.866 -9.307 -79.693 1.00 0.00 H
+ATOM 1698 1HB GLN H 111 -13.713 -8.327 -77.868 1.00 0.00 H
+ATOM 1699 2HB GLN H 111 -12.615 -8.168 -79.231 1.00 0.00 H
+ATOM 1700 1HG GLN H 111 -14.463 -5.916 -78.507 1.00 0.00 H
+ATOM 1701 2HG GLN H 111 -12.935 -6.184 -77.623 1.00 0.00 H
+ATOM 1702 1HE2 GLN H 111 -11.909 -3.789 -80.076 1.00 0.00 H
+ATOM 1703 2HE2 GLN H 111 -12.684 -3.913 -78.532 1.00 0.00 H
+ATOM 1704 N GLY H 112 -16.454 -6.561 -80.134 1.00 86.63 N
+ATOM 1705 CA GLY H 112 -17.685 -5.856 -79.832 1.00 77.01 C
+ATOM 1706 C GLY H 112 -17.494 -4.724 -78.848 1.00 73.26 C
+ATOM 1707 O GLY H 112 -16.785 -4.888 -77.851 1.00 92.90 O
+ATOM 1708 H GLY H 112 -15.923 -6.296 -80.951 1.00 0.00 H
+ATOM 1709 1HA GLY H 112 -18.108 -5.452 -80.752 1.00 0.00 H
+ATOM 1710 2HA GLY H 112 -18.414 -6.555 -79.423 1.00 0.00 H
+ATOM 1711 N THR H 113 -18.106 -3.571 -79.107 1.00 73.30 N
+ATOM 1712 CA THR H 113 -18.037 -2.449 -78.180 1.00 86.52 C
+ATOM 1713 C THR H 113 -19.387 -2.248 -77.507 1.00 89.42 C
+ATOM 1714 O THR H 113 -20.438 -2.520 -78.092 1.00 79.90 O
+ATOM 1715 CB THR H 113 -17.629 -1.142 -78.874 1.00 78.08 C
+ATOM 1716 OG1 THR H 113 -18.702 -0.681 -79.701 1.00 75.83 O
+ATOM 1717 CG2 THR H 113 -16.396 -1.347 -79.731 1.00 69.26 C
+ATOM 1718 H THR H 113 -18.630 -3.469 -79.964 1.00 0.00 H
+ATOM 1719 HA THR H 113 -17.285 -2.672 -77.423 1.00 0.00 H
+ATOM 1720 HB THR H 113 -17.416 -0.382 -78.122 1.00 0.00 H
+ATOM 1721 HG1 THR H 113 -19.440 -1.293 -79.638 1.00 0.00 H
+ATOM 1722 1HG2 THR H 113 -16.127 -0.407 -80.212 1.00 0.00 H
+ATOM 1723 2HG2 THR H 113 -15.570 -1.685 -79.105 1.00 0.00 H
+ATOM 1724 3HG2 THR H 113 -16.603 -2.097 -80.493 1.00 0.00 H
+ATOM 1725 N LEU H 114 -19.349 -1.769 -76.267 1.00 85.27 N
+ATOM 1726 CA LEU H 114 -20.563 -1.433 -75.535 1.00 80.79 C
+ATOM 1727 C LEU H 114 -20.886 0.038 -75.761 1.00 77.93 C
+ATOM 1728 O LEU H 114 -20.050 0.908 -75.498 1.00 83.79 O
+ATOM 1729 CB LEU H 114 -20.397 -1.723 -74.044 1.00 77.88 C
+ATOM 1730 CG LEU H 114 -21.489 -1.177 -73.117 1.00 78.99 C
+ATOM 1731 CD1 LEU H 114 -22.854 -1.758 -73.469 1.00 67.86 C
+ATOM 1732 CD2 LEU H 114 -21.143 -1.433 -71.651 1.00 81.86 C
+ATOM 1733 H LEU H 114 -18.453 -1.635 -75.821 1.00 0.00 H
+ATOM 1734 HA LEU H 114 -21.378 -2.047 -75.917 1.00 0.00 H
+ATOM 1735 1HB LEU H 114 -20.361 -2.802 -73.902 1.00 0.00 H
+ATOM 1736 2HB LEU H 114 -19.448 -1.302 -73.711 1.00 0.00 H
+ATOM 1737 HG LEU H 114 -21.591 -0.102 -73.269 1.00 0.00 H
+ATOM 1738 1HD1 LEU H 114 -23.607 -1.352 -72.794 1.00 0.00 H
+ATOM 1739 2HD1 LEU H 114 -23.108 -1.494 -74.496 1.00 0.00 H
+ATOM 1740 3HD1 LEU H 114 -22.825 -2.842 -73.369 1.00 0.00 H
+ATOM 1741 1HD2 LEU H 114 -21.934 -1.035 -71.015 1.00 0.00 H
+ATOM 1742 2HD2 LEU H 114 -21.047 -2.506 -71.482 1.00 0.00 H
+ATOM 1743 3HD2 LEU H 114 -20.201 -0.942 -71.408 1.00 0.00 H
+ATOM 1744 N VAL H 115 -22.090 0.316 -76.253 1.00 72.91 N
+ATOM 1745 CA VAL H 115 -22.577 1.680 -76.420 1.00 75.99 C
+ATOM 1746 C VAL H 115 -23.784 1.861 -75.513 1.00 78.84 C
+ATOM 1747 O VAL H 115 -24.786 1.141 -75.646 1.00 70.89 O
+ATOM 1748 CB VAL H 115 -22.929 1.997 -77.880 1.00 77.32 C
+ATOM 1749 CG1 VAL H 115 -23.519 3.394 -77.985 1.00 81.67 C
+ATOM 1750 CG2 VAL H 115 -21.692 1.878 -78.751 1.00 78.24 C
+ATOM 1751 H VAL H 115 -22.685 -0.455 -76.520 1.00 0.00 H
+ATOM 1752 HA VAL H 115 -21.790 2.369 -76.110 1.00 0.00 H
+ATOM 1753 HB VAL H 115 -23.684 1.290 -78.224 1.00 0.00 H
+ATOM 1754 1HG1 VAL H 115 -23.765 3.608 -79.025 1.00 0.00 H
+ATOM 1755 2HG1 VAL H 115 -24.423 3.454 -77.379 1.00 0.00 H
+ATOM 1756 3HG1 VAL H 115 -22.793 4.124 -77.628 1.00 0.00 H
+ATOM 1757 1HG2 VAL H 115 -21.952 2.104 -79.785 1.00 0.00 H
+ATOM 1758 2HG2 VAL H 115 -20.934 2.581 -78.405 1.00 0.00 H
+ATOM 1759 3HG2 VAL H 115 -21.300 0.863 -78.689 1.00 0.00 H
+ATOM 1760 N THR H 116 -23.683 2.817 -74.591 1.00 85.13 N
+ATOM 1761 CA THR H 116 -24.703 3.069 -73.580 1.00 82.35 C
+ATOM 1762 C THR H 116 -25.355 4.413 -73.876 1.00 79.73 C
+ATOM 1763 O THR H 116 -24.662 5.430 -73.963 1.00 79.89 O
+ATOM 1764 CB THR H 116 -24.091 3.067 -72.175 1.00 80.11 C
+ATOM 1765 OG1 THR H 116 -23.229 1.931 -72.019 1.00 70.07 O
+ATOM 1766 CG2 THR H 116 -25.183 3.021 -71.109 1.00 72.44 C
+ATOM 1767 H THR H 116 -22.851 3.390 -74.604 1.00 0.00 H
+ATOM 1768 HA THR H 116 -25.447 2.274 -73.634 1.00 0.00 H
+ATOM 1769 HB THR H 116 -23.496 3.970 -72.036 1.00 0.00 H
+ATOM 1770 HG1 THR H 116 -23.225 1.419 -72.832 1.00 0.00 H
+ATOM 1771 1HG2 THR H 116 -24.726 3.021 -70.120 1.00 0.00 H
+ATOM 1772 2HG2 THR H 116 -25.828 3.894 -71.211 1.00 0.00 H
+ATOM 1773 3HG2 THR H 116 -25.776 2.116 -71.234 1.00 0.00 H
+ATOM 1774 N VAL H 117 -26.677 4.419 -74.032 1.00 78.30 N
+ATOM 1775 CA VAL H 117 -27.432 5.634 -74.329 1.00 71.20 C
+ATOM 1776 C VAL H 117 -28.462 5.833 -73.227 1.00 73.06 C
+ATOM 1777 O VAL H 117 -29.391 5.029 -73.080 1.00 73.26 O
+ATOM 1778 CB VAL H 117 -28.110 5.580 -75.704 1.00 72.49 C
+ATOM 1779 CG1 VAL H 117 -28.919 6.847 -75.934 1.00 76.49 C
+ATOM 1780 CG2 VAL H 117 -27.076 5.405 -76.796 1.00 80.66 C
+ATOM 1781 H VAL H 117 -27.171 3.543 -73.940 1.00 0.00 H
+ATOM 1782 HA VAL H 117 -26.742 6.478 -74.333 1.00 0.00 H
+ATOM 1783 HB VAL H 117 -28.801 4.738 -75.725 1.00 0.00 H
+ATOM 1784 1HG1 VAL H 117 -29.398 6.801 -76.913 1.00 0.00 H
+ATOM 1785 2HG1 VAL H 117 -29.682 6.937 -75.161 1.00 0.00 H
+ATOM 1786 3HG1 VAL H 117 -28.258 7.713 -75.895 1.00 0.00 H
+ATOM 1787 1HG2 VAL H 117 -27.573 5.368 -77.765 1.00 0.00 H
+ATOM 1788 2HG2 VAL H 117 -26.380 6.244 -76.776 1.00 0.00 H
+ATOM 1789 3HG2 VAL H 117 -26.529 4.476 -76.633 1.00 0.00 H
+ATOM 1790 N SER H 118 -28.311 6.915 -72.469 1.00 83.10 N
+ATOM 1791 CA SER H 118 -29.213 7.228 -71.372 1.00 96.09 C
+ATOM 1792 C SER H 118 -28.990 8.672 -70.959 1.00101.09 C
+ATOM 1793 O SER H 118 -27.875 9.191 -71.051 1.00100.09 O
+ATOM 1794 CB SER H 118 -28.994 6.301 -70.174 1.00100.61 C
+ATOM 1795 OG SER H 118 -29.740 6.746 -69.054 1.00105.34 O
+ATOM 1796 H SER H 118 -27.541 7.538 -72.666 1.00 0.00 H
+ATOM 1797 HA SER H 118 -30.239 7.095 -71.718 1.00 0.00 H
+ATOM 1798 1HB SER H 118 -29.294 5.287 -70.439 1.00 0.00 H
+ATOM 1799 2HB SER H 118 -27.934 6.274 -69.924 1.00 0.00 H
+ATOM 1800 HG SER H 118 -30.204 7.536 -69.342 1.00 0.00 H
+ATOM 1801 N SER H 119 -30.060 9.309 -70.489 1.00104.50 N
+ATOM 1802 CA SER H 119 -29.994 10.693 -70.039 1.00110.26 C
+ATOM 1803 C SER H 119 -29.332 10.844 -68.672 1.00108.01 C
+ATOM 1804 O SER H 119 -29.424 11.920 -68.071 1.00109.37 O
+ATOM 1805 CB SER H 119 -31.399 11.303 -70.011 1.00112.77 C
+ATOM 1806 OG SER H 119 -32.296 10.495 -69.270 1.00110.69 O
+ATOM 1807 H SER H 119 -30.942 8.818 -70.443 1.00 0.00 H
+ATOM 1808 HA SER H 119 -29.379 11.257 -70.742 1.00 0.00 H
+ATOM 1809 1HB SER H 119 -31.355 12.298 -69.568 1.00 0.00 H
+ATOM 1810 2HB SER H 119 -31.767 11.415 -71.030 1.00 0.00 H
+ATOM 1811 HG SER H 119 -31.783 9.744 -68.961 1.00 0.00 H
+ATOM 1812 N ALA H 120 -28.670 9.805 -68.176 1.00102.26 N
+ATOM 1813 CA ALA H 120 -27.992 9.854 -66.892 1.00 97.01 C
+ATOM 1814 C ALA H 120 -26.546 10.310 -67.066 1.00106.07 C
+ATOM 1815 O ALA H 120 -26.015 10.382 -68.176 1.00114.45 O
+ATOM 1816 CB ALA H 120 -28.045 8.487 -66.210 1.00 87.34 C
+ATOM 1817 H ALA H 120 -28.640 8.952 -68.716 1.00 0.00 H
+ATOM 1818 HA ALA H 120 -28.507 10.582 -66.265 1.00 0.00 H
+ATOM 1819 1HB ALA H 120 -27.533 8.540 -65.249 1.00 0.00 H
+ATOM 1820 2HB ALA H 120 -29.084 8.199 -66.052 1.00 0.00 H
+ATOM 1821 3HB ALA H 120 -27.556 7.747 -66.841 1.00 0.00 H
+ATOM 1822 N SER H 121 -25.907 10.618 -65.942 1.00109.94 N
+ATOM 1823 CA SER H 121 -24.522 11.061 -65.911 1.00112.81 C
+ATOM 1824 C SER H 121 -23.687 10.083 -65.094 1.00110.79 C
+ATOM 1825 O SER H 121 -24.211 9.244 -64.357 1.00117.51 O
+ATOM 1826 CB SER H 121 -24.411 12.477 -65.333 1.00118.15 C
+ATOM 1827 OG SER H 121 -25.135 13.403 -66.124 1.00123.28 O
+ATOM 1828 H SER H 121 -26.417 10.537 -65.074 1.00 0.00 H
+ATOM 1829 HA SER H 121 -24.140 11.075 -66.933 1.00 0.00 H
+ATOM 1830 1HB SER H 121 -24.795 12.485 -64.313 1.00 0.00 H
+ATOM 1831 2HB SER H 121 -23.363 12.771 -65.290 1.00 0.00 H
+ATOM 1832 HG SER H 121 -25.521 12.894 -66.840 1.00 0.00 H
+ATOM 1833 N THR H 122 -22.369 10.198 -65.235 1.00104.81 N
+ATOM 1834 CA THR H 122 -21.453 9.298 -64.545 1.00 93.51 C
+ATOM 1835 C THR H 122 -21.525 9.528 -63.040 1.00 98.72 C
+ATOM 1836 O THR H 122 -21.270 10.640 -62.564 1.00111.99 O
+ATOM 1837 CB THR H 122 -20.027 9.501 -65.051 1.00 86.69 C
+ATOM 1838 OG1 THR H 122 -19.929 9.042 -66.406 1.00104.35 O
+ATOM 1839 CG2 THR H 122 -19.039 8.738 -64.186 1.00 75.53 C
+ATOM 1840 H THR H 122 -21.992 10.922 -65.831 1.00 0.00 H
+ATOM 1841 HA THR H 122 -21.755 8.271 -64.753 1.00 0.00 H
+ATOM 1842 HB THR H 122 -19.779 10.562 -65.025 1.00 0.00 H
+ATOM 1843 HG1 THR H 122 -20.783 8.709 -66.693 1.00 0.00 H
+ATOM 1844 1HG2 THR H 122 -18.028 8.896 -64.562 1.00 0.00 H
+ATOM 1845 2HG2 THR H 122 -19.104 9.095 -63.158 1.00 0.00 H
+ATOM 1846 3HG2 THR H 122 -19.275 7.675 -64.216 1.00 0.00 H
+ATOM 1847 N LYS H 123 -21.872 8.479 -62.294 1.00 90.04 N
+ATOM 1848 CA LYS H 123 -21.974 8.544 -60.841 1.00 81.53 C
+ATOM 1849 C LYS H 123 -21.296 7.324 -60.241 1.00 85.67 C
+ATOM 1850 O LYS H 123 -21.538 6.197 -60.681 1.00 69.74 O
+ATOM 1851 CB LYS H 123 -23.434 8.623 -60.393 1.00 86.86 C
+ATOM 1852 CG LYS H 123 -23.624 8.752 -58.887 1.00 76.54 C
+ATOM 1853 CD LYS H 123 -25.094 8.901 -58.526 1.00 0.00 C
+ATOM 1854 CE LYS H 123 -25.286 9.031 -57.022 1.00 0.00 C
+ATOM 1855 NZ LYS H 123 -26.720 9.178 -56.654 1.00 0.00 N
+ATOM 1856 H LYS H 123 -22.071 7.607 -62.763 1.00 0.00 H
+ATOM 1857 HA LYS H 123 -21.467 9.446 -60.499 1.00 0.00 H
+ATOM 1858 1HB LYS H 123 -23.914 9.481 -60.865 1.00 0.00 H
+ATOM 1859 2HB LYS H 123 -23.965 7.729 -60.722 1.00 0.00 H
+ATOM 1860 1HG LYS H 123 -23.226 7.865 -58.393 1.00 0.00 H
+ATOM 1861 2HG LYS H 123 -23.079 9.623 -58.525 1.00 0.00 H
+ATOM 1862 1HD LYS H 123 -25.501 9.788 -59.014 1.00 0.00 H
+ATOM 1863 2HD LYS H 123 -25.646 8.030 -58.879 1.00 0.00 H
+ATOM 1864 1HE LYS H 123 -24.885 8.147 -56.528 1.00 0.00 H
+ATOM 1865 2HE LYS H 123 -24.740 9.902 -56.660 1.00 0.00 H
+ATOM 1866 1HZ LYS H 123 -26.804 9.261 -55.651 1.00 0.00 H
+ATOM 1867 2HZ LYS H 123 -27.098 10.006 -57.094 1.00 0.00 H
+ATOM 1868 3HZ LYS H 123 -27.234 8.367 -56.969 1.00 0.00 H
+ATOM 1869 N GLY H 124 -20.455 7.550 -59.237 1.00 97.25 N
+ATOM 1870 CA GLY H 124 -19.803 6.472 -58.538 1.00 98.93 C
+ATOM 1871 C GLY H 124 -20.784 5.660 -57.717 1.00 85.92 C
+ATOM 1872 O GLY H 124 -21.807 6.167 -57.246 1.00 77.46 O
+ATOM 1873 H GLY H 124 -20.268 8.502 -58.957 1.00 0.00 H
+ATOM 1874 1HA GLY H 124 -19.306 5.820 -59.257 1.00 0.00 H
+ATOM 1875 2HA GLY H 124 -19.032 6.877 -57.884 1.00 0.00 H
+ATOM 1876 N PRO H 125 -20.484 4.380 -57.526 1.00 85.63 N
+ATOM 1877 CA PRO H 125 -21.410 3.504 -56.804 1.00 84.70 C
+ATOM 1878 C PRO H 125 -21.415 3.780 -55.309 1.00 92.33 C
+ATOM 1879 O PRO H 125 -20.496 4.381 -54.749 1.00 87.35 O
+ATOM 1880 CB PRO H 125 -20.867 2.104 -57.101 1.00 72.63 C
+ATOM 1881 CG PRO H 125 -19.409 2.316 -57.312 1.00 74.44 C
+ATOM 1882 CD PRO H 125 -19.287 3.657 -57.990 1.00 85.72 C
+ATOM 1883 HA PRO H 125 -22.422 3.629 -57.217 1.00 0.00 H
+ATOM 1884 1HB PRO H 125 -21.083 1.430 -56.259 1.00 0.00 H
+ATOM 1885 2HB PRO H 125 -21.370 1.685 -57.985 1.00 0.00 H
+ATOM 1886 1HG PRO H 125 -18.878 2.291 -56.349 1.00 0.00 H
+ATOM 1887 2HG PRO H 125 -18.992 1.504 -57.926 1.00 0.00 H
+ATOM 1888 1HD PRO H 125 -18.362 4.152 -57.661 1.00 0.00 H
+ATOM 1889 2HD PRO H 125 -19.286 3.518 -59.081 1.00 0.00 H
+ATOM 1890 N SER H 126 -22.487 3.325 -54.663 1.00 88.08 N
+ATOM 1891 CA SER H 126 -22.617 3.357 -53.211 1.00 89.55 C
+ATOM 1892 C SER H 126 -22.659 1.921 -52.710 1.00 84.53 C
+ATOM 1893 O SER H 126 -23.569 1.164 -53.064 1.00 98.39 O
+ATOM 1894 CB SER H 126 -23.872 4.120 -52.783 1.00 94.81 C
+ATOM 1895 OG SER H 126 -23.846 5.452 -53.264 1.00104.29 O
+ATOM 1896 H SER H 126 -23.240 2.941 -55.216 1.00 0.00 H
+ATOM 1897 HA SER H 126 -21.747 3.869 -52.797 1.00 0.00 H
+ATOM 1898 1HB SER H 126 -24.756 3.610 -53.165 1.00 0.00 H
+ATOM 1899 2HB SER H 126 -23.942 4.125 -51.696 1.00 0.00 H
+ATOM 1900 HG SER H 126 -23.023 5.541 -53.751 1.00 0.00 H
+ATOM 1901 N VAL H 127 -21.675 1.544 -51.900 1.00 65.73 N
+ATOM 1902 CA VAL H 127 -21.538 0.176 -51.417 1.00 69.19 C
+ATOM 1903 C VAL H 127 -22.188 0.073 -50.044 1.00 76.60 C
+ATOM 1904 O VAL H 127 -21.826 0.809 -49.118 1.00 78.95 O
+ATOM 1905 CB VAL H 127 -20.066 -0.253 -51.358 1.00 63.54 C
+ATOM 1906 CG1 VAL H 127 -19.967 -1.712 -50.931 1.00 67.96 C
+ATOM 1907 CG2 VAL H 127 -19.396 -0.027 -52.704 1.00 68.75 C
+ATOM 1908 H VAL H 127 -21.000 2.237 -51.612 1.00 0.00 H
+ATOM 1909 HA VAL H 127 -22.059 -0.489 -52.107 1.00 0.00 H
+ATOM 1910 HB VAL H 127 -19.555 0.338 -50.597 1.00 0.00 H
+ATOM 1911 1HG1 VAL H 127 -18.919 -2.009 -50.891 1.00 0.00 H
+ATOM 1912 2HG1 VAL H 127 -20.416 -1.834 -49.945 1.00 0.00 H
+ATOM 1913 3HG1 VAL H 127 -20.494 -2.338 -51.651 1.00 0.00 H
+ATOM 1914 1HG2 VAL H 127 -18.352 -0.335 -52.647 1.00 0.00 H
+ATOM 1915 2HG2 VAL H 127 -19.907 -0.614 -53.468 1.00 0.00 H
+ATOM 1916 3HG2 VAL H 127 -19.448 1.031 -52.964 1.00 0.00 H
+ATOM 1917 N PHE H 128 -23.145 -0.847 -49.907 1.00 74.09 N
+ATOM 1918 CA PHE H 128 -23.782 -1.091 -48.628 1.00 62.28 C
+ATOM 1919 C PHE H 128 -23.572 -2.538 -48.201 1.00 74.43 C
+ATOM 1920 O PHE H 128 -23.580 -3.440 -49.044 1.00 85.07 O
+ATOM 1921 CB PHE H 128 -25.282 -0.785 -48.687 1.00 59.01 C
+ATOM 1922 CG PHE H 128 -25.590 0.639 -49.022 1.00 68.47 C
+ATOM 1923 CD1 PHE H 128 -25.117 1.666 -48.224 1.00 62.54 C
+ATOM 1924 CD2 PHE H 128 -26.359 0.956 -50.128 1.00 83.81 C
+ATOM 1925 CE1 PHE H 128 -25.398 2.984 -48.526 1.00 71.55 C
+ATOM 1926 CE2 PHE H 128 -26.645 2.275 -50.437 1.00 88.39 C
+ATOM 1927 CZ PHE H 128 -26.162 3.290 -49.635 1.00 79.21 C
+ATOM 1928 H PHE H 128 -23.433 -1.386 -50.711 1.00 0.00 H
+ATOM 1929 HA PHE H 128 -23.328 -0.434 -47.884 1.00 0.00 H
+ATOM 1930 1HB PHE H 128 -25.754 -1.422 -49.434 1.00 0.00 H
+ATOM 1931 2HB PHE H 128 -25.738 -1.016 -47.725 1.00 0.00 H
+ATOM 1932 HD1 PHE H 128 -24.515 1.425 -47.348 1.00 0.00 H
+ATOM 1933 HD2 PHE H 128 -26.740 0.153 -50.760 1.00 0.00 H
+ATOM 1934 HE1 PHE H 128 -25.016 3.782 -47.889 1.00 0.00 H
+ATOM 1935 HE2 PHE H 128 -27.251 2.513 -51.311 1.00 0.00 H
+ATOM 1936 HZ PHE H 128 -26.384 4.329 -49.875 1.00 0.00 H
+ATOM 1937 N PRO H 129 -23.378 -2.791 -46.911 1.00 76.61 N
+ATOM 1938 CA PRO H 129 -23.122 -4.161 -46.460 1.00 78.59 C
+ATOM 1939 C PRO H 129 -24.389 -5.000 -46.398 1.00 85.94 C
+ATOM 1940 O PRO H 129 -25.502 -4.492 -46.243 1.00100.27 O
+ATOM 1941 CB PRO H 129 -22.529 -3.959 -45.061 1.00 64.54 C
+ATOM 1942 CG PRO H 129 -23.139 -2.688 -44.592 1.00 64.28 C
+ATOM 1943 CD PRO H 129 -23.282 -1.818 -45.810 1.00 72.92 C
+ATOM 1944 HA PRO H 129 -22.391 -4.633 -47.133 1.00 0.00 H
+ATOM 1945 1HB PRO H 129 -22.779 -4.817 -44.419 1.00 0.00 H
+ATOM 1946 2HB PRO H 129 -21.432 -3.911 -45.121 1.00 0.00 H
+ATOM 1947 1HG PRO H 129 -24.111 -2.886 -44.116 1.00 0.00 H
+ATOM 1948 2HG PRO H 129 -22.501 -2.219 -43.829 1.00 0.00 H
+ATOM 1949 1HD PRO H 129 -24.196 -1.213 -45.724 1.00 0.00 H
+ATOM 1950 2HD PRO H 129 -22.397 -1.172 -45.906 1.00 0.00 H
+ATOM 1951 N LEU H 130 -24.196 -6.313 -46.528 1.00 70.60 N
+ATOM 1952 CA LEU H 130 -25.251 -7.319 -46.386 1.00 77.55 C
+ATOM 1953 C LEU H 130 -24.748 -8.318 -45.350 1.00 94.86 C
+ATOM 1954 O LEU H 130 -24.093 -9.307 -45.693 1.00106.24 O
+ATOM 1955 CB LEU H 130 -25.581 -7.989 -47.712 1.00 81.68 C
+ATOM 1956 CG LEU H 130 -26.201 -7.093 -48.787 1.00 80.35 C
+ATOM 1957 CD1 LEU H 130 -26.450 -7.873 -50.070 1.00 63.95 C
+ATOM 1958 CD2 LEU H 130 -27.491 -6.456 -48.279 1.00 81.37 C
+ATOM 1959 H LEU H 130 -23.255 -6.613 -46.738 1.00 0.00 H
+ATOM 1960 HA LEU H 130 -26.153 -6.825 -46.026 1.00 0.00 H
+ATOM 1961 1HB LEU H 130 -24.666 -8.409 -48.126 1.00 0.00 H
+ATOM 1962 2HB LEU H 130 -26.279 -8.805 -47.525 1.00 0.00 H
+ATOM 1963 HG LEU H 130 -25.498 -6.303 -49.052 1.00 0.00 H
+ATOM 1964 1HD1 LEU H 130 -26.891 -7.213 -50.817 1.00 0.00 H
+ATOM 1965 2HD1 LEU H 130 -25.505 -8.266 -50.446 1.00 0.00 H
+ATOM 1966 3HD1 LEU H 130 -27.132 -8.698 -49.868 1.00 0.00 H
+ATOM 1967 1HD2 LEU H 130 -27.915 -5.822 -49.058 1.00 0.00 H
+ATOM 1968 2HD2 LEU H 130 -28.205 -7.238 -48.018 1.00 0.00 H
+ATOM 1969 3HD2 LEU H 130 -27.276 -5.852 -47.397 1.00 0.00 H
+ATOM 1970 N ALA H 131 -25.068 -8.052 -44.079 1.00 95.27 N
+ATOM 1971 CA ALA H 131 -24.486 -8.750 -42.947 1.00 83.36 C
+ATOM 1972 C ALA H 131 -25.240 -10.046 -42.653 1.00 86.44 C
+ATOM 1973 O ALA H 131 -26.439 -10.151 -42.928 1.00 85.20 O
+ATOM 1974 CB ALA H 131 -24.502 -7.851 -41.716 1.00 82.01 C
+ATOM 1975 H ALA H 131 -25.750 -7.326 -43.912 1.00 0.00 H
+ATOM 1976 HA ALA H 131 -23.453 -8.996 -43.195 1.00 0.00 H
+ATOM 1977 1HB ALA H 131 -24.064 -8.383 -40.871 1.00 0.00 H
+ATOM 1978 2HB ALA H 131 -23.924 -6.949 -41.917 1.00 0.00 H
+ATOM 1979 3HB ALA H 131 -25.529 -7.578 -41.479 1.00 0.00 H
+ATOM 1980 N PRO H 132 -24.549 -11.054 -42.089 1.00 91.82 N
+ATOM 1981 CA PRO H 132 -25.167 -12.324 -41.688 1.00104.26 C
+ATOM 1982 C PRO H 132 -26.295 -12.156 -40.670 1.00107.66 C
+ATOM 1983 O PRO H 132 -26.343 -12.913 -39.699 1.00104.84 O
+ATOM 1984 CB PRO H 132 -24.001 -13.100 -41.065 1.00102.61 C
+ATOM 1985 CG PRO H 132 -22.784 -12.513 -41.677 1.00 89.84 C
+ATOM 1986 CD PRO H 132 -23.092 -11.061 -41.866 1.00 78.90 C
+ATOM 1987 HA PRO H 132 -25.548 -12.839 -42.582 1.00 0.00 H
+ATOM 1988 1HB PRO H 132 -24.017 -12.989 -39.971 1.00 0.00 H
+ATOM 1989 2HB PRO H 132 -24.105 -14.174 -41.281 1.00 0.00 H
+ATOM 1990 1HG PRO H 132 -21.915 -12.670 -41.021 1.00 0.00 H
+ATOM 1991 2HG PRO H 132 -22.558 -13.015 -42.629 1.00 0.00 H
+ATOM 1992 1HD PRO H 132 -22.818 -10.506 -40.957 1.00 0.00 H
+ATOM 1993 2HD PRO H 132 -22.538 -10.678 -42.736 1.00 0.00 H
+ATOM 1994 N GLY H 140 -25.078 -23.195 -39.044 1.00119.98 N
+ATOM 1995 CA GLY H 140 -24.171 -24.038 -39.802 1.00124.72 C
+ATOM 1996 C GLY H 140 -23.388 -23.298 -40.870 1.00123.57 C
+ATOM 1997 O GLY H 140 -22.156 -23.287 -40.859 1.00117.97 O
+ATOM 1998 H GLY H 140 -25.645 -23.610 -38.319 1.00 0.00 H
+ATOM 1999 1HA GLY H 140 -23.460 -24.510 -39.123 1.00 0.00 H
+ATOM 2000 2HA GLY H 140 -24.734 -24.837 -40.284 1.00 0.00 H
+ATOM 2001 N THR H 141 -24.109 -22.673 -41.797 1.00126.96 N
+ATOM 2002 CA THR H 141 -23.517 -21.935 -42.904 1.00113.74 C
+ATOM 2003 C THR H 141 -23.981 -20.485 -42.854 1.00110.21 C
+ATOM 2004 O THR H 141 -25.131 -20.202 -42.501 1.00123.39 O
+ATOM 2005 CB THR H 141 -23.899 -22.564 -44.253 1.00107.82 C
+ATOM 2006 OG1 THR H 141 -23.539 -23.951 -44.253 1.00116.93 O
+ATOM 2007 CG2 THR H 141 -23.192 -21.863 -45.402 1.00 87.58 C
+ATOM 2008 H THR H 141 -25.115 -22.720 -41.719 1.00 0.00 H
+ATOM 2009 HA THR H 141 -22.432 -21.971 -42.803 1.00 0.00 H
+ATOM 2010 HB THR H 141 -24.976 -22.484 -44.400 1.00 0.00 H
+ATOM 2011 HG1 THR H 141 -23.139 -24.177 -43.410 1.00 0.00 H
+ATOM 2012 1HG2 THR H 141 -23.481 -22.328 -46.345 1.00 0.00 H
+ATOM 2013 2HG2 THR H 141 -23.474 -20.810 -45.415 1.00 0.00 H
+ATOM 2014 3HG2 THR H 141 -22.114 -21.948 -45.271 1.00 0.00 H
+ATOM 2015 N ALA H 142 -23.084 -19.567 -43.203 1.00 98.94 N
+ATOM 2016 CA ALA H 142 -23.386 -18.145 -43.218 1.00 98.09 C
+ATOM 2017 C ALA H 142 -23.325 -17.604 -44.641 1.00101.59 C
+ATOM 2018 O ALA H 142 -22.647 -18.156 -45.512 1.00107.09 O
+ATOM 2019 CB ALA H 142 -22.419 -17.360 -42.321 1.00 87.65 C
+ATOM 2020 H ALA H 142 -22.159 -19.876 -43.467 1.00 0.00 H
+ATOM 2021 HA ALA H 142 -24.398 -18.010 -42.836 1.00 0.00 H
+ATOM 2022 1HB ALA H 142 -22.671 -16.300 -42.354 1.00 0.00 H
+ATOM 2023 2HB ALA H 142 -22.500 -17.721 -41.295 1.00 0.00 H
+ATOM 2024 3HB ALA H 142 -21.399 -17.501 -42.675 1.00 0.00 H
+ATOM 2025 N ALA H 143 -24.045 -16.507 -44.867 1.00 94.52 N
+ATOM 2026 CA ALA H 143 -24.058 -15.835 -46.159 1.00 72.04 C
+ATOM 2027 C ALA H 143 -23.943 -14.337 -45.936 1.00100.05 C
+ATOM 2028 O ALA H 143 -24.676 -13.776 -45.117 1.00109.23 O
+ATOM 2029 CB ALA H 143 -25.335 -16.158 -46.941 1.00 74.51 C
+ATOM 2030 H ALA H 143 -24.600 -16.132 -44.112 1.00 0.00 H
+ATOM 2031 HA ALA H 143 -23.202 -16.190 -46.734 1.00 0.00 H
+ATOM 2032 1HB ALA H 143 -25.314 -15.641 -47.901 1.00 0.00 H
+ATOM 2033 2HB ALA H 143 -25.397 -17.233 -47.109 1.00 0.00 H
+ATOM 2034 3HB ALA H 143 -26.203 -15.830 -46.371 1.00 0.00 H
+ATOM 2035 N LEU H 144 -23.024 -13.694 -46.656 1.00 84.71 N
+ATOM 2036 CA LEU H 144 -22.829 -12.255 -46.539 1.00 87.13 C
+ATOM 2037 C LEU H 144 -22.515 -11.683 -47.914 1.00 87.31 C
+ATOM 2038 O LEU H 144 -22.038 -12.390 -48.804 1.00 83.61 O
+ATOM 2039 CB LEU H 144 -21.714 -11.913 -45.537 1.00 87.55 C
+ATOM 2040 CG LEU H 144 -20.321 -12.508 -45.773 1.00 95.49 C
+ATOM 2041 CD1 LEU H 144 -19.435 -11.552 -46.560 1.00102.36 C
+ATOM 2042 CD2 LEU H 144 -19.658 -12.890 -44.458 1.00 95.70 C
+ATOM 2043 H LEU H 144 -22.448 -14.218 -47.299 1.00 0.00 H
+ATOM 2044 HA LEU H 144 -23.755 -11.809 -46.179 1.00 0.00 H
+ATOM 2045 1HB LEU H 144 -21.587 -10.832 -45.515 1.00 0.00 H
+ATOM 2046 2HB LEU H 144 -22.025 -12.242 -44.545 1.00 0.00 H
+ATOM 2047 HG LEU H 144 -20.407 -13.401 -46.392 1.00 0.00 H
+ATOM 2048 1HD1 LEU H 144 -18.455 -12.005 -46.710 1.00 0.00 H
+ATOM 2049 2HD1 LEU H 144 -19.891 -11.347 -47.529 1.00 0.00 H
+ATOM 2050 3HD1 LEU H 144 -19.323 -10.621 -46.006 1.00 0.00 H
+ATOM 2051 1HD2 LEU H 144 -18.671 -13.310 -44.656 1.00 0.00 H
+ATOM 2052 2HD2 LEU H 144 -19.556 -12.004 -43.831 1.00 0.00 H
+ATOM 2053 3HD2 LEU H 144 -20.271 -13.630 -43.943 1.00 0.00 H
+ATOM 2054 N GLY H 145 -22.786 -10.390 -48.087 1.00 78.49 N
+ATOM 2055 CA GLY H 145 -22.600 -9.825 -49.409 1.00 80.50 C
+ATOM 2056 C GLY H 145 -22.455 -8.319 -49.399 1.00 81.15 C
+ATOM 2057 O GLY H 145 -22.457 -7.674 -48.350 1.00 75.01 O
+ATOM 2058 H GLY H 145 -23.113 -9.795 -47.339 1.00 0.00 H
+ATOM 2059 1HA GLY H 145 -21.711 -10.258 -49.868 1.00 0.00 H
+ATOM 2060 2HA GLY H 145 -23.448 -10.089 -50.040 1.00 0.00 H
+ATOM 2061 N CYS H 146 -22.320 -7.771 -50.605 1.00 92.05 N
+ATOM 2062 CA CYS H 146 -22.201 -6.343 -50.853 1.00 87.85 C
+ATOM 2063 C CYS H 146 -23.261 -5.918 -51.854 1.00 88.12 C
+ATOM 2064 O CYS H 146 -23.491 -6.604 -52.856 1.00111.59 O
+ATOM 2065 CB CYS H 146 -20.814 -5.977 -51.391 1.00101.44 C
+ATOM 2066 SG CYS H 146 -19.591 -5.671 -50.110 1.00135.87 S
+ATOM 2067 H CYS H 146 -22.301 -8.409 -51.387 1.00 0.00 H
+ATOM 2068 HA CYS H 146 -22.349 -5.815 -49.911 1.00 0.00 H
+ATOM 2069 1HB CYS H 146 -20.445 -6.783 -52.025 1.00 0.00 H
+ATOM 2070 2HB CYS H 146 -20.888 -5.082 -52.009 1.00 0.00 H
+ATOM 2071 N LEU H 147 -23.901 -4.787 -51.579 1.00 75.41 N
+ATOM 2072 CA LEU H 147 -24.905 -4.204 -52.462 1.00 75.85 C
+ATOM 2073 C LEU H 147 -24.323 -2.938 -53.083 1.00 79.76 C
+ATOM 2074 O LEU H 147 -24.196 -1.908 -52.411 1.00 75.16 O
+ATOM 2075 CB LEU H 147 -26.198 -3.912 -51.704 1.00 71.60 C
+ATOM 2076 CG LEU H 147 -27.323 -3.267 -52.515 1.00 77.63 C
+ATOM 2077 CD1 LEU H 147 -27.592 -4.054 -53.784 1.00 88.04 C
+ATOM 2078 CD2 LEU H 147 -28.589 -3.154 -51.684 1.00 78.67 C
+ATOM 2079 H LEU H 147 -23.674 -4.317 -50.715 1.00 0.00 H
+ATOM 2080 HA LEU H 147 -25.125 -4.918 -53.254 1.00 0.00 H
+ATOM 2081 1HB LEU H 147 -26.582 -4.847 -51.299 1.00 0.00 H
+ATOM 2082 2HB LEU H 147 -25.970 -3.246 -50.872 1.00 0.00 H
+ATOM 2083 HG LEU H 147 -27.019 -2.268 -52.829 1.00 0.00 H
+ATOM 2084 1HD1 LEU H 147 -28.396 -3.577 -54.345 1.00 0.00 H
+ATOM 2085 2HD1 LEU H 147 -26.690 -4.079 -54.395 1.00 0.00 H
+ATOM 2086 3HD1 LEU H 147 -27.885 -5.071 -53.526 1.00 0.00 H
+ATOM 2087 1HD2 LEU H 147 -29.376 -2.692 -52.281 1.00 0.00 H
+ATOM 2088 2HD2 LEU H 147 -28.908 -4.148 -51.370 1.00 0.00 H
+ATOM 2089 3HD2 LEU H 147 -28.393 -2.541 -50.804 1.00 0.00 H
+ATOM 2090 N VAL H 148 -23.967 -3.024 -54.361 1.00 75.38 N
+ATOM 2091 CA VAL H 148 -23.412 -1.903 -55.110 1.00 78.14 C
+ATOM 2092 C VAL H 148 -24.574 -1.206 -55.811 1.00 83.88 C
+ATOM 2093 O VAL H 148 -25.115 -1.720 -56.795 1.00 95.01 O
+ATOM 2094 CB VAL H 148 -22.355 -2.377 -56.115 1.00 78.45 C
+ATOM 2095 CG1 VAL H 148 -21.778 -1.204 -56.877 1.00 79.82 C
+ATOM 2096 CG2 VAL H 148 -21.260 -3.159 -55.409 1.00 67.38 C
+ATOM 2097 H VAL H 148 -24.091 -3.912 -54.825 1.00 0.00 H
+ATOM 2098 HA VAL H 148 -22.934 -1.220 -54.407 1.00 0.00 H
+ATOM 2099 HB VAL H 148 -22.833 -3.019 -56.855 1.00 0.00 H
+ATOM 2100 1HG1 VAL H 148 -21.030 -1.562 -57.585 1.00 0.00 H
+ATOM 2101 2HG1 VAL H 148 -22.575 -0.695 -57.419 1.00 0.00 H
+ATOM 2102 3HG1 VAL H 148 -21.311 -0.510 -56.178 1.00 0.00 H
+ATOM 2103 1HG2 VAL H 148 -20.520 -3.488 -56.138 1.00 0.00 H
+ATOM 2104 2HG2 VAL H 148 -20.780 -2.523 -54.665 1.00 0.00 H
+ATOM 2105 3HG2 VAL H 148 -21.694 -4.029 -54.916 1.00 0.00 H
+ATOM 2106 N LYS H 149 -24.961 -0.036 -55.309 1.00 78.06 N
+ATOM 2107 CA LYS H 149 -26.199 0.610 -55.723 1.00 79.45 C
+ATOM 2108 C LYS H 149 -25.925 1.965 -56.363 1.00 78.43 C
+ATOM 2109 O LYS H 149 -25.036 2.704 -55.925 1.00 60.58 O
+ATOM 2110 CB LYS H 149 -27.150 0.782 -54.530 1.00 66.60 C
+ATOM 2111 CG LYS H 149 -28.599 0.984 -54.924 1.00 76.80 C
+ATOM 2112 CD LYS H 149 -29.501 1.049 -53.706 1.00 94.77 C
+ATOM 2113 CE LYS H 149 -30.965 1.094 -54.112 1.00100.30 C
+ATOM 2114 NZ LYS H 149 -31.232 2.208 -55.063 1.00 96.47 N
+ATOM 2115 H LYS H 149 -24.377 0.416 -54.620 1.00 0.00 H
+ATOM 2116 HA LYS H 149 -26.687 -0.022 -56.466 1.00 0.00 H
+ATOM 2117 1HB LYS H 149 -27.092 -0.098 -53.889 1.00 0.00 H
+ATOM 2118 2HB LYS H 149 -26.837 1.641 -53.936 1.00 0.00 H
+ATOM 2119 1HG LYS H 149 -28.697 1.913 -55.487 1.00 0.00 H
+ATOM 2120 2HG LYS H 149 -28.922 0.160 -55.559 1.00 0.00 H
+ATOM 2121 1HD LYS H 149 -29.330 0.173 -53.079 1.00 0.00 H
+ATOM 2122 2HD LYS H 149 -29.265 1.941 -53.125 1.00 0.00 H
+ATOM 2123 1HE LYS H 149 -31.241 0.151 -54.582 1.00 0.00 H
+ATOM 2124 2HE LYS H 149 -31.585 1.228 -53.225 1.00 0.00 H
+ATOM 2125 1HZ LYS H 149 -32.211 2.211 -55.312 1.00 0.00 H
+ATOM 2126 2HZ LYS H 149 -30.993 3.088 -54.627 1.00 0.00 H
+ATOM 2127 3HZ LYS H 149 -30.674 2.082 -55.895 1.00 0.00 H
+ATOM 2128 N ASP H 150 -26.697 2.271 -57.411 1.00 91.34 N
+ATOM 2129 CA ASP H 150 -26.742 3.585 -58.048 1.00 89.07 C
+ATOM 2130 C ASP H 150 -25.396 4.005 -58.629 1.00 91.87 C
+ATOM 2131 O ASP H 150 -24.713 4.872 -58.075 1.00102.38 O
+ATOM 2132 CB ASP H 150 -27.248 4.642 -57.062 1.00 93.77 C
+ATOM 2133 CG ASP H 150 -28.625 4.313 -56.505 1.00110.11 C
+ATOM 2134 OD1 ASP H 150 -29.374 3.556 -57.162 1.00116.50 O
+ATOM 2135 OD2 ASP H 150 -28.966 4.820 -55.416 1.00119.97 O
+ATOM 2136 H ASP H 150 -27.281 1.529 -57.771 1.00 0.00 H
+ATOM 2137 HA ASP H 150 -27.431 3.537 -58.892 1.00 0.00 H
+ATOM 2138 1HB ASP H 150 -26.546 4.732 -56.233 1.00 0.00 H
+ATOM 2139 2HB ASP H 150 -27.293 5.612 -57.559 1.00 0.00 H
+ATOM 2140 N TYR H 151 -25.020 3.405 -59.756 1.00 82.81 N
+ATOM 2141 CA TYR H 151 -23.811 3.781 -60.472 1.00 80.14 C
+ATOM 2142 C TYR H 151 -24.093 3.811 -61.969 1.00 85.36 C
+ATOM 2143 O TYR H 151 -25.050 3.205 -62.459 1.00 79.73 O
+ATOM 2144 CB TYR H 151 -22.648 2.828 -60.160 1.00 79.01 C
+ATOM 2145 CG TYR H 151 -22.814 1.431 -60.720 1.00 85.47 C
+ATOM 2146 CD1 TYR H 151 -22.216 1.063 -61.922 1.00 81.99 C
+ATOM 2147 CD2 TYR H 151 -23.555 0.477 -60.039 1.00 83.27 C
+ATOM 2148 CE1 TYR H 151 -22.365 -0.211 -62.430 1.00 81.97 C
+ATOM 2149 CE2 TYR H 151 -23.706 -0.800 -60.540 1.00 81.44 C
+ATOM 2150 CZ TYR H 151 -23.110 -1.138 -61.734 1.00 80.70 C
+ATOM 2151 OH TYR H 151 -23.263 -2.412 -62.229 1.00 85.91 O
+ATOM 2152 H TYR H 151 -25.598 2.663 -60.123 1.00 0.00 H
+ATOM 2153 HA TYR H 151 -23.520 4.784 -60.157 1.00 0.00 H
+ATOM 2154 1HB TYR H 151 -21.721 3.241 -60.561 1.00 0.00 H
+ATOM 2155 2HB TYR H 151 -22.527 2.742 -59.080 1.00 0.00 H
+ATOM 2156 HD1 TYR H 151 -21.619 1.786 -62.478 1.00 0.00 H
+ATOM 2157 HD2 TYR H 151 -24.031 0.731 -59.092 1.00 0.00 H
+ATOM 2158 HE1 TYR H 151 -21.889 -0.481 -63.373 1.00 0.00 H
+ATOM 2159 HE2 TYR H 151 -24.296 -1.535 -59.991 1.00 0.00 H
+ATOM 2160 HH TYR H 151 -23.806 -2.926 -61.626 1.00 0.00 H
+ATOM 2161 N PHE H 152 -23.239 4.529 -62.692 1.00 82.43 N
+ATOM 2162 CA PHE H 152 -23.403 4.704 -64.127 1.00 84.42 C
+ATOM 2163 C PHE H 152 -22.118 5.243 -64.743 1.00 93.89 C
+ATOM 2164 O PHE H 152 -21.510 6.165 -64.203 1.00 97.57 O
+ATOM 2165 CB PHE H 152 -24.572 5.648 -64.419 1.00 86.67 C
+ATOM 2166 CG PHE H 152 -24.905 5.777 -65.880 1.00 97.97 C
+ATOM 2167 CD1 PHE H 152 -25.787 4.895 -66.483 1.00 95.89 C
+ATOM 2168 CD2 PHE H 152 -24.348 6.788 -66.644 1.00 99.54 C
+ATOM 2169 CE1 PHE H 152 -26.099 5.013 -67.822 1.00100.51 C
+ATOM 2170 CE2 PHE H 152 -24.657 6.911 -67.984 1.00106.86 C
+ATOM 2171 CZ PHE H 152 -25.534 6.022 -68.573 1.00105.51 C
+ATOM 2172 H PHE H 152 -22.454 4.965 -62.230 1.00 0.00 H
+ATOM 2173 HA PHE H 152 -23.619 3.732 -64.572 1.00 0.00 H
+ATOM 2174 1HB PHE H 152 -25.462 5.296 -63.900 1.00 0.00 H
+ATOM 2175 2HB PHE H 152 -24.342 6.641 -64.036 1.00 0.00 H
+ATOM 2176 HD1 PHE H 152 -26.237 4.101 -65.887 1.00 0.00 H
+ATOM 2177 HD2 PHE H 152 -23.655 7.489 -66.178 1.00 0.00 H
+ATOM 2178 HE1 PHE H 152 -26.791 4.309 -68.284 1.00 0.00 H
+ATOM 2179 HE2 PHE H 152 -24.209 7.708 -68.578 1.00 0.00 H
+ATOM 2180 HZ PHE H 152 -25.778 6.118 -69.630 1.00 0.00 H
+ATOM 2181 N PRO H 153 -21.693 4.664 -65.876 1.00 89.26 N
+ATOM 2182 CA PRO H 153 -22.327 3.518 -66.529 1.00 76.92 C
+ATOM 2183 C PRO H 153 -21.719 2.195 -66.085 1.00 84.79 C
+ATOM 2184 O PRO H 153 -20.854 2.179 -65.211 1.00 94.89 O
+ATOM 2185 CB PRO H 153 -22.037 3.771 -68.001 1.00 81.27 C
+ATOM 2186 CG PRO H 153 -20.683 4.401 -67.973 1.00 88.30 C
+ATOM 2187 CD PRO H 153 -20.618 5.231 -66.710 1.00 90.01 C
+ATOM 2188 HA PRO H 153 -23.408 3.540 -66.328 1.00 0.00 H
+ATOM 2189 1HB PRO H 153 -22.067 2.823 -68.559 1.00 0.00 H
+ATOM 2190 2HB PRO H 153 -22.813 4.421 -68.431 1.00 0.00 H
+ATOM 2191 1HG PRO H 153 -19.903 3.626 -67.987 1.00 0.00 H
+ATOM 2192 2HG PRO H 153 -20.533 5.019 -68.871 1.00 0.00 H
+ATOM 2193 1HD PRO H 153 -19.632 5.106 -66.239 1.00 0.00 H
+ATOM 2194 2HD PRO H 153 -20.800 6.288 -66.955 1.00 0.00 H
+ATOM 2195 N GLU H 154 -22.171 1.101 -66.686 1.00 86.08 N
+ATOM 2196 CA GLU H 154 -21.583 -0.207 -66.433 1.00 83.18 C
+ATOM 2197 C GLU H 154 -20.172 -0.249 -67.020 1.00 87.69 C
+ATOM 2198 O GLU H 154 -19.878 0.476 -67.971 1.00 95.60 O
+ATOM 2199 CB GLU H 154 -22.461 -1.312 -67.026 1.00 93.56 C
+ATOM 2200 CG GLU H 154 -23.516 -1.842 -66.072 1.00104.66 C
+ATOM 2201 CD GLU H 154 -23.999 -3.229 -66.452 1.00131.52 C
+ATOM 2202 OE1 GLU H 154 -24.016 -3.550 -67.660 1.00139.78 O
+ATOM 2203 OE2 GLU H 154 -24.354 -4.004 -65.540 1.00141.30 O
+ATOM 2204 H GLU H 154 -22.941 1.177 -67.335 1.00 0.00 H
+ATOM 2205 HA GLU H 154 -21.518 -0.354 -65.354 1.00 0.00 H
+ATOM 2206 1HB GLU H 154 -22.967 -0.936 -67.915 1.00 0.00 H
+ATOM 2207 2HB GLU H 154 -21.834 -2.148 -67.335 1.00 0.00 H
+ATOM 2208 1HG GLU H 154 -23.098 -1.875 -65.066 1.00 0.00 H
+ATOM 2209 2HG GLU H 154 -24.361 -1.154 -66.063 1.00 0.00 H
+ATOM 2210 N PRO H 155 -19.294 -1.103 -66.465 1.00 78.95 N
+ATOM 2211 CA PRO H 155 -19.545 -2.062 -65.388 1.00 93.08 C
+ATOM 2212 C PRO H 155 -18.912 -1.696 -64.052 1.00 90.63 C
+ATOM 2213 O PRO H 155 -18.415 -0.585 -63.861 1.00 93.82 O
+ATOM 2214 CB PRO H 155 -18.895 -3.331 -65.928 1.00102.27 C
+ATOM 2215 CG PRO H 155 -17.720 -2.800 -66.781 1.00 97.15 C
+ATOM 2216 CD PRO H 155 -17.954 -1.316 -67.032 1.00 82.01 C
+ATOM 2217 HA PRO H 155 -20.630 -2.190 -65.263 1.00 0.00 H
+ATOM 2218 1HB PRO H 155 -18.570 -3.971 -65.095 1.00 0.00 H
+ATOM 2219 2HB PRO H 155 -19.627 -3.909 -66.511 1.00 0.00 H
+ATOM 2220 1HG PRO H 155 -16.766 -2.963 -66.257 1.00 0.00 H
+ATOM 2221 2HG PRO H 155 -17.660 -3.353 -67.730 1.00 0.00 H
+ATOM 2222 1HD PRO H 155 -17.187 -0.729 -66.505 1.00 0.00 H
+ATOM 2223 2HD PRO H 155 -17.921 -1.117 -68.113 1.00 0.00 H
+ATOM 2224 N VAL H 156 -18.943 -2.657 -63.133 1.00 82.19 N
+ATOM 2225 CA VAL H 156 -18.184 -2.605 -61.890 1.00 85.43 C
+ATOM 2226 C VAL H 156 -17.571 -3.978 -61.667 1.00 86.64 C
+ATOM 2227 O VAL H 156 -18.220 -5.004 -61.904 1.00 91.71 O
+ATOM 2228 CB VAL H 156 -19.056 -2.193 -60.683 1.00 74.48 C
+ATOM 2229 CG1 VAL H 156 -19.325 -0.704 -60.696 1.00 77.76 C
+ATOM 2230 CG2 VAL H 156 -20.361 -2.951 -60.688 1.00 71.27 C
+ATOM 2231 H VAL H 156 -19.528 -3.459 -63.319 1.00 0.00 H
+ATOM 2232 HA VAL H 156 -17.394 -1.861 -61.998 1.00 0.00 H
+ATOM 2233 HB VAL H 156 -18.516 -2.416 -59.763 1.00 0.00 H
+ATOM 2234 1HG1 VAL H 156 -19.941 -0.438 -59.836 1.00 0.00 H
+ATOM 2235 2HG1 VAL H 156 -18.380 -0.163 -60.646 1.00 0.00 H
+ATOM 2236 3HG1 VAL H 156 -19.849 -0.437 -61.613 1.00 0.00 H
+ATOM 2237 1HG2 VAL H 156 -20.961 -2.648 -59.830 1.00 0.00 H
+ATOM 2238 2HG2 VAL H 156 -20.905 -2.733 -61.607 1.00 0.00 H
+ATOM 2239 3HG2 VAL H 156 -20.161 -4.021 -60.630 1.00 0.00 H
+ATOM 2240 N THR H 157 -16.317 -4.003 -61.231 1.00 80.87 N
+ATOM 2241 CA THR H 157 -15.649 -5.246 -60.873 1.00 81.40 C
+ATOM 2242 C THR H 157 -15.653 -5.391 -59.356 1.00 83.45 C
+ATOM 2243 O THR H 157 -15.271 -4.462 -58.636 1.00 72.70 O
+ATOM 2244 CB THR H 157 -14.220 -5.285 -61.419 1.00 76.68 C
+ATOM 2245 OG1 THR H 157 -13.500 -4.130 -60.970 1.00 83.11 O
+ATOM 2246 CG2 THR H 157 -14.233 -5.311 -62.937 1.00 88.15 C
+ATOM 2247 H THR H 157 -15.813 -3.132 -61.146 1.00 0.00 H
+ATOM 2248 HA THR H 157 -16.205 -6.076 -61.310 1.00 0.00 H
+ATOM 2249 HB THR H 157 -13.714 -6.176 -61.049 1.00 0.00 H
+ATOM 2250 HG1 THR H 157 -14.075 -3.587 -60.425 1.00 0.00 H
+ATOM 2251 1HG2 THR H 157 -13.209 -5.339 -63.309 1.00 0.00 H
+ATOM 2252 2HG2 THR H 157 -14.769 -6.195 -63.281 1.00 0.00 H
+ATOM 2253 3HG2 THR H 157 -14.730 -4.417 -63.312 1.00 0.00 H
+ATOM 2254 N VAL H 158 -16.098 -6.547 -58.873 1.00 85.06 N
+ATOM 2255 CA VAL H 158 -16.283 -6.785 -57.446 1.00 83.22 C
+ATOM 2256 C VAL H 158 -15.529 -8.054 -57.072 1.00 78.80 C
+ATOM 2257 O VAL H 158 -15.896 -9.151 -57.510 1.00 75.51 O
+ATOM 2258 CB VAL H 158 -17.766 -6.902 -57.068 1.00 73.61 C
+ATOM 2259 CG1 VAL H 158 -17.904 -7.312 -55.614 1.00 75.89 C
+ATOM 2260 CG2 VAL H 158 -18.478 -5.582 -57.323 1.00 68.03 C
+ATOM 2261 H VAL H 158 -16.315 -7.286 -59.527 1.00 0.00 H
+ATOM 2262 HA VAL H 158 -15.863 -5.941 -56.897 1.00 0.00 H
+ATOM 2263 HB VAL H 158 -18.225 -7.684 -57.673 1.00 0.00 H
+ATOM 2264 1HG1 VAL H 158 -18.961 -7.392 -55.357 1.00 0.00 H
+ATOM 2265 2HG1 VAL H 158 -17.420 -8.276 -55.460 1.00 0.00 H
+ATOM 2266 3HG1 VAL H 158 -17.433 -6.563 -54.978 1.00 0.00 H
+ATOM 2267 1HG2 VAL H 158 -19.529 -5.677 -57.052 1.00 0.00 H
+ATOM 2268 2HG2 VAL H 158 -18.017 -4.798 -56.722 1.00 0.00 H
+ATOM 2269 3HG2 VAL H 158 -18.398 -5.323 -58.379 1.00 0.00 H
+ATOM 2270 N SER H 159 -14.482 -7.909 -56.267 1.00 82.12 N
+ATOM 2271 CA SER H 159 -13.731 -9.039 -55.739 1.00 88.15 C
+ATOM 2272 C SER H 159 -13.976 -9.151 -54.239 1.00 84.89 C
+ATOM 2273 O SER H 159 -14.698 -8.349 -53.643 1.00 90.69 O
+ATOM 2274 CB SER H 159 -12.240 -8.897 -56.054 1.00104.25 C
+ATOM 2275 OG SER H 159 -11.714 -7.694 -55.526 1.00106.70 O
+ATOM 2276 H SER H 159 -14.202 -6.972 -56.016 1.00 0.00 H
+ATOM 2277 HA SER H 159 -14.099 -9.951 -56.212 1.00 0.00 H
+ATOM 2278 1HB SER H 159 -11.698 -9.745 -55.636 1.00 0.00 H
+ATOM 2279 2HB SER H 159 -12.093 -8.915 -57.133 1.00 0.00 H
+ATOM 2280 HG SER H 159 -12.447 -7.254 -55.089 1.00 0.00 H
+ATOM 2281 N TRP H 160 -13.372 -10.167 -53.627 1.00 86.83 N
+ATOM 2282 CA TRP H 160 -13.526 -10.405 -52.197 1.00 90.05 C
+ATOM 2283 C TRP H 160 -12.170 -10.693 -51.576 1.00 91.57 C
+ATOM 2284 O TRP H 160 -11.421 -11.535 -52.081 1.00101.31 O
+ATOM 2285 CB TRP H 160 -14.486 -11.570 -51.925 1.00 91.45 C
+ATOM 2286 CG TRP H 160 -15.922 -11.193 -52.070 1.00 93.77 C
+ATOM 2287 CD1 TRP H 160 -16.699 -11.340 -53.180 1.00 98.87 C
+ATOM 2288 CD2 TRP H 160 -16.756 -10.596 -51.072 1.00 91.29 C
+ATOM 2289 NE1 TRP H 160 -17.968 -10.875 -52.935 1.00 99.27 N
+ATOM 2290 CE2 TRP H 160 -18.029 -10.412 -51.647 1.00 86.69 C
+ATOM 2291 CE3 TRP H 160 -16.551 -10.200 -49.747 1.00 90.44 C
+ATOM 2292 CZ2 TRP H 160 -19.091 -9.849 -50.945 1.00 84.83 C
+ATOM 2293 CZ3 TRP H 160 -17.607 -9.642 -49.051 1.00 88.36 C
+ATOM 2294 CH2 TRP H 160 -18.861 -9.472 -49.651 1.00 84.29 C
+ATOM 2295 H TRP H 160 -12.791 -10.790 -54.170 1.00 0.00 H
+ATOM 2296 HA TRP H 160 -13.942 -9.507 -51.740 1.00 0.00 H
+ATOM 2297 1HB TRP H 160 -14.271 -12.387 -52.614 1.00 0.00 H
+ATOM 2298 2HB TRP H 160 -14.327 -11.944 -50.914 1.00 0.00 H
+ATOM 2299 HD1 TRP H 160 -16.362 -11.764 -54.124 1.00 0.00 H
+ATOM 2300 HE1 TRP H 160 -18.732 -10.873 -53.596 1.00 0.00 H
+ATOM 2301 HE3 TRP H 160 -15.579 -10.331 -49.272 1.00 0.00 H
+ATOM 2302 HZ2 TRP H 160 -20.074 -9.709 -51.395 1.00 0.00 H
+ATOM 2303 HZ3 TRP H 160 -17.437 -9.336 -48.018 1.00 0.00 H
+ATOM 2304 HH2 TRP H 160 -19.670 -9.028 -49.071 1.00 0.00 H
+ATOM 2305 N ASN H 161 -11.866 -9.995 -50.481 1.00 78.32 N
+ATOM 2306 CA ASN H 161 -10.602 -10.162 -49.763 1.00 80.71 C
+ATOM 2307 C ASN H 161 -9.412 -9.970 -50.699 1.00 92.98 C
+ATOM 2308 O ASN H 161 -8.437 -10.724 -50.663 1.00 99.45 O
+ATOM 2309 CB ASN H 161 -10.541 -11.522 -49.064 1.00 77.64 C
+ATOM 2310 CG ASN H 161 -11.481 -11.610 -47.873 1.00 79.93 C
+ATOM 2311 OD1 ASN H 161 -12.306 -10.723 -47.648 1.00 74.56 O
+ATOM 2312 ND2 ASN H 161 -11.361 -12.687 -47.105 1.00 82.97 N
+ATOM 2313 H ASN H 161 -12.541 -9.326 -50.140 1.00 0.00 H
+ATOM 2314 HA ASN H 161 -10.530 -9.382 -49.003 1.00 0.00 H
+ATOM 2315 1HB ASN H 161 -10.799 -12.308 -49.774 1.00 0.00 H
+ATOM 2316 2HB ASN H 161 -9.523 -11.710 -48.723 1.00 0.00 H
+ATOM 2317 1HD2 ASN H 161 -11.953 -12.800 -46.306 1.00 0.00 H
+ATOM 2318 2HD2 ASN H 161 -10.680 -13.384 -47.325 1.00 0.00 H
+ATOM 2319 N SER H 162 -9.503 -8.943 -51.547 1.00 90.44 N
+ATOM 2320 CA SER H 162 -8.462 -8.626 -52.525 1.00 93.09 C
+ATOM 2321 C SER H 162 -8.202 -9.810 -53.454 1.00 94.89 C
+ATOM 2322 O SER H 162 -7.063 -10.093 -53.830 1.00 93.23 O
+ATOM 2323 CB SER H 162 -7.171 -8.178 -51.836 1.00 91.20 C
+ATOM 2324 OG SER H 162 -7.393 -7.031 -51.035 1.00 87.78 O
+ATOM 2325 H SER H 162 -10.330 -8.365 -51.504 1.00 0.00 H
+ATOM 2326 HA SER H 162 -8.816 -7.808 -53.154 1.00 0.00 H
+ATOM 2327 1HB SER H 162 -6.789 -8.989 -51.216 1.00 0.00 H
+ATOM 2328 2HB SER H 162 -6.415 -7.958 -52.588 1.00 0.00 H
+ATOM 2329 HG SER H 162 -8.325 -6.818 -51.130 1.00 0.00 H
+ATOM 2330 N GLY H 163 -9.272 -10.512 -53.823 1.00 93.75 N
+ATOM 2331 CA GLY H 163 -9.167 -11.657 -54.702 1.00 87.46 C
+ATOM 2332 C GLY H 163 -8.768 -12.952 -54.034 1.00 83.49 C
+ATOM 2333 O GLY H 163 -8.527 -13.941 -54.735 1.00 84.37 O
+ATOM 2334 H GLY H 163 -10.181 -10.237 -53.480 1.00 0.00 H
+ATOM 2335 1HA GLY H 163 -10.124 -11.825 -55.197 1.00 0.00 H
+ATOM 2336 2HA GLY H 163 -8.434 -11.451 -55.481 1.00 0.00 H
+ATOM 2337 N ALA H 164 -8.692 -12.985 -52.702 1.00 84.56 N
+ATOM 2338 CA ALA H 164 -8.283 -14.196 -52.001 1.00 85.51 C
+ATOM 2339 C ALA H 164 -9.429 -15.177 -51.792 1.00 88.23 C
+ATOM 2340 O ALA H 164 -9.174 -16.366 -51.572 1.00 98.38 O
+ATOM 2341 CB ALA H 164 -7.662 -13.841 -50.649 1.00 86.44 C
+ATOM 2342 H ALA H 164 -8.921 -12.160 -52.166 1.00 0.00 H
+ATOM 2343 HA ALA H 164 -7.536 -14.705 -52.611 1.00 0.00 H
+ATOM 2344 1HB ALA H 164 -7.361 -14.754 -50.136 1.00 0.00 H
+ATOM 2345 2HB ALA H 164 -6.789 -13.208 -50.805 1.00 0.00 H
+ATOM 2346 3HB ALA H 164 -8.392 -13.308 -50.042 1.00 0.00 H
+ATOM 2347 N LEU H 165 -10.676 -14.715 -51.856 1.00 81.29 N
+ATOM 2348 CA LEU H 165 -11.850 -15.560 -51.657 1.00 83.80 C
+ATOM 2349 C LEU H 165 -12.600 -15.671 -52.980 1.00 93.69 C
+ATOM 2350 O LEU H 165 -13.234 -14.707 -53.422 1.00 93.40 O
+ATOM 2351 CB LEU H 165 -12.748 -14.993 -50.560 1.00 75.57 C
+ATOM 2352 CG LEU H 165 -14.010 -15.785 -50.211 1.00 71.23 C
+ATOM 2353 CD1 LEU H 165 -13.665 -17.178 -49.713 1.00 74.06 C
+ATOM 2354 CD2 LEU H 165 -14.821 -15.038 -49.173 1.00 68.85 C
+ATOM 2355 H LEU H 165 -10.804 -13.733 -52.052 1.00 0.00 H
+ATOM 2356 HA LEU H 165 -11.515 -16.551 -51.351 1.00 0.00 H
+ATOM 2357 1HB LEU H 165 -12.165 -14.906 -49.644 1.00 0.00 H
+ATOM 2358 2HB LEU H 165 -13.071 -13.995 -50.857 1.00 0.00 H
+ATOM 2359 HG LEU H 165 -14.615 -15.920 -51.108 1.00 0.00 H
+ATOM 2360 1HD1 LEU H 165 -14.582 -17.716 -49.473 1.00 0.00 H
+ATOM 2361 2HD1 LEU H 165 -13.121 -17.717 -50.489 1.00 0.00 H
+ATOM 2362 3HD1 LEU H 165 -13.045 -17.102 -48.820 1.00 0.00 H
+ATOM 2363 1HD2 LEU H 165 -15.718 -15.609 -48.932 1.00 0.00 H
+ATOM 2364 2HD2 LEU H 165 -14.223 -14.903 -48.272 1.00 0.00 H
+ATOM 2365 3HD2 LEU H 165 -15.107 -14.063 -49.567 1.00 0.00 H
+ATOM 2366 N THR H 166 -12.528 -16.846 -53.607 1.00100.13 N
+ATOM 2367 CA THR H 166 -13.218 -17.098 -54.865 1.00 99.97 C
+ATOM 2368 C THR H 166 -14.314 -18.144 -54.760 1.00107.20 C
+ATOM 2369 O THR H 166 -15.311 -18.047 -55.477 1.00113.89 O
+ATOM 2370 CB THR H 166 -12.223 -17.543 -55.948 1.00103.21 C
+ATOM 2371 OG1 THR H 166 -11.678 -18.826 -55.610 1.00101.10 O
+ATOM 2372 CG2 THR H 166 -11.092 -16.534 -56.087 1.00102.40 C
+ATOM 2373 H THR H 166 -11.976 -17.583 -53.193 1.00 0.00 H
+ATOM 2374 HA THR H 166 -13.694 -16.173 -55.190 1.00 0.00 H
+ATOM 2375 HB THR H 166 -12.740 -17.632 -56.903 1.00 0.00 H
+ATOM 2376 HG1 THR H 166 -12.056 -19.125 -54.779 1.00 0.00 H
+ATOM 2377 1HG2 THR H 166 -10.399 -16.868 -56.859 1.00 0.00 H
+ATOM 2378 2HG2 THR H 166 -11.503 -15.563 -56.363 1.00 0.00 H
+ATOM 2379 3HG2 THR H 166 -10.563 -16.448 -55.139 1.00 0.00 H
+ATOM 2380 N SER H 167 -14.156 -19.135 -53.889 1.00112.88 N
+ATOM 2381 CA SER H 167 -15.135 -20.208 -53.792 1.00111.49 C
+ATOM 2382 C SER H 167 -16.424 -19.701 -53.157 1.00 98.54 C
+ATOM 2383 O SER H 167 -16.401 -18.909 -52.212 1.00 94.04 O
+ATOM 2384 CB SER H 167 -14.565 -21.370 -52.980 1.00113.02 C
+ATOM 2385 OG SER H 167 -15.459 -22.467 -52.959 1.00120.22 O
+ATOM 2386 H SER H 167 -13.348 -19.150 -53.283 1.00 0.00 H
+ATOM 2387 HA SER H 167 -15.362 -20.561 -54.799 1.00 0.00 H
+ATOM 2388 1HB SER H 167 -13.614 -21.683 -53.411 1.00 0.00 H
+ATOM 2389 2HB SER H 167 -14.369 -21.040 -51.961 1.00 0.00 H
+ATOM 2390 HG SER H 167 -16.222 -22.197 -53.476 1.00 0.00 H
+ATOM 2391 N GLY H 168 -17.556 -20.158 -53.691 1.00 95.63 N
+ATOM 2392 CA GLY H 168 -18.851 -19.798 -53.150 1.00 87.98 C
+ATOM 2393 C GLY H 168 -19.290 -18.375 -53.402 1.00 92.10 C
+ATOM 2394 O GLY H 168 -20.310 -17.951 -52.850 1.00 98.38 O
+ATOM 2395 H GLY H 168 -17.511 -20.771 -54.493 1.00 0.00 H
+ATOM 2396 1HA GLY H 168 -19.615 -20.454 -53.568 1.00 0.00 H
+ATOM 2397 2HA GLY H 168 -18.850 -19.952 -52.072 1.00 0.00 H
+ATOM 2398 N VAL H 169 -18.560 -17.624 -54.216 1.00 86.79 N
+ATOM 2399 CA VAL H 169 -18.908 -16.244 -54.531 1.00 78.62 C
+ATOM 2400 C VAL H 169 -19.854 -16.225 -55.723 1.00 82.92 C
+ATOM 2401 O VAL H 169 -19.681 -16.981 -56.686 1.00 84.11 O
+ATOM 2402 CB VAL H 169 -17.643 -15.413 -54.815 1.00 76.77 C
+ATOM 2403 CG1 VAL H 169 -18.008 -13.958 -55.070 1.00 70.82 C
+ATOM 2404 CG2 VAL H 169 -16.652 -15.538 -53.669 1.00 82.96 C
+ATOM 2405 H VAL H 169 -17.733 -18.030 -54.630 1.00 0.00 H
+ATOM 2406 HA VAL H 169 -19.420 -15.811 -53.671 1.00 0.00 H
+ATOM 2407 HB VAL H 169 -17.178 -15.777 -55.731 1.00 0.00 H
+ATOM 2408 1HG1 VAL H 169 -17.102 -13.385 -55.269 1.00 0.00 H
+ATOM 2409 2HG1 VAL H 169 -18.673 -13.895 -55.931 1.00 0.00 H
+ATOM 2410 3HG1 VAL H 169 -18.509 -13.549 -54.193 1.00 0.00 H
+ATOM 2411 1HG2 VAL H 169 -15.765 -14.945 -53.889 1.00 0.00 H
+ATOM 2412 2HG2 VAL H 169 -17.112 -15.177 -52.749 1.00 0.00 H
+ATOM 2413 3HG2 VAL H 169 -16.368 -16.583 -53.546 1.00 0.00 H
+ATOM 2414 N HIS H 170 -20.865 -15.360 -55.654 1.00 81.56 N
+ATOM 2415 CA HIS H 170 -21.804 -15.132 -56.748 1.00 75.13 C
+ATOM 2416 C HIS H 170 -21.976 -13.629 -56.918 1.00 87.93 C
+ATOM 2417 O HIS H 170 -22.618 -12.980 -56.086 1.00 77.77 O
+ATOM 2418 CB HIS H 170 -23.156 -15.795 -56.477 1.00 77.20 C
+ATOM 2419 CG HIS H 170 -23.097 -17.287 -56.391 1.00 84.29 C
+ATOM 2420 ND1 HIS H 170 -22.047 -18.023 -56.895 1.00 98.05 N
+ATOM 2421 CD2 HIS H 170 -23.963 -18.182 -55.860 1.00 93.16 C
+ATOM 2422 CE1 HIS H 170 -22.268 -19.307 -56.678 1.00115.35 C
+ATOM 2423 NE2 HIS H 170 -23.425 -19.431 -56.051 1.00114.80 N
+ATOM 2424 H HIS H 170 -20.976 -14.842 -54.794 1.00 0.00 H
+ATOM 2425 HA HIS H 170 -21.404 -15.562 -57.666 1.00 0.00 H
+ATOM 2426 1HB HIS H 170 -23.565 -15.418 -55.539 1.00 0.00 H
+ATOM 2427 2HB HIS H 170 -23.856 -15.530 -57.269 1.00 0.00 H
+ATOM 2428 HD2 HIS H 170 -24.911 -17.954 -55.372 1.00 0.00 H
+ATOM 2429 HE1 HIS H 170 -21.608 -20.125 -56.967 1.00 0.00 H
+ATOM 2430 HE2 HIS H 170 -23.848 -20.300 -55.758 1.00 0.00 H
+ATOM 2431 N THR H 171 -21.403 -13.076 -57.983 1.00 96.92 N
+ATOM 2432 CA THR H 171 -21.642 -11.685 -58.348 1.00 89.25 C
+ATOM 2433 C THR H 171 -22.771 -11.652 -59.372 1.00 84.34 C
+ATOM 2434 O THR H 171 -22.666 -12.270 -60.437 1.00 87.09 O
+ATOM 2435 CB THR H 171 -20.381 -11.027 -58.909 1.00 76.05 C
+ATOM 2436 OG1 THR H 171 -19.281 -11.243 -58.014 1.00 75.93 O
+ATOM 2437 CG2 THR H 171 -20.596 -9.532 -59.067 1.00 68.59 C
+ATOM 2438 H THR H 171 -20.786 -13.635 -58.554 1.00 0.00 H
+ATOM 2439 HA THR H 171 -21.940 -11.139 -57.453 1.00 0.00 H
+ATOM 2440 HB THR H 171 -20.145 -11.462 -59.880 1.00 0.00 H
+ATOM 2441 HG1 THR H 171 -19.580 -11.754 -57.258 1.00 0.00 H
+ATOM 2442 1HG2 THR H 171 -19.691 -9.075 -59.468 1.00 0.00 H
+ATOM 2443 2HG2 THR H 171 -21.426 -9.354 -59.750 1.00 0.00 H
+ATOM 2444 3HG2 THR H 171 -20.825 -9.093 -58.097 1.00 0.00 H
+ATOM 2445 N PHE H 172 -23.861 -10.942 -59.041 1.00 76.86 N
+ATOM 2446 CA PHE H 172 -25.019 -10.977 -59.921 1.00 78.03 C
+ATOM 2447 C PHE H 172 -24.924 -9.896 -60.995 1.00 83.05 C
+ATOM 2448 O PHE H 172 -24.311 -8.846 -60.778 1.00 93.93 O
+ATOM 2449 CB PHE H 172 -26.305 -10.789 -59.118 1.00 78.56 C
+ATOM 2450 CG PHE H 172 -26.658 -11.970 -58.256 1.00 85.24 C
+ATOM 2451 CD1 PHE H 172 -26.069 -12.141 -57.013 1.00 82.73 C
+ATOM 2452 CD2 PHE H 172 -27.580 -12.909 -58.689 1.00 84.79 C
+ATOM 2453 CE1 PHE H 172 -26.389 -13.227 -56.220 1.00 80.44 C
+ATOM 2454 CE2 PHE H 172 -27.906 -13.997 -57.898 1.00 84.45 C
+ATOM 2455 CZ PHE H 172 -27.308 -14.156 -56.663 1.00 85.20 C
+ATOM 2456 H PHE H 172 -23.899 -10.385 -58.199 1.00 0.00 H
+ATOM 2457 HA PHE H 172 -25.052 -11.951 -60.411 1.00 0.00 H
+ATOM 2458 1HB PHE H 172 -26.208 -9.915 -58.475 1.00 0.00 H
+ATOM 2459 2HB PHE H 172 -27.135 -10.604 -59.799 1.00 0.00 H
+ATOM 2460 HD1 PHE H 172 -25.345 -11.406 -56.661 1.00 0.00 H
+ATOM 2461 HD2 PHE H 172 -28.052 -12.784 -59.664 1.00 0.00 H
+ATOM 2462 HE1 PHE H 172 -25.915 -13.348 -55.246 1.00 0.00 H
+ATOM 2463 HE2 PHE H 172 -28.633 -14.729 -58.249 1.00 0.00 H
+ATOM 2464 HZ PHE H 172 -27.560 -15.014 -56.041 1.00 0.00 H
+ATOM 2465 N PRO H 173 -25.509 -10.137 -62.167 1.00 80.74 N
+ATOM 2466 CA PRO H 173 -25.559 -9.085 -63.186 1.00 84.48 C
+ATOM 2467 C PRO H 173 -26.392 -7.909 -62.705 1.00 87.68 C
+ATOM 2468 O PRO H 173 -27.396 -8.078 -62.011 1.00 99.49 O
+ATOM 2469 CB PRO H 173 -26.207 -9.785 -64.385 1.00 97.72 C
+ATOM 2470 CG PRO H 173 -26.972 -10.921 -63.787 1.00 87.32 C
+ATOM 2471 CD PRO H 173 -26.144 -11.382 -62.630 1.00 84.56 C
+ATOM 2472 HA PRO H 173 -24.534 -8.765 -63.427 1.00 0.00 H
+ATOM 2473 1HB PRO H 173 -26.852 -9.079 -64.929 1.00 0.00 H
+ATOM 2474 2HB PRO H 173 -25.431 -10.120 -65.089 1.00 0.00 H
+ATOM 2475 1HG PRO H 173 -27.972 -10.584 -63.477 1.00 0.00 H
+ATOM 2476 2HG PRO H 173 -27.122 -11.713 -64.535 1.00 0.00 H
+ATOM 2477 1HD PRO H 173 -26.798 -11.818 -61.861 1.00 0.00 H
+ATOM 2478 2HD PRO H 173 -25.407 -12.121 -62.977 1.00 0.00 H
+ATOM 2479 N ALA H 174 -25.961 -6.708 -63.078 1.00 81.24 N
+ATOM 2480 CA ALA H 174 -26.641 -5.509 -62.623 1.00 79.78 C
+ATOM 2481 C ALA H 174 -28.042 -5.424 -63.220 1.00 84.56 C
+ATOM 2482 O ALA H 174 -28.354 -6.044 -64.241 1.00 90.67 O
+ATOM 2483 CB ALA H 174 -25.834 -4.263 -62.986 1.00 73.65 C
+ATOM 2484 H ALA H 174 -25.156 -6.618 -63.682 1.00 0.00 H
+ATOM 2485 HA ALA H 174 -26.734 -5.563 -61.538 1.00 0.00 H
+ATOM 2486 1HB ALA H 174 -26.360 -3.374 -62.637 1.00 0.00 H
+ATOM 2487 2HB ALA H 174 -24.853 -4.314 -62.513 1.00 0.00 H
+ATOM 2488 3HB ALA H 174 -25.712 -4.211 -64.067 1.00 0.00 H
+ATOM 2489 N VAL H 175 -28.896 -4.648 -62.558 1.00 82.39 N
+ATOM 2490 CA VAL H 175 -30.259 -4.398 -63.007 1.00 83.30 C
+ATOM 2491 C VAL H 175 -30.445 -2.893 -63.136 1.00 80.77 C
+ATOM 2492 O VAL H 175 -30.053 -2.134 -62.242 1.00 93.22 O
+ATOM 2493 CB VAL H 175 -31.300 -5.013 -62.050 1.00 98.68 C
+ATOM 2494 CG1 VAL H 175 -30.999 -4.645 -60.605 1.00108.43 C
+ATOM 2495 CG2 VAL H 175 -32.706 -4.576 -62.434 1.00116.50 C
+ATOM 2496 H VAL H 175 -28.572 -4.217 -61.704 1.00 0.00 H
+ATOM 2497 HA VAL H 175 -30.390 -4.857 -63.987 1.00 0.00 H
+ATOM 2498 HB VAL H 175 -31.235 -6.100 -62.107 1.00 0.00 H
+ATOM 2499 1HG1 VAL H 175 -31.749 -5.092 -59.952 1.00 0.00 H
+ATOM 2500 2HG1 VAL H 175 -30.012 -5.018 -60.333 1.00 0.00 H
+ATOM 2501 3HG1 VAL H 175 -31.022 -3.561 -60.493 1.00 0.00 H
+ATOM 2502 1HG2 VAL H 175 -33.425 -5.021 -61.747 1.00 0.00 H
+ATOM 2503 2HG2 VAL H 175 -32.777 -3.489 -62.380 1.00 0.00 H
+ATOM 2504 3HG2 VAL H 175 -32.924 -4.904 -63.451 1.00 0.00 H
+ATOM 2505 N LEU H 176 -31.021 -2.463 -64.255 1.00 84.27 N
+ATOM 2506 CA LEU H 176 -31.245 -1.046 -64.507 1.00 94.67 C
+ATOM 2507 C LEU H 176 -32.462 -0.579 -63.717 1.00100.55 C
+ATOM 2508 O LEU H 176 -33.578 -1.061 -63.943 1.00 98.31 O
+ATOM 2509 CB LEU H 176 -31.435 -0.796 -66.002 1.00 88.20 C
+ATOM 2510 CG LEU H 176 -31.550 0.662 -66.453 1.00 95.18 C
+ATOM 2511 CD1 LEU H 176 -30.344 1.474 -66.003 1.00 95.47 C
+ATOM 2512 CD2 LEU H 176 -31.708 0.731 -67.958 1.00101.35 C
+ATOM 2513 H LEU H 176 -31.311 -3.138 -64.948 1.00 0.00 H
+ATOM 2514 HA LEU H 176 -30.370 -0.492 -64.169 1.00 0.00 H
+ATOM 2515 1HB LEU H 176 -30.591 -1.230 -66.537 1.00 0.00 H
+ATOM 2516 2HB LEU H 176 -32.344 -1.303 -66.327 1.00 0.00 H
+ATOM 2517 HG LEU H 176 -32.419 1.122 -65.981 1.00 0.00 H
+ATOM 2518 1HD1 LEU H 176 -30.454 2.506 -66.338 1.00 0.00 H
+ATOM 2519 2HD1 LEU H 176 -30.276 1.452 -64.915 1.00 0.00 H
+ATOM 2520 3HD1 LEU H 176 -29.438 1.048 -66.433 1.00 0.00 H
+ATOM 2521 1HD2 LEU H 176 -31.790 1.773 -68.268 1.00 0.00 H
+ATOM 2522 2HD2 LEU H 176 -30.840 0.277 -68.436 1.00 0.00 H
+ATOM 2523 3HD2 LEU H 176 -32.608 0.193 -68.254 1.00 0.00 H
+ATOM 2524 N GLN H 177 -32.246 0.354 -62.792 1.00 99.72 N
+ATOM 2525 CA GLN H 177 -33.313 0.847 -61.937 1.00 90.94 C
+ATOM 2526 C GLN H 177 -34.170 1.868 -62.681 1.00 93.50 C
+ATOM 2527 O GLN H 177 -33.806 2.374 -63.745 1.00 96.80 O
+ATOM 2528 CB GLN H 177 -32.743 1.474 -60.666 1.00 88.57 C
+ATOM 2529 CG GLN H 177 -32.043 0.500 -59.735 1.00 87.07 C
+ATOM 2530 CD GLN H 177 -31.624 1.149 -58.427 1.00 91.45 C
+ATOM 2531 OE1 GLN H 177 -31.057 0.498 -57.549 1.00 90.61 O
+ATOM 2532 NE2 GLN H 177 -31.912 2.439 -58.288 1.00 92.30 N
+ATOM 2533 H GLN H 177 -31.315 0.729 -62.682 1.00 0.00 H
+ATOM 2534 HA GLN H 177 -33.946 0.006 -61.654 1.00 0.00 H
+ATOM 2535 1HB GLN H 177 -32.026 2.250 -60.933 1.00 0.00 H
+ATOM 2536 2HB GLN H 177 -33.546 1.950 -60.104 1.00 0.00 H
+ATOM 2537 1HG GLN H 177 -32.723 -0.321 -59.507 1.00 0.00 H
+ATOM 2538 2HG GLN H 177 -31.150 0.119 -60.230 1.00 0.00 H
+ATOM 2539 1HE2 GLN H 177 -31.660 2.921 -57.447 1.00 0.00 H
+ATOM 2540 2HE2 GLN H 177 -32.380 2.929 -59.023 1.00 0.00 H
+ATOM 2541 N SER H 178 -35.323 2.185 -62.089 1.00 96.96 N
+ATOM 2542 CA SER H 178 -36.245 3.146 -62.681 1.00101.33 C
+ATOM 2543 C SER H 178 -35.676 4.558 -62.738 1.00104.22 C
+ATOM 2544 O SER H 178 -36.319 5.442 -63.313 1.00114.73 O
+ATOM 2545 CB SER H 178 -37.562 3.152 -61.902 1.00108.73 C
+ATOM 2546 OG SER H 178 -38.133 1.856 -61.859 1.00113.72 O
+ATOM 2547 H SER H 178 -35.564 1.750 -61.210 1.00 0.00 H
+ATOM 2548 HA SER H 178 -36.444 2.846 -63.711 1.00 0.00 H
+ATOM 2549 1HB SER H 178 -37.383 3.507 -60.887 1.00 0.00 H
+ATOM 2550 2HB SER H 178 -38.259 3.844 -62.372 1.00 0.00 H
+ATOM 2551 HG SER H 178 -37.532 1.286 -62.344 1.00 0.00 H
+ATOM 2552 N SER H 179 -34.499 4.792 -62.160 1.00 95.16 N
+ATOM 2553 CA SER H 179 -33.855 6.097 -62.196 1.00100.25 C
+ATOM 2554 C SER H 179 -32.778 6.204 -63.267 1.00107.77 C
+ATOM 2555 O SER H 179 -32.305 7.312 -63.538 1.00112.06 O
+ATOM 2556 CB SER H 179 -33.241 6.418 -60.828 1.00 97.06 C
+ATOM 2557 OG SER H 179 -32.307 5.423 -60.441 1.00 88.56 O
+ATOM 2558 H SER H 179 -34.041 4.030 -61.680 1.00 0.00 H
+ATOM 2559 HA SER H 179 -34.610 6.849 -62.429 1.00 0.00 H
+ATOM 2560 1HB SER H 179 -32.746 7.388 -60.870 1.00 0.00 H
+ATOM 2561 2HB SER H 179 -34.031 6.487 -60.082 1.00 0.00 H
+ATOM 2562 HG SER H 179 -32.294 4.780 -61.154 1.00 0.00 H
+ATOM 2563 N GLY H 180 -32.388 5.092 -63.881 1.00108.86 N
+ATOM 2564 CA GLY H 180 -31.309 5.097 -64.843 1.00114.12 C
+ATOM 2565 C GLY H 180 -29.952 4.757 -64.275 1.00112.51 C
+ATOM 2566 O GLY H 180 -28.946 4.931 -64.973 1.00117.97 O
+ATOM 2567 H GLY H 180 -32.856 4.222 -63.671 1.00 0.00 H
+ATOM 2568 1HA GLY H 180 -31.526 4.383 -65.637 1.00 0.00 H
+ATOM 2569 2HA GLY H 180 -31.239 6.081 -65.306 1.00 0.00 H
+ATOM 2570 N LEU H 181 -29.890 4.278 -63.035 1.00104.70 N
+ATOM 2571 CA LEU H 181 -28.641 3.934 -62.373 1.00 90.43 C
+ATOM 2572 C LEU H 181 -28.627 2.442 -62.083 1.00 94.66 C
+ATOM 2573 O LEU H 181 -29.576 1.912 -61.495 1.00 98.53 O
+ATOM 2574 CB LEU H 181 -28.474 4.726 -61.076 1.00 84.08 C
+ATOM 2575 CG LEU H 181 -28.559 6.248 -61.191 1.00 84.81 C
+ATOM 2576 CD1 LEU H 181 -28.418 6.890 -59.822 1.00 79.68 C
+ATOM 2577 CD2 LEU H 181 -27.505 6.779 -62.150 1.00 87.93 C
+ATOM 2578 H LEU H 181 -30.761 4.151 -62.539 1.00 0.00 H
+ATOM 2579 HA LEU H 181 -27.816 4.186 -63.039 1.00 0.00 H
+ATOM 2580 1HB LEU H 181 -29.245 4.411 -60.375 1.00 0.00 H
+ATOM 2581 2HB LEU H 181 -27.501 4.487 -60.646 1.00 0.00 H
+ATOM 2582 HG LEU H 181 -29.545 6.530 -61.562 1.00 0.00 H
+ATOM 2583 1HD1 LEU H 181 -28.481 7.974 -59.920 1.00 0.00 H
+ATOM 2584 2HD1 LEU H 181 -29.219 6.539 -59.171 1.00 0.00 H
+ATOM 2585 3HD1 LEU H 181 -27.454 6.620 -59.391 1.00 0.00 H
+ATOM 2586 1HD2 LEU H 181 -27.586 7.864 -62.216 1.00 0.00 H
+ATOM 2587 2HD2 LEU H 181 -26.513 6.511 -61.786 1.00 0.00 H
+ATOM 2588 3HD2 LEU H 181 -27.659 6.343 -63.137 1.00 0.00 H
+ATOM 2589 N TYR H 182 -27.554 1.770 -62.491 1.00 97.90 N
+ATOM 2590 CA TYR H 182 -27.442 0.336 -62.282 1.00 95.65 C
+ATOM 2591 C TYR H 182 -27.244 0.026 -60.798 1.00 95.00 C
+ATOM 2592 O TYR H 182 -26.962 0.906 -59.977 1.00 89.75 O
+ATOM 2593 CB TYR H 182 -26.292 -0.238 -63.112 1.00 94.85 C
+ATOM 2594 CG TYR H 182 -26.473 -0.092 -64.612 1.00 91.71 C
+ATOM 2595 CD1 TYR H 182 -25.913 0.979 -65.298 1.00 88.49 C
+ATOM 2596 CD2 TYR H 182 -27.192 -1.028 -65.341 1.00 82.58 C
+ATOM 2597 CE1 TYR H 182 -26.070 1.119 -66.662 1.00 81.54 C
+ATOM 2598 CE2 TYR H 182 -27.354 -0.896 -66.709 1.00101.61 C
+ATOM 2599 CZ TYR H 182 -26.790 0.181 -67.365 1.00 99.53 C
+ATOM 2600 OH TYR H 182 -26.946 0.319 -68.729 1.00103.67 O
+ATOM 2601 H TYR H 182 -26.802 2.260 -62.954 1.00 0.00 H
+ATOM 2602 HA TYR H 182 -28.372 -0.134 -62.603 1.00 0.00 H
+ATOM 2603 1HB TYR H 182 -25.360 0.258 -62.836 1.00 0.00 H
+ATOM 2604 2HB TYR H 182 -26.177 -1.298 -62.889 1.00 0.00 H
+ATOM 2605 HD1 TYR H 182 -25.336 1.730 -64.758 1.00 0.00 H
+ATOM 2606 HD2 TYR H 182 -27.641 -1.884 -64.837 1.00 0.00 H
+ATOM 2607 HE1 TYR H 182 -25.621 1.968 -67.178 1.00 0.00 H
+ATOM 2608 HE2 TYR H 182 -27.926 -1.640 -67.265 1.00 0.00 H
+ATOM 2609 HH TYR H 182 -27.469 -0.413 -69.066 1.00 0.00 H
+ATOM 2610 N SER H 183 -27.400 -1.256 -60.461 1.00 98.27 N
+ATOM 2611 CA SER H 183 -27.285 -1.732 -59.086 1.00 93.33 C
+ATOM 2612 C SER H 183 -27.202 -3.252 -59.042 1.00 92.73 C
+ATOM 2613 O SER H 183 -28.165 -3.936 -59.401 1.00 92.91 O
+ATOM 2614 CB SER H 183 -28.473 -1.253 -58.250 1.00 94.14 C
+ATOM 2615 OG SER H 183 -28.604 -2.018 -57.065 1.00 97.65 O
+ATOM 2616 H SER H 183 -27.606 -1.918 -61.195 1.00 0.00 H
+ATOM 2617 HA SER H 183 -26.369 -1.325 -58.654 1.00 0.00 H
+ATOM 2618 1HB SER H 183 -28.338 -0.203 -57.994 1.00 0.00 H
+ATOM 2619 2HB SER H 183 -29.386 -1.331 -58.838 1.00 0.00 H
+ATOM 2620 HG SER H 183 -27.893 -2.663 -57.086 1.00 0.00 H
+ATOM 2621 N LEU H 184 -26.070 -3.794 -58.602 1.00 88.24 N
+ATOM 2622 CA LEU H 184 -25.905 -5.236 -58.493 1.00 90.01 C
+ATOM 2623 C LEU H 184 -25.589 -5.625 -57.056 1.00 85.59 C
+ATOM 2624 O LEU H 184 -25.381 -4.780 -56.184 1.00 88.46 O
+ATOM 2625 CB LEU H 184 -24.811 -5.755 -59.440 1.00 89.72 C
+ATOM 2626 CG LEU H 184 -23.359 -5.264 -59.402 1.00 78.74 C
+ATOM 2627 CD1 LEU H 184 -22.558 -5.828 -58.237 1.00 67.31 C
+ATOM 2628 CD2 LEU H 184 -22.691 -5.635 -60.712 1.00 90.34 C
+ATOM 2629 H LEU H 184 -25.305 -3.190 -58.337 1.00 0.00 H
+ATOM 2630 HA LEU H 184 -26.845 -5.713 -58.769 1.00 0.00 H
+ATOM 2631 1HB LEU H 184 -24.720 -6.832 -59.308 1.00 0.00 H
+ATOM 2632 2HB LEU H 184 -25.119 -5.561 -60.467 1.00 0.00 H
+ATOM 2633 HG LEU H 184 -23.344 -4.182 -59.270 1.00 0.00 H
+ATOM 2634 1HD1 LEU H 184 -21.541 -5.438 -58.272 1.00 0.00 H
+ATOM 2635 2HD1 LEU H 184 -23.026 -5.534 -57.297 1.00 0.00 H
+ATOM 2636 3HD1 LEU H 184 -22.533 -6.915 -58.306 1.00 0.00 H
+ATOM 2637 1HD2 LEU H 184 -21.656 -5.292 -60.703 1.00 0.00 H
+ATOM 2638 2HD2 LEU H 184 -22.713 -6.718 -60.838 1.00 0.00 H
+ATOM 2639 3HD2 LEU H 184 -23.222 -5.162 -61.538 1.00 0.00 H
+ATOM 2640 N SER H 185 -25.547 -6.933 -56.826 1.00 88.06 N
+ATOM 2641 CA SER H 185 -25.257 -7.494 -55.516 1.00 81.15 C
+ATOM 2642 C SER H 185 -24.295 -8.655 -55.701 1.00 83.90 C
+ATOM 2643 O SER H 185 -24.483 -9.476 -56.604 1.00 87.02 O
+ATOM 2644 CB SER H 185 -26.538 -7.968 -54.821 1.00 87.74 C
+ATOM 2645 OG SER H 185 -27.615 -7.082 -55.082 1.00 94.47 O
+ATOM 2646 H SER H 185 -25.725 -7.557 -57.600 1.00 0.00 H
+ATOM 2647 HA SER H 185 -24.800 -6.718 -54.900 1.00 0.00 H
+ATOM 2648 1HB SER H 185 -26.793 -8.968 -55.171 1.00 0.00 H
+ATOM 2649 2HB SER H 185 -26.367 -8.031 -53.747 1.00 0.00 H
+ATOM 2650 HG SER H 185 -27.258 -6.390 -55.644 1.00 0.00 H
+ATOM 2651 N SER H 186 -23.266 -8.718 -54.860 1.00 78.77 N
+ATOM 2652 CA SER H 186 -22.276 -9.788 -54.909 1.00 77.30 C
+ATOM 2653 C SER H 186 -22.207 -10.445 -53.541 1.00 73.74 C
+ATOM 2654 O SER H 186 -21.837 -9.796 -52.560 1.00 72.96 O
+ATOM 2655 CB SER H 186 -20.901 -9.257 -55.317 1.00 72.70 C
+ATOM 2656 OG SER H 186 -19.951 -10.306 -55.380 1.00 75.90 O
+ATOM 2657 H SER H 186 -23.173 -7.993 -54.163 1.00 0.00 H
+ATOM 2658 HA SER H 186 -22.594 -10.520 -55.653 1.00 0.00 H
+ATOM 2659 1HB SER H 186 -20.973 -8.769 -56.288 1.00 0.00 H
+ATOM 2660 2HB SER H 186 -20.573 -8.508 -54.598 1.00 0.00 H
+ATOM 2661 HG SER H 186 -20.425 -11.107 -55.144 1.00 0.00 H
+ATOM 2662 N VAL H 187 -22.543 -11.729 -53.477 1.00 78.35 N
+ATOM 2663 CA VAL H 187 -22.664 -12.432 -52.210 1.00 78.24 C
+ATOM 2664 C VAL H 187 -21.675 -13.592 -52.173 1.00 85.00 C
+ATOM 2665 O VAL H 187 -21.029 -13.926 -53.164 1.00 93.98 O
+ATOM 2666 CB VAL H 187 -24.095 -12.932 -51.966 1.00 67.34 C
+ATOM 2667 CG1 VAL H 187 -25.051 -11.748 -51.891 1.00 66.62 C
+ATOM 2668 CG2 VAL H 187 -24.495 -13.900 -53.067 1.00 70.44 C
+ATOM 2669 H VAL H 187 -22.719 -12.230 -54.336 1.00 0.00 H
+ATOM 2670 HA VAL H 187 -22.408 -11.742 -51.405 1.00 0.00 H
+ATOM 2671 HB VAL H 187 -24.133 -13.439 -51.002 1.00 0.00 H
+ATOM 2672 1HG1 VAL H 187 -26.065 -12.109 -51.717 1.00 0.00 H
+ATOM 2673 2HG1 VAL H 187 -24.755 -11.093 -51.072 1.00 0.00 H
+ATOM 2674 3HG1 VAL H 187 -25.020 -11.195 -52.830 1.00 0.00 H
+ATOM 2675 1HG2 VAL H 187 -25.511 -14.253 -52.890 1.00 0.00 H
+ATOM 2676 2HG2 VAL H 187 -24.450 -13.393 -54.031 1.00 0.00 H
+ATOM 2677 3HG2 VAL H 187 -23.812 -14.749 -53.071 1.00 0.00 H
+ATOM 2678 N VAL H 188 -21.571 -14.204 -50.997 1.00 87.63 N
+ATOM 2679 CA VAL H 188 -20.656 -15.315 -50.766 1.00 87.35 C
+ATOM 2680 C VAL H 188 -21.134 -16.057 -49.526 1.00 78.95 C
+ATOM 2681 O VAL H 188 -21.644 -15.449 -48.579 1.00 84.96 O
+ATOM 2682 CB VAL H 188 -19.196 -14.819 -50.620 1.00 82.09 C
+ATOM 2683 CG1 VAL H 188 -19.084 -13.788 -49.505 1.00 76.42 C
+ATOM 2684 CG2 VAL H 188 -18.245 -15.985 -50.377 1.00 75.59 C
+ATOM 2685 H VAL H 188 -22.153 -13.880 -50.238 1.00 0.00 H
+ATOM 2686 HA VAL H 188 -20.705 -15.987 -51.623 1.00 0.00 H
+ATOM 2687 HB VAL H 188 -18.902 -14.307 -51.537 1.00 0.00 H
+ATOM 2688 1HG1 VAL H 188 -18.050 -13.454 -49.421 1.00 0.00 H
+ATOM 2689 2HG1 VAL H 188 -19.723 -12.935 -49.733 1.00 0.00 H
+ATOM 2690 3HG1 VAL H 188 -19.397 -14.236 -48.562 1.00 0.00 H
+ATOM 2691 1HG2 VAL H 188 -17.227 -15.610 -50.279 1.00 0.00 H
+ATOM 2692 2HG2 VAL H 188 -18.531 -16.503 -49.461 1.00 0.00 H
+ATOM 2693 3HG2 VAL H 188 -18.297 -16.678 -51.217 1.00 0.00 H
+ATOM 2694 N THR H 189 -20.988 -17.378 -49.548 1.00 72.02 N
+ATOM 2695 CA THR H 189 -21.289 -18.218 -48.398 1.00 89.55 C
+ATOM 2696 C THR H 189 -19.984 -18.637 -47.737 1.00100.35 C
+ATOM 2697 O THR H 189 -19.048 -19.070 -48.419 1.00 99.62 O
+ATOM 2698 CB THR H 189 -22.094 -19.453 -48.805 1.00 95.99 C
+ATOM 2699 OG1 THR H 189 -21.296 -20.291 -49.647 1.00 95.42 O
+ATOM 2700 CG2 THR H 189 -23.354 -19.042 -49.554 1.00 97.59 C
+ATOM 2701 H THR H 189 -20.655 -17.809 -50.398 1.00 0.00 H
+ATOM 2702 HA THR H 189 -21.887 -17.639 -47.694 1.00 0.00 H
+ATOM 2703 HB THR H 189 -22.373 -20.015 -47.914 1.00 0.00 H
+ATOM 2704 HG1 THR H 189 -20.432 -19.891 -49.769 1.00 0.00 H
+ATOM 2705 1HG2 THR H 189 -23.916 -19.932 -49.836 1.00 0.00 H
+ATOM 2706 2HG2 THR H 189 -23.970 -18.412 -48.912 1.00 0.00 H
+ATOM 2707 3HG2 THR H 189 -23.080 -18.487 -50.450 1.00 0.00 H
+ATOM 2708 N VAL H 190 -19.929 -18.508 -46.414 1.00 96.52 N
+ATOM 2709 CA VAL H 190 -18.728 -18.824 -45.641 1.00 86.14 C
+ATOM 2710 C VAL H 190 -19.144 -19.672 -44.442 1.00 99.37 C
+ATOM 2711 O VAL H 190 -20.305 -19.604 -44.010 1.00110.05 O
+ATOM 2712 CB VAL H 190 -17.992 -17.547 -45.192 1.00 79.95 C
+ATOM 2713 CG1 VAL H 190 -17.471 -16.792 -46.404 1.00 77.60 C
+ATOM 2714 CG2 VAL H 190 -18.922 -16.655 -44.371 1.00 70.02 C
+ATOM 2715 H VAL H 190 -20.752 -18.178 -45.931 1.00 0.00 H
+ATOM 2716 HA VAL H 190 -18.052 -19.401 -46.273 1.00 0.00 H
+ATOM 2717 HB VAL H 190 -17.134 -17.829 -44.582 1.00 0.00 H
+ATOM 2718 1HG1 VAL H 190 -16.952 -15.891 -46.076 1.00 0.00 H
+ATOM 2719 2HG1 VAL H 190 -16.780 -17.427 -46.959 1.00 0.00 H
+ATOM 2720 3HG1 VAL H 190 -18.306 -16.515 -47.047 1.00 0.00 H
+ATOM 2721 1HG2 VAL H 190 -18.386 -15.758 -44.061 1.00 0.00 H
+ATOM 2722 2HG2 VAL H 190 -19.784 -16.373 -44.976 1.00 0.00 H
+ATOM 2723 3HG2 VAL H 190 -19.261 -17.198 -43.488 1.00 0.00 H
+ATOM 2724 N PRO H 191 -18.256 -20.500 -43.887 1.00106.36 N
+ATOM 2725 CA PRO H 191 -18.620 -21.250 -42.676 1.00106.40 C
+ATOM 2726 C PRO H 191 -18.880 -20.308 -41.511 1.00110.97 C
+ATOM 2727 O PRO H 191 -18.070 -19.431 -41.207 1.00113.53 O
+ATOM 2728 CB PRO H 191 -17.396 -22.145 -42.424 1.00 98.36 C
+ATOM 2729 CG PRO H 191 -16.277 -21.469 -43.135 1.00 95.30 C
+ATOM 2730 CD PRO H 191 -16.905 -20.853 -44.353 1.00102.63 C
+ATOM 2731 HA PRO H 191 -19.512 -21.860 -42.883 1.00 0.00 H
+ATOM 2732 1HB PRO H 191 -17.214 -22.238 -41.343 1.00 0.00 H
+ATOM 2733 2HB PRO H 191 -17.586 -23.159 -42.806 1.00 0.00 H
+ATOM 2734 1HG PRO H 191 -15.810 -20.718 -42.481 1.00 0.00 H
+ATOM 2735 2HG PRO H 191 -15.494 -22.198 -43.392 1.00 0.00 H
+ATOM 2736 1HD PRO H 191 -16.332 -19.963 -44.651 1.00 0.00 H
+ATOM 2737 2HD PRO H 191 -16.927 -21.591 -45.168 1.00 0.00 H
+ATOM 2738 N SER H 192 -20.024 -20.502 -40.850 1.00109.68 N
+ATOM 2739 CA SER H 192 -20.427 -19.594 -39.781 1.00104.01 C
+ATOM 2740 C SER H 192 -19.481 -19.640 -38.589 1.00 99.03 C
+ATOM 2741 O SER H 192 -19.523 -18.735 -37.750 1.00 99.16 O
+ATOM 2742 CB SER H 192 -21.854 -19.909 -39.329 1.00107.37 C
+ATOM 2743 OG SER H 192 -21.999 -21.279 -39.004 1.00117.88 O
+ATOM 2744 H SER H 192 -20.622 -21.281 -41.085 1.00 0.00 H
+ATOM 2745 HA SER H 192 -20.398 -18.573 -40.165 1.00 0.00 H
+ATOM 2746 1HB SER H 192 -22.103 -19.300 -38.460 1.00 0.00 H
+ATOM 2747 2HB SER H 192 -22.553 -19.647 -40.122 1.00 0.00 H
+ATOM 2748 HG SER H 192 -21.139 -21.679 -39.153 1.00 0.00 H
+ATOM 2749 N SER H 193 -18.628 -20.659 -38.498 1.00100.46 N
+ATOM 2750 CA SER H 193 -17.653 -20.756 -37.419 1.00111.10 C
+ATOM 2751 C SER H 193 -16.411 -19.907 -37.663 1.00114.22 C
+ATOM 2752 O SER H 193 -15.473 -19.972 -36.862 1.00121.10 O
+ATOM 2753 CB SER H 193 -17.245 -22.217 -37.211 1.00117.55 C
+ATOM 2754 OG SER H 193 -16.608 -22.736 -38.363 1.00119.10 O
+ATOM 2755 H SER H 193 -18.660 -21.385 -39.199 1.00 0.00 H
+ATOM 2756 HA SER H 193 -18.113 -20.384 -36.502 1.00 0.00 H
+ATOM 2757 1HB SER H 193 -16.572 -22.289 -36.357 1.00 0.00 H
+ATOM 2758 2HB SER H 193 -18.128 -22.812 -36.982 1.00 0.00 H
+ATOM 2759 HG SER H 193 -16.592 -22.020 -39.002 1.00 0.00 H
+ATOM 2760 N SER H 194 -16.378 -19.122 -38.741 1.00109.89 N
+ATOM 2761 CA SER H 194 -15.245 -18.258 -39.040 1.00106.62 C
+ATOM 2762 C SER H 194 -15.601 -16.779 -39.032 1.00101.14 C
+ATOM 2763 O SER H 194 -14.726 -15.945 -39.293 1.00 94.96 O
+ATOM 2764 CB SER H 194 -14.643 -18.619 -40.404 1.00108.67 C
+ATOM 2765 OG SER H 194 -15.545 -18.302 -41.449 1.00109.10 O
+ATOM 2766 H SER H 194 -17.169 -19.131 -39.369 1.00 0.00 H
+ATOM 2767 HA SER H 194 -14.485 -18.406 -38.272 1.00 0.00 H
+ATOM 2768 1HB SER H 194 -13.709 -18.075 -40.545 1.00 0.00 H
+ATOM 2769 2HB SER H 194 -14.409 -19.683 -40.428 1.00 0.00 H
+ATOM 2770 HG SER H 194 -16.323 -17.933 -41.024 1.00 0.00 H
+ATOM 2771 N LEU H 195 -16.856 -16.429 -38.741 1.00100.56 N
+ATOM 2772 CA LEU H 195 -17.281 -15.035 -38.751 1.00 97.24 C
+ATOM 2773 C LEU H 195 -16.595 -14.197 -37.681 1.00107.51 C
+ATOM 2774 O LEU H 195 -16.687 -12.965 -37.733 1.00117.96 O
+ATOM 2775 CB LEU H 195 -18.798 -14.957 -38.571 1.00 96.61 C
+ATOM 2776 CG LEU H 195 -19.658 -15.453 -39.732 1.00103.56 C
+ATOM 2777 CD1 LEU H 195 -21.118 -15.504 -39.317 1.00105.08 C
+ATOM 2778 CD2 LEU H 195 -19.474 -14.556 -40.948 1.00105.66 C
+ATOM 2779 H LEU H 195 -17.528 -17.146 -38.508 1.00 0.00 H
+ATOM 2780 HA LEU H 195 -17.015 -14.599 -39.713 1.00 0.00 H
+ATOM 2781 1HB LEU H 195 -19.074 -15.542 -37.696 1.00 0.00 H
+ATOM 2782 2HB LEU H 195 -19.074 -13.918 -38.390 1.00 0.00 H
+ATOM 2783 HG LEU H 195 -19.365 -16.470 -39.993 1.00 0.00 H
+ATOM 2784 1HD1 LEU H 195 -21.722 -15.859 -40.152 1.00 0.00 H
+ATOM 2785 2HD1 LEU H 195 -21.233 -16.184 -38.473 1.00 0.00 H
+ATOM 2786 3HD1 LEU H 195 -21.449 -14.507 -39.029 1.00 0.00 H
+ATOM 2787 1HD2 LEU H 195 -20.093 -14.923 -41.768 1.00 0.00 H
+ATOM 2788 2HD2 LEU H 195 -19.771 -13.537 -40.697 1.00 0.00 H
+ATOM 2789 3HD2 LEU H 195 -18.427 -14.565 -41.252 1.00 0.00 H
+ATOM 2790 N GLY H 196 -15.919 -14.822 -36.721 1.00107.75 N
+ATOM 2791 CA GLY H 196 -15.248 -14.085 -35.669 1.00105.99 C
+ATOM 2792 C GLY H 196 -13.738 -14.124 -35.777 1.00109.12 C
+ATOM 2793 O GLY H 196 -13.039 -13.393 -35.070 1.00116.00 O
+ATOM 2794 H GLY H 196 -15.871 -15.831 -36.723 1.00 0.00 H
+ATOM 2795 1HA GLY H 196 -15.571 -13.044 -35.691 1.00 0.00 H
+ATOM 2796 2HA GLY H 196 -15.537 -14.490 -34.700 1.00 0.00 H
+ATOM 2797 N THR H 197 -13.221 -14.977 -36.659 1.00107.76 N
+ATOM 2798 CA THR H 197 -11.787 -15.107 -36.864 1.00101.34 C
+ATOM 2799 C THR H 197 -11.349 -14.771 -38.283 1.00 90.97 C
+ATOM 2800 O THR H 197 -10.147 -14.817 -38.569 1.00 89.33 O
+ATOM 2801 CB THR H 197 -11.322 -16.529 -36.513 1.00 98.37 C
+ATOM 2802 OG1 THR H 197 -11.987 -17.474 -37.360 1.00 97.65 O
+ATOM 2803 CG2 THR H 197 -11.629 -16.850 -35.058 1.00 92.23 C
+ATOM 2804 H THR H 197 -13.850 -15.551 -37.202 1.00 0.00 H
+ATOM 2805 HA THR H 197 -11.278 -14.401 -36.207 1.00 0.00 H
+ATOM 2806 HB THR H 197 -10.248 -16.611 -36.677 1.00 0.00 H
+ATOM 2807 HG1 THR H 197 -12.575 -17.008 -37.959 1.00 0.00 H
+ATOM 2808 1HG2 THR H 197 -11.292 -17.861 -34.829 1.00 0.00 H
+ATOM 2809 2HG2 THR H 197 -11.113 -16.140 -34.412 1.00 0.00 H
+ATOM 2810 3HG2 THR H 197 -12.703 -16.779 -34.889 1.00 0.00 H
+ATOM 2811 N GLN H 198 -12.278 -14.438 -39.176 1.00 84.17 N
+ATOM 2812 CA GLN H 198 -11.948 -14.094 -40.555 1.00 82.85 C
+ATOM 2813 C GLN H 198 -12.770 -12.884 -40.967 1.00 85.77 C
+ATOM 2814 O GLN H 198 -14.001 -12.957 -41.010 1.00 93.67 O
+ATOM 2815 CB GLN H 198 -12.220 -15.269 -41.499 1.00 82.66 C
+ATOM 2816 CG GLN H 198 -12.033 -14.935 -42.971 1.00 84.93 C
+ATOM 2817 CD GLN H 198 -10.601 -14.577 -43.314 1.00 88.34 C
+ATOM 2818 OE1 GLN H 198 -9.661 -15.033 -42.662 1.00 81.77 O
+ATOM 2819 NE2 GLN H 198 -10.428 -13.739 -44.334 1.00 93.17 N
+ATOM 2820 H GLN H 198 -13.245 -14.424 -38.883 1.00 0.00 H
+ATOM 2821 HA GLN H 198 -10.887 -13.852 -40.607 1.00 0.00 H
+ATOM 2822 1HB GLN H 198 -11.554 -16.096 -41.252 1.00 0.00 H
+ATOM 2823 2HB GLN H 198 -13.242 -15.619 -41.359 1.00 0.00 H
+ATOM 2824 1HG GLN H 198 -12.318 -15.801 -43.569 1.00 0.00 H
+ATOM 2825 2HG GLN H 198 -12.665 -14.083 -43.223 1.00 0.00 H
+ATOM 2826 1HE2 GLN H 198 -9.504 -13.466 -44.607 1.00 0.00 H
+ATOM 2827 2HE2 GLN H 198 -11.221 -13.382 -44.828 1.00 0.00 H
+ATOM 2828 N THR H 199 -12.097 -11.776 -41.265 1.00 82.41 N
+ATOM 2829 CA THR H 199 -12.781 -10.593 -41.769 1.00 88.52 C
+ATOM 2830 C THR H 199 -13.018 -10.731 -43.266 1.00 93.55 C
+ATOM 2831 O THR H 199 -12.151 -11.202 -44.007 1.00 94.07 O
+ATOM 2832 CB THR H 199 -11.970 -9.328 -41.476 1.00 90.44 C
+ATOM 2833 OG1 THR H 199 -11.686 -9.251 -40.072 1.00102.61 O
+ATOM 2834 CG2 THR H 199 -12.739 -8.087 -41.895 1.00 79.36 C
+ATOM 2835 H THR H 199 -11.095 -11.750 -41.141 1.00 0.00 H
+ATOM 2836 HA THR H 199 -13.744 -10.510 -41.266 1.00 0.00 H
+ATOM 2837 HB THR H 199 -11.028 -9.365 -42.023 1.00 0.00 H
+ATOM 2838 HG1 THR H 199 -12.068 -10.011 -39.627 1.00 0.00 H
+ATOM 2839 1HG2 THR H 199 -12.144 -7.200 -41.678 1.00 0.00 H
+ATOM 2840 2HG2 THR H 199 -12.948 -8.132 -42.964 1.00 0.00 H
+ATOM 2841 3HG2 THR H 199 -13.677 -8.037 -41.344 1.00 0.00 H
+ATOM 2842 N TYR H 200 -14.208 -10.329 -43.707 1.00 95.48 N
+ATOM 2843 CA TYR H 200 -14.607 -10.431 -45.105 1.00 85.50 C
+ATOM 2844 C TYR H 200 -14.806 -9.033 -45.671 1.00 86.99 C
+ATOM 2845 O TYR H 200 -15.674 -8.286 -45.206 1.00 86.16 O
+ATOM 2846 CB TYR H 200 -15.878 -11.270 -45.250 1.00 69.14 C
+ATOM 2847 CG TYR H 200 -15.665 -12.722 -44.893 1.00 68.27 C
+ATOM 2848 CD1 TYR H 200 -14.970 -13.568 -45.743 1.00 83.14 C
+ATOM 2849 CD2 TYR H 200 -16.147 -13.244 -43.702 1.00 74.63 C
+ATOM 2850 CE1 TYR H 200 -14.765 -14.897 -45.421 1.00 88.29 C
+ATOM 2851 CE2 TYR H 200 -15.948 -14.572 -43.369 1.00 82.49 C
+ATOM 2852 CZ TYR H 200 -15.257 -15.394 -44.233 1.00 85.76 C
+ATOM 2853 OH TYR H 200 -15.054 -16.717 -43.913 1.00 88.07 O
+ATOM 2854 H TYR H 200 -14.856 -9.938 -43.038 1.00 0.00 H
+ATOM 2855 HA TYR H 200 -13.805 -10.921 -45.659 1.00 0.00 H
+ATOM 2856 1HB TYR H 200 -16.659 -10.862 -44.606 1.00 0.00 H
+ATOM 2857 2HB TYR H 200 -16.237 -11.212 -46.277 1.00 0.00 H
+ATOM 2858 HD1 TYR H 200 -14.574 -13.189 -46.685 1.00 0.00 H
+ATOM 2859 HD2 TYR H 200 -16.695 -12.605 -43.009 1.00 0.00 H
+ATOM 2860 HE1 TYR H 200 -14.216 -15.545 -46.104 1.00 0.00 H
+ATOM 2861 HE2 TYR H 200 -16.338 -14.962 -42.429 1.00 0.00 H
+ATOM 2862 HH TYR H 200 -15.454 -16.904 -43.060 1.00 0.00 H
+ATOM 2863 N ILE H 201 -14.000 -8.687 -46.671 1.00 88.87 N
+ATOM 2864 CA ILE H 201 -14.025 -7.380 -47.316 1.00 84.89 C
+ATOM 2865 C ILE H 201 -14.319 -7.578 -48.797 1.00 87.92 C
+ATOM 2866 O ILE H 201 -13.774 -8.493 -49.426 1.00 94.77 O
+ATOM 2867 CB ILE H 201 -12.692 -6.631 -47.134 1.00 78.41 C
+ATOM 2868 CG1 ILE H 201 -12.420 -6.378 -45.649 1.00 79.04 C
+ATOM 2869 CG2 ILE H 201 -12.709 -5.321 -47.907 1.00 86.39 C
+ATOM 2870 CD1 ILE H 201 -11.025 -5.870 -45.362 1.00 0.00 C
+ATOM 2871 H ILE H 201 -13.339 -9.381 -46.990 1.00 0.00 H
+ATOM 2872 HA ILE H 201 -14.819 -6.786 -46.864 1.00 0.00 H
+ATOM 2873 HB ILE H 201 -11.874 -7.249 -47.504 1.00 0.00 H
+ATOM 2874 1HG1 ILE H 201 -13.134 -5.649 -45.268 1.00 0.00 H
+ATOM 2875 2HG1 ILE H 201 -12.567 -7.302 -45.090 1.00 0.00 H
+ATOM 2876 1HG2 ILE H 201 -11.760 -4.804 -47.767 1.00 0.00 H
+ATOM 2877 2HG2 ILE H 201 -12.858 -5.525 -48.966 1.00 0.00 H
+ATOM 2878 3HG2 ILE H 201 -13.521 -4.693 -47.540 1.00 0.00 H
+ATOM 2879 1HD1 ILE H 201 -10.908 -5.715 -44.289 1.00 0.00 H
+ATOM 2880 2HD1 ILE H 201 -10.293 -6.602 -45.705 1.00 0.00 H
+ATOM 2881 3HD1 ILE H 201 -10.867 -4.927 -45.883 1.00 0.00 H
+ATOM 2882 N CYS H 202 -15.186 -6.734 -49.353 1.00 84.82 N
+ATOM 2883 CA CYS H 202 -15.453 -6.745 -50.785 1.00 92.50 C
+ATOM 2884 C CYS H 202 -14.834 -5.508 -51.424 1.00 83.11 C
+ATOM 2885 O CYS H 202 -14.890 -4.407 -50.861 1.00 73.02 O
+ATOM 2886 CB CYS H 202 -16.958 -6.821 -51.095 1.00103.41 C
+ATOM 2887 SG CYS H 202 -17.874 -5.261 -51.114 1.00116.64 S
+ATOM 2888 H CYS H 202 -15.671 -6.069 -48.767 1.00 0.00 H
+ATOM 2889 HA CYS H 202 -14.978 -7.625 -51.219 1.00 0.00 H
+ATOM 2890 1HB CYS H 202 -17.105 -7.277 -52.074 1.00 0.00 H
+ATOM 2891 2HB CYS H 202 -17.449 -7.458 -50.360 1.00 0.00 H
+ATOM 2892 N ASN H 203 -14.220 -5.709 -52.588 1.00 81.76 N
+ATOM 2893 CA ASN H 203 -13.518 -4.663 -53.321 1.00 76.72 C
+ATOM 2894 C ASN H 203 -14.354 -4.295 -54.541 1.00 72.74 C
+ATOM 2895 O ASN H 203 -14.462 -5.080 -55.490 1.00 84.73 O
+ATOM 2896 CB ASN H 203 -12.120 -5.123 -53.727 1.00 81.33 C
+ATOM 2897 CG ASN H 203 -11.405 -5.871 -52.616 1.00 78.69 C
+ATOM 2898 OD1 ASN H 203 -11.458 -7.101 -52.542 1.00 68.54 O
+ATOM 2899 ND2 ASN H 203 -10.733 -5.130 -51.744 1.00 86.20 N
+ATOM 2900 H ASN H 203 -14.251 -6.643 -52.972 1.00 0.00 H
+ATOM 2901 HA ASN H 203 -13.419 -3.792 -52.671 1.00 0.00 H
+ATOM 2902 1HB ASN H 203 -12.190 -5.773 -54.600 1.00 0.00 H
+ATOM 2903 2HB ASN H 203 -11.520 -4.258 -54.010 1.00 0.00 H
+ATOM 2904 1HD2 ASN H 203 -10.242 -5.567 -50.990 1.00 0.00 H
+ATOM 2905 2HD2 ASN H 203 -10.718 -4.135 -51.841 1.00 0.00 H
+ATOM 2906 N VAL H 204 -14.946 -3.106 -54.504 1.00 63.24 N
+ATOM 2907 CA VAL H 204 -15.767 -2.583 -55.587 1.00 75.14 C
+ATOM 2908 C VAL H 204 -14.944 -1.553 -56.345 1.00 77.38 C
+ATOM 2909 O VAL H 204 -14.560 -0.518 -55.788 1.00 71.58 O
+ATOM 2910 CB VAL H 204 -17.071 -1.967 -55.054 1.00 76.37 C
+ATOM 2911 CG1 VAL H 204 -17.915 -1.423 -56.197 1.00 77.80 C
+ATOM 2912 CG2 VAL H 204 -17.850 -2.996 -54.256 1.00 78.79 C
+ATOM 2913 H VAL H 204 -14.811 -2.546 -53.675 1.00 0.00 H
+ATOM 2914 HA VAL H 204 -16.026 -3.407 -56.253 1.00 0.00 H
+ATOM 2915 HB VAL H 204 -16.826 -1.121 -54.411 1.00 0.00 H
+ATOM 2916 1HG1 VAL H 204 -18.833 -0.991 -55.798 1.00 0.00 H
+ATOM 2917 2HG1 VAL H 204 -17.355 -0.654 -56.729 1.00 0.00 H
+ATOM 2918 3HG1 VAL H 204 -18.164 -2.233 -56.883 1.00 0.00 H
+ATOM 2919 1HG2 VAL H 204 -18.770 -2.547 -53.884 1.00 0.00 H
+ATOM 2920 2HG2 VAL H 204 -18.093 -3.845 -54.896 1.00 0.00 H
+ATOM 2921 3HG2 VAL H 204 -17.247 -3.337 -53.414 1.00 0.00 H
+ATOM 2922 N ASN H 205 -14.664 -1.838 -57.613 1.00 81.00 N
+ATOM 2923 CA ASN H 205 -13.934 -0.931 -58.487 1.00 76.21 C
+ATOM 2924 C ASN H 205 -14.848 -0.525 -59.633 1.00 75.01 C
+ATOM 2925 O ASN H 205 -15.340 -1.383 -60.375 1.00 82.89 O
+ATOM 2926 CB ASN H 205 -12.653 -1.585 -59.012 1.00 76.91 C
+ATOM 2927 CG ASN H 205 -11.800 -0.630 -59.832 1.00 85.68 C
+ATOM 2928 OD1 ASN H 205 -12.041 0.576 -59.856 1.00 88.06 O
+ATOM 2929 ND2 ASN H 205 -10.785 -1.169 -60.496 1.00 92.41 N
+ATOM 2930 H ASN H 205 -14.976 -2.727 -57.977 1.00 0.00 H
+ATOM 2931 HA ASN H 205 -13.657 -0.045 -57.913 1.00 0.00 H
+ATOM 2932 1HB ASN H 205 -12.061 -1.952 -58.172 1.00 0.00 H
+ATOM 2933 2HB ASN H 205 -12.911 -2.445 -59.631 1.00 0.00 H
+ATOM 2934 1HD2 ASN H 205 -10.188 -0.591 -61.053 1.00 0.00 H
+ATOM 2935 2HD2 ASN H 205 -10.617 -2.153 -60.440 1.00 0.00 H
+ATOM 2936 N HIS H 206 -15.086 0.779 -59.759 1.00 68.18 N
+ATOM 2937 CA HIS H 206 -15.863 1.364 -60.850 1.00 76.67 C
+ATOM 2938 C HIS H 206 -14.917 2.266 -61.639 1.00 85.22 C
+ATOM 2939 O HIS H 206 -14.721 3.435 -61.296 1.00 90.75 O
+ATOM 2940 CB HIS H 206 -17.066 2.128 -60.325 1.00 70.18 C
+ATOM 2941 CG HIS H 206 -17.936 2.698 -61.402 1.00 79.94 C
+ATOM 2942 ND1 HIS H 206 -18.152 4.052 -61.545 1.00 86.02 N
+ATOM 2943 CD2 HIS H 206 -18.645 2.098 -62.388 1.00 72.72 C
+ATOM 2944 CE1 HIS H 206 -18.958 4.261 -62.571 1.00 80.21 C
+ATOM 2945 NE2 HIS H 206 -19.272 3.092 -63.099 1.00 76.98 N
+ATOM 2946 H HIS H 206 -14.699 1.386 -59.050 1.00 0.00 H
+ATOM 2947 HA HIS H 206 -16.232 0.571 -61.500 1.00 0.00 H
+ATOM 2948 1HB HIS H 206 -17.676 1.467 -59.708 1.00 0.00 H
+ATOM 2949 2HB HIS H 206 -16.728 2.947 -59.691 1.00 0.00 H
+ATOM 2950 HD2 HIS H 206 -18.708 1.027 -62.580 1.00 0.00 H
+ATOM 2951 HE1 HIS H 206 -19.304 5.233 -62.922 1.00 0.00 H
+ATOM 2952 HE2 HIS H 206 -19.875 2.947 -63.896 1.00 0.00 H
+ATOM 2953 N LYS H 207 -14.328 1.707 -62.695 1.00 81.77 N
+ATOM 2954 CA LYS H 207 -13.347 2.451 -63.480 1.00 85.26 C
+ATOM 2955 C LYS H 207 -13.901 3.710 -64.142 1.00102.53 C
+ATOM 2956 O LYS H 207 -13.165 4.712 -64.190 1.00105.52 O
+ATOM 2957 CB LYS H 207 -12.746 1.538 -64.550 1.00 85.46 C
+ATOM 2958 CG LYS H 207 -11.824 0.454 -64.006 1.00 82.72 C
+ATOM 2959 CD LYS H 207 -11.284 -0.424 -65.125 1.00 0.00 C
+ATOM 2960 CE LYS H 207 -10.371 -1.514 -64.582 1.00 0.00 C
+ATOM 2961 NZ LYS H 207 -9.867 -2.406 -65.662 1.00 0.00 N
+ATOM 2962 H LYS H 207 -14.556 0.760 -62.962 1.00 0.00 H
+ATOM 2963 HA LYS H 207 -12.566 2.809 -62.808 1.00 0.00 H
+ATOM 2964 1HB LYS H 207 -13.548 1.048 -65.103 1.00 0.00 H
+ATOM 2965 2HB LYS H 207 -12.176 2.136 -65.261 1.00 0.00 H
+ATOM 2966 1HG LYS H 207 -10.987 0.918 -63.483 1.00 0.00 H
+ATOM 2967 2HG LYS H 207 -12.371 -0.168 -63.299 1.00 0.00 H
+ATOM 2968 1HD LYS H 207 -12.116 -0.890 -65.656 1.00 0.00 H
+ATOM 2969 2HD LYS H 207 -10.723 0.188 -65.830 1.00 0.00 H
+ATOM 2970 1HE LYS H 207 -9.521 -1.058 -64.078 1.00 0.00 H
+ATOM 2971 2HE LYS H 207 -10.916 -2.116 -63.855 1.00 0.00 H
+ATOM 2972 1HZ LYS H 207 -9.267 -3.114 -65.262 1.00 0.00 H
+ATOM 2973 2HZ LYS H 207 -10.648 -2.850 -66.124 1.00 0.00 H
+ATOM 2974 3HZ LYS H 207 -9.344 -1.862 -66.332 1.00 0.00 H
+ATOM 2975 N PRO H 208 -15.132 3.741 -64.680 1.00107.40 N
+ATOM 2976 CA PRO H 208 -15.603 4.980 -65.326 1.00 95.16 C
+ATOM 2977 C PRO H 208 -15.546 6.200 -64.427 1.00 97.23 C
+ATOM 2978 O PRO H 208 -15.311 7.310 -64.922 1.00100.45 O
+ATOM 2979 CB PRO H 208 -17.047 4.640 -65.719 1.00 85.29 C
+ATOM 2980 CG PRO H 208 -17.032 3.179 -65.926 1.00 94.91 C
+ATOM 2981 CD PRO H 208 -16.089 2.635 -64.889 1.00104.33 C
+ATOM 2982 HA PRO H 208 -14.990 5.179 -66.217 1.00 0.00 H
+ATOM 2983 1HB PRO H 208 -17.737 4.951 -64.921 1.00 0.00 H
+ATOM 2984 2HB PRO H 208 -17.331 5.196 -66.624 1.00 0.00 H
+ATOM 2985 1HG PRO H 208 -18.047 2.770 -65.817 1.00 0.00 H
+ATOM 2986 2HG PRO H 208 -16.702 2.944 -66.949 1.00 0.00 H
+ATOM 2987 1HD PRO H 208 -16.647 2.405 -63.969 1.00 0.00 H
+ATOM 2988 2HD PRO H 208 -15.595 1.733 -65.279 1.00 0.00 H
+ATOM 2989 N SER H 209 -15.748 6.034 -63.122 1.00 98.01 N
+ATOM 2990 CA SER H 209 -15.657 7.138 -62.179 1.00105.19 C
+ATOM 2991 C SER H 209 -14.375 7.100 -61.358 1.00100.97 C
+ATOM 2992 O SER H 209 -14.219 7.909 -60.437 1.00 92.67 O
+ATOM 2993 CB SER H 209 -16.877 7.144 -61.254 1.00102.18 C
+ATOM 2994 OG SER H 209 -17.003 5.916 -60.559 1.00 99.60 O
+ATOM 2995 H SER H 209 -15.971 5.111 -62.779 1.00 0.00 H
+ATOM 2996 HA SER H 209 -15.638 8.073 -62.741 1.00 0.00 H
+ATOM 2997 1HB SER H 209 -16.786 7.960 -60.537 1.00 0.00 H
+ATOM 2998 2HB SER H 209 -17.777 7.323 -61.841 1.00 0.00 H
+ATOM 2999 HG SER H 209 -16.269 5.370 -60.851 1.00 0.00 H
+ATOM 3000 N ASN H 210 -13.452 6.192 -61.684 1.00125.54 N
+ATOM 3001 CA ASN H 210 -12.227 5.986 -60.910 1.00128.74 C
+ATOM 3002 C ASN H 210 -12.545 5.846 -59.424 1.00120.25 C
+ATOM 3003 O ASN H 210 -11.981 6.532 -58.570 1.00120.05 O
+ATOM 3004 CB ASN H 210 -11.222 7.111 -61.158 1.00138.82 C
+ATOM 3005 CG ASN H 210 -10.626 7.062 -62.551 1.00153.58 C
+ATOM 3006 OD1 ASN H 210 -10.802 7.982 -63.349 1.00166.11 O
+ATOM 3007 ND2 ASN H 210 -9.914 5.982 -62.851 1.00154.79 N
+ATOM 3008 H ASN H 210 -13.617 5.626 -62.504 1.00 0.00 H
+ATOM 3009 HA ASN H 210 -11.773 5.045 -61.224 1.00 0.00 H
+ATOM 3010 1HB ASN H 210 -11.713 8.075 -61.019 1.00 0.00 H
+ATOM 3011 2HB ASN H 210 -10.415 7.046 -60.428 1.00 0.00 H
+ATOM 3012 1HD2 ASN H 210 -9.496 5.894 -63.756 1.00 0.00 H
+ATOM 3013 2HD2 ASN H 210 -9.796 5.257 -62.173 1.00 0.00 H
+ATOM 3014 N THR H 211 -13.474 4.943 -59.120 1.00108.85 N
+ATOM 3015 CA THR H 211 -13.998 4.762 -57.768 1.00 96.66 C
+ATOM 3016 C THR H 211 -13.592 3.378 -57.271 1.00 98.21 C
+ATOM 3017 O THR H 211 -14.293 2.391 -57.502 1.00 99.61 O
+ATOM 3018 CB THR H 211 -15.524 4.948 -57.744 1.00 89.28 C
+ATOM 3019 OG1 THR H 211 -15.852 6.271 -58.187 1.00 88.47 O
+ATOM 3020 CG2 THR H 211 -16.080 4.729 -56.337 1.00 79.52 C
+ATOM 3021 H THR H 211 -13.826 4.361 -59.866 1.00 0.00 H
+ATOM 3022 HA THR H 211 -13.548 5.514 -57.119 1.00 0.00 H
+ATOM 3023 HB THR H 211 -15.988 4.233 -58.423 1.00 0.00 H
+ATOM 3024 HG1 THR H 211 -15.045 6.746 -58.400 1.00 0.00 H
+ATOM 3025 1HG2 THR H 211 -17.161 4.866 -56.348 1.00 0.00 H
+ATOM 3026 2HG2 THR H 211 -15.845 3.717 -56.006 1.00 0.00 H
+ATOM 3027 3HG2 THR H 211 -15.631 5.447 -55.653 1.00 0.00 H
+ATOM 3028 N LYS H 212 -12.452 3.308 -56.591 1.00 93.89 N
+ATOM 3029 CA LYS H 212 -12.006 2.092 -55.927 1.00 86.35 C
+ATOM 3030 C LYS H 212 -12.371 2.181 -54.450 1.00 90.57 C
+ATOM 3031 O LYS H 212 -12.012 3.152 -53.776 1.00104.60 O
+ATOM 3032 CB LYS H 212 -10.501 1.887 -56.103 1.00 81.43 C
+ATOM 3033 CG LYS H 212 -9.967 0.595 -55.499 1.00 0.00 C
+ATOM 3034 CD LYS H 212 -8.475 0.442 -55.750 1.00 0.00 C
+ATOM 3035 CE LYS H 212 -7.938 -0.844 -55.139 1.00 0.00 C
+ATOM 3036 NZ LYS H 212 -6.478 -1.007 -55.377 1.00 0.00 N
+ATOM 3037 H LYS H 212 -11.877 4.137 -56.538 1.00 0.00 H
+ATOM 3038 HA LYS H 212 -12.522 1.243 -56.377 1.00 0.00 H
+ATOM 3039 1HB LYS H 212 -10.255 1.885 -57.165 1.00 0.00 H
+ATOM 3040 2HB LYS H 212 -9.964 2.717 -55.644 1.00 0.00 H
+ATOM 3041 1HG LYS H 212 -10.147 0.594 -54.423 1.00 0.00 H
+ATOM 3042 2HG LYS H 212 -10.490 -0.255 -55.937 1.00 0.00 H
+ATOM 3043 1HD LYS H 212 -8.286 0.430 -56.825 1.00 0.00 H
+ATOM 3044 2HD LYS H 212 -7.944 1.289 -55.316 1.00 0.00 H
+ATOM 3045 1HE LYS H 212 -8.120 -0.839 -54.065 1.00 0.00 H
+ATOM 3046 2HE LYS H 212 -8.461 -1.698 -55.570 1.00 0.00 H
+ATOM 3047 1HZ LYS H 212 -6.162 -1.870 -54.957 1.00 0.00 H
+ATOM 3048 2HZ LYS H 212 -6.300 -1.032 -56.372 1.00 0.00 H
+ATOM 3049 3HZ LYS H 212 -5.980 -0.231 -54.966 1.00 0.00 H
+ATOM 3050 N VAL H 213 -13.087 1.171 -53.957 1.00 90.57 N
+ATOM 3051 CA VAL H 213 -13.653 1.175 -52.610 1.00 85.44 C
+ATOM 3052 C VAL H 213 -13.497 -0.213 -52.005 1.00 79.65 C
+ATOM 3053 O VAL H 213 -13.836 -1.213 -52.645 1.00 85.87 O
+ATOM 3054 CB VAL H 213 -15.138 1.591 -52.625 1.00 78.26 C
+ATOM 3055 CG1 VAL H 213 -15.821 1.206 -51.329 1.00 71.59 C
+ATOM 3056 CG2 VAL H 213 -15.265 3.088 -52.856 1.00 90.86 C
+ATOM 3057 H VAL H 213 -13.239 0.369 -54.552 1.00 0.00 H
+ATOM 3058 HA VAL H 213 -13.103 1.897 -52.006 1.00 0.00 H
+ATOM 3059 HB VAL H 213 -15.647 1.058 -53.428 1.00 0.00 H
+ATOM 3060 1HG1 VAL H 213 -16.868 1.510 -51.365 1.00 0.00 H
+ATOM 3061 2HG1 VAL H 213 -15.762 0.126 -51.193 1.00 0.00 H
+ATOM 3062 3HG1 VAL H 213 -15.327 1.705 -50.495 1.00 0.00 H
+ATOM 3063 1HG2 VAL H 213 -16.318 3.367 -52.865 1.00 0.00 H
+ATOM 3064 2HG2 VAL H 213 -14.754 3.624 -52.056 1.00 0.00 H
+ATOM 3065 3HG2 VAL H 213 -14.813 3.348 -53.813 1.00 0.00 H
+ATOM 3066 N ASP H 214 -12.986 -0.278 -50.776 1.00 84.16 N
+ATOM 3067 CA ASP H 214 -12.899 -1.519 -50.011 1.00 86.60 C
+ATOM 3068 C ASP H 214 -13.856 -1.429 -48.828 1.00 76.62 C
+ATOM 3069 O ASP H 214 -13.673 -0.585 -47.946 1.00 81.17 O
+ATOM 3070 CB ASP H 214 -11.472 -1.774 -49.522 1.00100.45 C
+ATOM 3071 CG ASP H 214 -10.494 -2.015 -50.659 1.00115.03 C
+ATOM 3072 OD1 ASP H 214 -10.926 -2.484 -51.732 1.00117.44 O
+ATOM 3073 OD2 ASP H 214 -9.289 -1.740 -50.473 1.00122.81 O
+ATOM 3074 H ASP H 214 -12.646 0.579 -50.364 1.00 0.00 H
+ATOM 3075 HA ASP H 214 -13.190 -2.346 -50.659 1.00 0.00 H
+ATOM 3076 1HB ASP H 214 -11.128 -0.918 -48.941 1.00 0.00 H
+ATOM 3077 2HB ASP H 214 -11.463 -2.643 -48.863 1.00 0.00 H
+ATOM 3078 N LYS H 215 -14.867 -2.296 -48.804 1.00 79.26 N
+ATOM 3079 CA LYS H 215 -15.908 -2.245 -47.784 1.00 86.08 C
+ATOM 3080 C LYS H 215 -15.870 -3.498 -46.918 1.00 91.70 C
+ATOM 3081 O LYS H 215 -15.844 -4.620 -47.438 1.00 98.07 O
+ATOM 3082 CB LYS H 215 -17.293 -2.083 -48.418 1.00 84.72 C
+ATOM 3083 CG LYS H 215 -18.418 -1.919 -47.408 1.00 91.90 C
+ATOM 3084 CD LYS H 215 -18.105 -0.801 -46.427 1.00107.55 C
+ATOM 3085 CE LYS H 215 -19.270 -0.531 -45.488 1.00116.03 C
+ATOM 3086 NZ LYS H 215 -20.444 0.040 -46.202 1.00118.63 N
+ATOM 3087 H LYS H 215 -14.911 -3.010 -49.517 1.00 0.00 H
+ATOM 3088 HA LYS H 215 -15.721 -1.384 -47.142 1.00 0.00 H
+ATOM 3089 1HB LYS H 215 -17.294 -1.210 -49.072 1.00 0.00 H
+ATOM 3090 2HB LYS H 215 -17.515 -2.954 -49.035 1.00 0.00 H
+ATOM 3091 1HG LYS H 215 -19.346 -1.688 -47.932 1.00 0.00 H
+ATOM 3092 2HG LYS H 215 -18.553 -2.851 -46.860 1.00 0.00 H
+ATOM 3093 1HD LYS H 215 -17.231 -1.072 -45.833 1.00 0.00 H
+ATOM 3094 2HD LYS H 215 -17.880 0.113 -46.977 1.00 0.00 H
+ATOM 3095 1HE LYS H 215 -19.571 -1.460 -45.006 1.00 0.00 H
+ATOM 3096 2HE LYS H 215 -18.958 0.169 -44.713 1.00 0.00 H
+ATOM 3097 1HZ LYS H 215 -21.192 0.204 -45.543 1.00 0.00 H
+ATOM 3098 2HZ LYS H 215 -20.182 0.913 -46.638 1.00 0.00 H
+ATOM 3099 3HZ LYS H 215 -20.756 -0.609 -46.910 1.00 0.00 H
+ATOM 3100 N ARG H 216 -15.886 -3.298 -45.600 1.00 84.82 N
+ATOM 3101 CA ARG H 216 -15.856 -4.390 -44.635 1.00 80.97 C
+ATOM 3102 C ARG H 216 -17.275 -4.859 -44.339 1.00 81.74 C
+ATOM 3103 O ARG H 216 -18.173 -4.042 -44.110 1.00 85.11 O
+ATOM 3104 CB ARG H 216 -15.179 -3.956 -43.343 1.00 76.10 C
+ATOM 3105 CG ARG H 216 -15.085 -5.036 -42.277 1.00 73.50 C
+ATOM 3106 CD ARG H 216 -14.293 -4.582 -41.104 1.00 84.82 C
+ATOM 3107 NE ARG H 216 -12.884 -4.432 -41.428 1.00 78.19 N
+ATOM 3108 CZ ARG H 216 -11.962 -3.897 -40.603 1.00 0.00 C
+ATOM 3109 NH1 ARG H 216 -12.317 -3.466 -39.413 1.00 0.00 N
+ATOM 3110 NH2 ARG H 216 -10.702 -3.805 -40.991 1.00 0.00 N
+ATOM 3111 H ARG H 216 -15.920 -2.346 -45.265 1.00 0.00 H
+ATOM 3112 HA ARG H 216 -15.290 -5.217 -45.066 1.00 0.00 H
+ATOM 3113 1HB ARG H 216 -14.167 -3.617 -43.559 1.00 0.00 H
+ATOM 3114 2HB ARG H 216 -15.722 -3.114 -42.913 1.00 0.00 H
+ATOM 3115 1HG ARG H 216 -16.087 -5.297 -41.933 1.00 0.00 H
+ATOM 3116 2HG ARG H 216 -14.603 -5.920 -42.695 1.00 0.00 H
+ATOM 3117 1HD ARG H 216 -14.669 -3.619 -40.762 1.00 0.00 H
+ATOM 3118 2HD ARG H 216 -14.383 -5.312 -40.301 1.00 0.00 H
+ATOM 3119 HE ARG H 216 -12.573 -4.753 -42.335 1.00 0.00 H
+ATOM 3120 1HH1 ARG H 216 -13.280 -3.537 -39.116 1.00 0.00 H
+ATOM 3121 2HH1 ARG H 216 -11.627 -3.065 -38.795 1.00 0.00 H
+ATOM 3122 1HH2 ARG H 216 -10.430 -4.136 -41.907 1.00 0.00 H
+ATOM 3123 2HH2 ARG H 216 -10.012 -3.404 -40.374 1.00 0.00 H
+ATOM 3124 N VAL H 217 -17.471 -6.174 -44.342 1.00 76.26 N
+ATOM 3125 CA VAL H 217 -18.760 -6.786 -44.047 1.00 68.53 C
+ATOM 3126 C VAL H 217 -18.615 -7.546 -42.735 1.00 75.00 C
+ATOM 3127 O VAL H 217 -17.889 -8.545 -42.659 1.00 80.62 O
+ATOM 3128 CB VAL H 217 -19.225 -7.712 -45.177 1.00 67.76 C
+ATOM 3129 CG1 VAL H 217 -20.580 -8.321 -44.842 1.00 67.00 C
+ATOM 3130 CG2 VAL H 217 -19.282 -6.953 -46.493 1.00 65.16 C
+ATOM 3131 H VAL H 217 -16.683 -6.767 -44.560 1.00 0.00 H
+ATOM 3132 HA VAL H 217 -19.501 -5.994 -43.935 1.00 0.00 H
+ATOM 3133 HB VAL H 217 -18.521 -8.540 -45.269 1.00 0.00 H
+ATOM 3134 1HG1 VAL H 217 -20.896 -8.976 -45.655 1.00 0.00 H
+ATOM 3135 2HG1 VAL H 217 -20.502 -8.898 -43.921 1.00 0.00 H
+ATOM 3136 3HG1 VAL H 217 -21.314 -7.526 -44.712 1.00 0.00 H
+ATOM 3137 1HG2 VAL H 217 -19.613 -7.624 -47.286 1.00 0.00 H
+ATOM 3138 2HG2 VAL H 217 -19.982 -6.122 -46.404 1.00 0.00 H
+ATOM 3139 3HG2 VAL H 217 -18.291 -6.568 -46.734 1.00 0.00 H
+ATOM 3140 N GLU H 218 -19.303 -7.077 -41.700 1.00 78.23 N
+ATOM 3141 CA GLU H 218 -19.278 -7.705 -40.392 1.00 89.27 C
+ATOM 3142 C GLU H 218 -20.704 -7.919 -39.907 1.00 87.96 C
+ATOM 3143 O GLU H 218 -21.618 -7.202 -40.327 1.00 82.15 O
+ATOM 3144 CB GLU H 218 -18.497 -6.845 -39.384 1.00 96.25 C
+ATOM 3145 CG GLU H 218 -19.247 -5.628 -38.864 1.00110.48 C
+ATOM 3146 CD GLU H 218 -18.354 -4.697 -38.064 1.00128.86 C
+ATOM 3147 OE1 GLU H 218 -17.137 -4.965 -37.982 1.00136.38 O
+ATOM 3148 OE2 GLU H 218 -18.868 -3.698 -37.517 1.00135.08 O
+ATOM 3149 H GLU H 218 -19.864 -6.249 -41.837 1.00 0.00 H
+ATOM 3150 HA GLU H 218 -18.779 -8.670 -40.481 1.00 0.00 H
+ATOM 3151 1HB GLU H 218 -18.220 -7.454 -38.523 1.00 0.00 H
+ATOM 3152 2HB GLU H 218 -17.575 -6.492 -39.845 1.00 0.00 H
+ATOM 3153 1HG GLU H 218 -19.664 -5.082 -39.710 1.00 0.00 H
+ATOM 3154 2HG GLU H 218 -20.074 -5.963 -38.240 1.00 0.00 H
+ATOM 3155 N PRO H 219 -20.930 -8.910 -39.042 1.00100.05 N
+ATOM 3156 CA PRO H 219 -22.290 -9.151 -38.545 1.00108.17 C
+ATOM 3157 C PRO H 219 -22.810 -7.971 -37.738 1.00120.07 C
+ATOM 3158 O PRO H 219 -22.050 -7.149 -37.221 1.00113.74 O
+ATOM 3159 CB PRO H 219 -22.136 -10.404 -37.672 1.00100.59 C
+ATOM 3160 CG PRO H 219 -20.690 -10.445 -37.315 1.00 86.88 C
+ATOM 3161 CD PRO H 219 -19.971 -9.892 -38.508 1.00 95.63 C
+ATOM 3162 HA PRO H 219 -22.957 -9.349 -39.397 1.00 0.00 H
+ATOM 3163 1HB PRO H 219 -22.786 -10.329 -36.788 1.00 0.00 H
+ATOM 3164 2HB PRO H 219 -22.457 -11.295 -38.232 1.00 0.00 H
+ATOM 3165 1HG PRO H 219 -20.506 -9.851 -36.407 1.00 0.00 H
+ATOM 3166 2HG PRO H 219 -20.384 -11.477 -37.087 1.00 0.00 H
+ATOM 3167 1HD PRO H 219 -19.035 -9.414 -38.184 1.00 0.00 H
+ATOM 3168 2HD PRO H 219 -19.765 -10.704 -39.222 1.00 0.00 H
+ATOM 3169 N LYS H 220 -24.139 -7.899 -37.636 1.00139.38 N
+ATOM 3170 CA LYS H 220 -24.803 -6.784 -36.970 1.00149.59 C
+ATOM 3171 C LYS H 220 -24.461 -6.735 -35.484 1.00159.96 C
+ATOM 3172 O LYS H 220 -23.771 -7.620 -34.966 1.00163.33 O
+ATOM 3173 CB LYS H 220 -26.318 -6.878 -37.157 1.00148.29 C
+ATOM 3174 CG LYS H 220 -26.789 -6.683 -38.592 1.00 0.00 C
+ATOM 3175 CD LYS H 220 -28.293 -6.878 -38.712 1.00 0.00 C
+ATOM 3176 CE LYS H 220 -29.054 -5.744 -38.041 1.00 0.00 C
+ATOM 3177 NZ LYS H 220 -30.523 -5.866 -38.239 1.00 0.00 N
+ATOM 3178 H LYS H 220 -24.700 -8.640 -38.032 1.00 0.00 H
+ATOM 3179 HA LYS H 220 -24.446 -5.854 -37.413 1.00 0.00 H
+ATOM 3180 1HB LYS H 220 -26.666 -7.855 -36.820 1.00 0.00 H
+ATOM 3181 2HB LYS H 220 -26.808 -6.125 -36.539 1.00 0.00 H
+ATOM 3182 1HG LYS H 220 -26.533 -5.677 -38.925 1.00 0.00 H
+ATOM 3183 2HG LYS H 220 -26.285 -7.400 -39.240 1.00 0.00 H
+ATOM 3184 1HD LYS H 220 -28.572 -6.919 -39.765 1.00 0.00 H
+ATOM 3185 2HD LYS H 220 -28.576 -7.820 -38.242 1.00 0.00 H
+ATOM 3186 1HE LYS H 220 -28.842 -5.746 -36.973 1.00 0.00 H
+ATOM 3187 2HE LYS H 220 -28.723 -4.790 -38.452 1.00 0.00 H
+ATOM 3188 1HZ LYS H 220 -30.991 -5.097 -37.781 1.00 0.00 H
+ATOM 3189 2HZ LYS H 220 -30.733 -5.846 -39.227 1.00 0.00 H
+ATOM 3190 3HZ LYS H 220 -30.845 -6.738 -37.844 1.00 0.00 H
+ATOM 3191 N SER H 221 -24.957 -5.708 -34.793 1.00159.14 N
+ATOM 3192 CA SER H 221 -24.521 -5.431 -33.427 1.00159.61 C
+ATOM 3193 C SER H 221 -24.911 -6.554 -32.471 1.00170.07 C
+ATOM 3194 O SER H 221 -24.058 -7.124 -31.782 1.00167.29 O
+ATOM 3195 CB SER H 221 -25.107 -4.098 -32.961 1.00156.01 C
+ATOM 3196 OG SER H 221 -26.520 -4.166 -32.884 1.00154.07 O
+ATOM 3197 H SER H 221 -25.648 -5.108 -35.220 1.00 0.00 H
+ATOM 3198 HA SER H 221 -23.432 -5.364 -33.418 1.00 0.00 H
+ATOM 3199 1HB SER H 221 -24.698 -3.843 -31.984 1.00 0.00 H
+ATOM 3200 2HB SER H 221 -24.815 -3.310 -33.654 1.00 0.00 H
+ATOM 3201 HG SER H 221 -26.757 -5.057 -33.152 1.00 0.00 H
+ATOM 3202 N CYS H 222 -26.200 -6.883 -32.417 1.00177.60 N
+ATOM 3203 CA CYS H 222 -26.736 -7.802 -31.411 1.00188.27 C
+ATOM 3204 C CYS H 222 -26.193 -9.231 -31.512 1.00192.04 C
+ATOM 3205 O CYS H 222 -26.864 -10.140 -32.000 1.00196.67 O
+ATOM 3206 OXT CYS H 222 -25.091 -9.484 -31.110 1.00 0.00 O
+ATOM 3207 CB CYS H 222 -28.266 -7.825 -31.500 1.00189.06 C
+ATOM 3208 SG CYS H 222 -28.931 -8.119 -33.162 1.00177.49 S
+ATOM 3209 H CYS H 222 -26.827 -6.480 -33.099 1.00 0.00 H
+ATOM 3210 HA CYS H 222 -26.442 -7.444 -30.424 1.00 0.00 H
+ATOM 3211 1HB CYS H 222 -28.657 -8.605 -30.846 1.00 0.00 H
+ATOM 3212 2HB CYS H 222 -28.665 -6.873 -31.149 1.00 0.00 H
+ATOM 3213 HG CYS H 222 -30.212 -8.064 -32.811 1.00 0.00 H
+TER
+HETATM 3215 O HOH H 301 -10.753 -11.204 -84.734 1.00 54.28 O
+HETATM 3216 H1 HOH H 301 -10.629 -11.075 -83.794 1.00 0.00 H
+HETATM 3217 H2 HOH H 301 -10.318 -10.454 -85.139 1.00 0.00 H
+HETATM 3218 O HOH H 302 -14.265 6.385 -83.153 1.00103.88 O
+HETATM 3219 H1 HOH H 302 -14.095 6.317 -82.214 1.00 0.00 H
+HETATM 3220 H2 HOH H 302 -15.055 6.922 -83.215 1.00 0.00 H
+HETATM 3221 O HOH H 303 -4.090 -1.997 -94.884 1.00 82.25 O
+HETATM 3222 H1 HOH H 303 -4.047 -1.967 -93.928 1.00 0.00 H
+HETATM 3223 H2 HOH H 303 -4.241 -2.920 -95.089 1.00 0.00 H
+HETATM 3224 O HOH H 304 -23.071 -6.612 -64.761 1.00 87.49 O
+HETATM 3225 H1 HOH H 304 -22.748 -6.519 -63.865 1.00 0.00 H
+HETATM 3226 H2 HOH H 304 -22.660 -5.892 -65.240 1.00 0.00 H
+HETATM 3227 O HOH H 305 -9.530 -15.353 -47.530 1.00 53.72 O
+HETATM 3228 H1 HOH H 305 -9.349 -15.056 -46.638 1.00 0.00 H
+HETATM 3229 H2 HOH H 305 -9.833 -16.255 -47.426 1.00 0.00 H
+HETATM 3230 O HOH H 306 -17.081 -6.245 -74.898 1.00 57.23 O
+HETATM 3231 H1 HOH H 306 -16.867 -6.156 -73.969 1.00 0.00 H
+HETATM 3232 H2 HOH H 306 -16.842 -7.146 -75.114 1.00 0.00 H
+HETATM 3233 O HOH H 307 -26.897 -5.397 -67.910 1.00 79.01 O
+HETATM 3234 H1 HOH H 307 -26.536 -5.321 -67.027 1.00 0.00 H
+HETATM 3235 H2 HOH H 307 -26.743 -6.310 -68.154 1.00 0.00 H
+HETATM 3236 O HOH H 308 -20.968 -6.654 -63.481 1.00 75.97 O
+HETATM 3237 H1 HOH H 308 -20.662 -6.557 -62.579 1.00 0.00 H
+HETATM 3238 H2 HOH H 308 -20.628 -5.882 -63.934 1.00 0.00 H
+HETATM 3239 O HOH H 309 -29.378 -3.806 -68.524 1.00 81.11 O
+HETATM 3240 H1 HOH H 309 -28.995 -3.754 -67.648 1.00 0.00 H
+HETATM 3241 H2 HOH H 309 -28.771 -3.318 -69.081 1.00 0.00 H
+TER
+ATOM 3243 N ASP L 1 -38.866 -7.760 -95.403 1.00102.84 N
+ATOM 3244 CA ASP L 1 -38.069 -8.557 -94.476 1.00 95.15 C
+ATOM 3245 C ASP L 1 -38.493 -10.027 -94.506 1.00 92.51 C
+ATOM 3246 O ASP L 1 -39.650 -10.344 -94.778 1.00 95.68 O
+ATOM 3247 CB ASP L 1 -38.198 -8.009 -93.053 1.00 83.58 C
+ATOM 3248 CG ASP L 1 -37.553 -6.640 -92.884 1.00 0.00 C
+ATOM 3249 OD1 ASP L 1 -37.174 -6.058 -93.873 1.00 0.00 O
+ATOM 3250 OD2 ASP L 1 -37.447 -6.189 -91.769 1.00 0.00 O
+ATOM 3251 1H ASP L 1 -38.569 -6.806 -95.364 1.00 0.00 H
+ATOM 3252 2H ASP L 1 -38.744 -8.108 -96.332 1.00 0.00 H
+ATOM 3253 3H ASP L 1 -39.831 -7.819 -95.149 1.00 0.00 H
+ATOM 3254 HA ASP L 1 -37.025 -8.507 -94.786 1.00 0.00 H
+ATOM 3255 1HB ASP L 1 -39.252 -7.934 -92.785 1.00 0.00 H
+ATOM 3256 2HB ASP L 1 -37.731 -8.703 -92.352 1.00 0.00 H
+ATOM 3257 N ILE L 2 -37.548 -10.919 -94.223 1.00 88.11 N
+ATOM 3258 CA ILE L 2 -37.780 -12.359 -94.237 1.00 89.71 C
+ATOM 3259 C ILE L 2 -37.471 -12.917 -92.854 1.00 80.09 C
+ATOM 3260 O ILE L 2 -36.392 -12.668 -92.304 1.00 67.77 O
+ATOM 3261 CB ILE L 2 -36.936 -13.053 -95.321 1.00 88.34 C
+ATOM 3262 CG1 ILE L 2 -36.950 -14.566 -95.120 1.00 74.06 C
+ATOM 3263 CG2 ILE L 2 -35.522 -12.488 -95.344 1.00 96.00 C
+ATOM 3264 CD1 ILE L 2 -36.182 -15.306 -96.173 1.00 78.21 C
+ATOM 3265 H ILE L 2 -36.629 -10.571 -93.989 1.00 0.00 H
+ATOM 3266 HA ILE L 2 -38.832 -12.538 -94.458 1.00 0.00 H
+ATOM 3267 HB ILE L 2 -37.395 -12.894 -96.296 1.00 0.00 H
+ATOM 3268 1HG1 ILE L 2 -36.526 -14.807 -94.146 1.00 0.00 H
+ATOM 3269 2HG1 ILE L 2 -37.980 -14.924 -95.126 1.00 0.00 H
+ATOM 3270 1HG2 ILE L 2 -34.941 -12.992 -96.116 1.00 0.00 H
+ATOM 3271 2HG2 ILE L 2 -35.560 -11.421 -95.558 1.00 0.00 H
+ATOM 3272 3HG2 ILE L 2 -35.051 -12.647 -94.374 1.00 0.00 H
+ATOM 3273 1HD1 ILE L 2 -36.231 -16.377 -95.974 1.00 0.00 H
+ATOM 3274 2HD1 ILE L 2 -36.615 -15.099 -97.152 1.00 0.00 H
+ATOM 3275 3HD1 ILE L 2 -35.142 -14.982 -96.160 1.00 0.00 H
+ATOM 3276 N GLN L 3 -38.409 -13.683 -92.302 1.00 73.75 N
+ATOM 3277 CA GLN L 3 -38.395 -14.046 -90.892 1.00 68.17 C
+ATOM 3278 C GLN L 3 -37.896 -15.467 -90.668 1.00 72.58 C
+ATOM 3279 O GLN L 3 -38.311 -16.404 -91.355 1.00 65.50 O
+ATOM 3280 CB GLN L 3 -39.790 -13.893 -90.285 1.00 74.58 C
+ATOM 3281 CG GLN L 3 -40.398 -12.520 -90.488 1.00101.40 C
+ATOM 3282 CD GLN L 3 -41.688 -12.339 -89.716 1.00127.72 C
+ATOM 3283 OE1 GLN L 3 -41.918 -13.007 -88.706 1.00131.56 O
+ATOM 3284 NE2 GLN L 3 -42.536 -11.429 -90.183 1.00138.36 N
+ATOM 3285 H GLN L 3 -39.157 -14.022 -92.890 1.00 0.00 H
+ATOM 3286 HA GLN L 3 -37.713 -13.376 -90.369 1.00 0.00 H
+ATOM 3287 1HB GLN L 3 -40.461 -14.631 -90.725 1.00 0.00 H
+ATOM 3288 2HB GLN L 3 -39.744 -14.090 -89.214 1.00 0.00 H
+ATOM 3289 1HG GLN L 3 -39.688 -11.766 -90.149 1.00 0.00 H
+ATOM 3290 2HG GLN L 3 -40.612 -12.382 -91.548 1.00 0.00 H
+ATOM 3291 1HE2 GLN L 3 -43.405 -11.266 -89.713 1.00 0.00 H
+ATOM 3292 2HE2 GLN L 3 -42.307 -10.906 -91.004 1.00 0.00 H
+ATOM 3293 N MET L 4 -37.021 -15.618 -89.676 1.00 75.17 N
+ATOM 3294 CA MET L 4 -36.499 -16.906 -89.246 1.00 63.55 C
+ATOM 3295 C MET L 4 -37.173 -17.329 -87.947 1.00 65.05 C
+ATOM 3296 O MET L 4 -37.456 -16.494 -87.083 1.00 86.48 O
+ATOM 3297 CB MET L 4 -34.984 -16.835 -89.050 1.00 61.38 C
+ATOM 3298 CG MET L 4 -34.228 -16.457 -90.311 1.00 65.55 C
+ATOM 3299 SD MET L 4 -34.243 -17.793 -91.519 1.00 74.54 S
+ATOM 3300 CE MET L 4 -34.362 -16.864 -93.046 1.00 96.57 C
+ATOM 3301 H MET L 4 -36.712 -14.780 -89.205 1.00 0.00 H
+ATOM 3302 HA MET L 4 -36.715 -17.642 -90.020 1.00 0.00 H
+ATOM 3303 1HB MET L 4 -34.751 -16.103 -88.278 1.00 0.00 H
+ATOM 3304 2HB MET L 4 -34.616 -17.802 -88.706 1.00 0.00 H
+ATOM 3305 1HG MET L 4 -34.682 -15.572 -90.755 1.00 0.00 H
+ATOM 3306 2HG MET L 4 -33.195 -16.220 -90.058 1.00 0.00 H
+ATOM 3307 1HE MET L 4 -34.382 -17.553 -93.891 1.00 0.00 H
+ATOM 3308 2HE MET L 4 -35.277 -16.269 -93.040 1.00 0.00 H
+ATOM 3309 3HE MET L 4 -33.500 -16.202 -93.138 1.00 0.00 H
+ATOM 3310 N THR L 5 -37.430 -18.630 -87.810 1.00 67.79 N
+ATOM 3311 CA THR L 5 -38.106 -19.162 -86.628 1.00 82.80 C
+ATOM 3312 C THR L 5 -37.354 -20.381 -86.105 1.00 83.01 C
+ATOM 3313 O THR L 5 -37.396 -21.454 -86.718 1.00 78.40 O
+ATOM 3314 CB THR L 5 -39.562 -19.512 -86.939 1.00 85.11 C
+ATOM 3315 OG1 THR L 5 -40.286 -18.308 -87.221 1.00 80.78 O
+ATOM 3316 CG2 THR L 5 -40.206 -20.226 -85.758 1.00 90.41 C
+ATOM 3317 H THR L 5 -37.149 -19.265 -88.544 1.00 0.00 H
+ATOM 3318 HA THR L 5 -38.095 -18.398 -85.850 1.00 0.00 H
+ATOM 3319 HB THR L 5 -39.601 -20.161 -87.813 1.00 0.00 H
+ATOM 3320 HG1 THR L 5 -39.694 -17.555 -87.151 1.00 0.00 H
+ATOM 3321 1HG2 THR L 5 -41.241 -20.467 -85.999 1.00 0.00 H
+ATOM 3322 2HG2 THR L 5 -39.659 -21.145 -85.546 1.00 0.00 H
+ATOM 3323 3HG2 THR L 5 -40.179 -19.578 -84.883 1.00 0.00 H
+ATOM 3324 N GLN L 6 -36.683 -20.216 -84.966 1.00 71.40 N
+ATOM 3325 CA GLN L 6 -35.980 -21.307 -84.308 1.00 66.78 C
+ATOM 3326 C GLN L 6 -36.906 -22.049 -83.353 1.00 77.75 C
+ATOM 3327 O GLN L 6 -37.859 -21.483 -82.809 1.00 80.06 O
+ATOM 3328 CB GLN L 6 -34.773 -20.790 -83.530 1.00 65.70 C
+ATOM 3329 CG GLN L 6 -33.614 -20.334 -84.373 1.00 67.71 C
+ATOM 3330 CD GLN L 6 -32.341 -20.228 -83.561 1.00 78.46 C
+ATOM 3331 OE1 GLN L 6 -31.432 -19.479 -83.906 1.00 88.87 O
+ATOM 3332 NE2 GLN L 6 -32.270 -20.985 -82.472 1.00 69.59 N
+ATOM 3333 H GLN L 6 -36.665 -19.297 -84.548 1.00 0.00 H
+ATOM 3334 HA GLN L 6 -35.626 -22.000 -85.071 1.00 0.00 H
+ATOM 3335 1HB GLN L 6 -35.075 -19.948 -82.907 1.00 0.00 H
+ATOM 3336 2HB GLN L 6 -34.406 -21.572 -82.866 1.00 0.00 H
+ATOM 3337 1HG GLN L 6 -33.457 -21.054 -85.176 1.00 0.00 H
+ATOM 3338 2HG GLN L 6 -33.845 -19.354 -84.790 1.00 0.00 H
+ATOM 3339 1HE2 GLN L 6 -31.452 -20.957 -81.895 1.00 0.00 H
+ATOM 3340 2HE2 GLN L 6 -33.033 -21.583 -82.228 1.00 0.00 H
+ATOM 3341 N SER L 7 -36.600 -23.323 -83.137 1.00 69.73 N
+ATOM 3342 CA SER L 7 -37.367 -24.161 -82.229 1.00 76.17 C
+ATOM 3343 C SER L 7 -36.500 -25.307 -81.715 1.00 88.43 C
+ATOM 3344 O SER L 7 -35.856 -26.000 -82.503 1.00 94.01 O
+ATOM 3345 CB SER L 7 -38.616 -24.705 -82.921 1.00 81.96 C
+ATOM 3346 OG SER L 7 -39.375 -25.514 -82.043 1.00 93.63 O
+ATOM 3347 H SER L 7 -35.807 -23.720 -83.621 1.00 0.00 H
+ATOM 3348 HA SER L 7 -37.679 -23.554 -81.378 1.00 0.00 H
+ATOM 3349 1HB SER L 7 -39.228 -23.875 -83.273 1.00 0.00 H
+ATOM 3350 2HB SER L 7 -38.324 -25.288 -83.793 1.00 0.00 H
+ATOM 3351 HG SER L 7 -38.900 -25.517 -81.209 1.00 0.00 H
+ATOM 3352 N PRO L 8 -36.481 -25.513 -80.387 1.00 80.91 N
+ATOM 3353 CA PRO L 8 -37.231 -24.733 -79.401 1.00 81.01 C
+ATOM 3354 C PRO L 8 -36.486 -23.480 -78.967 1.00 81.74 C
+ATOM 3355 O PRO L 8 -35.322 -23.309 -79.324 1.00 75.77 O
+ATOM 3356 CB PRO L 8 -37.371 -25.707 -78.237 1.00 90.73 C
+ATOM 3357 CG PRO L 8 -36.100 -26.488 -78.290 1.00 86.21 C
+ATOM 3358 CD PRO L 8 -35.732 -26.612 -79.752 1.00 77.57 C
+ATOM 3359 HA PRO L 8 -38.214 -24.472 -79.819 1.00 0.00 H
+ATOM 3360 1HB PRO L 8 -37.502 -25.152 -77.296 1.00 0.00 H
+ATOM 3361 2HB PRO L 8 -38.269 -26.328 -78.372 1.00 0.00 H
+ATOM 3362 1HG PRO L 8 -35.314 -25.974 -77.717 1.00 0.00 H
+ATOM 3363 2HG PRO L 8 -36.240 -27.474 -77.823 1.00 0.00 H
+ATOM 3364 1HD PRO L 8 -34.646 -26.482 -79.870 1.00 0.00 H
+ATOM 3365 2HD PRO L 8 -36.048 -27.596 -80.128 1.00 0.00 H
+ATOM 3366 N SER L 9 -37.155 -22.613 -78.204 1.00 87.21 N
+ATOM 3367 CA SER L 9 -36.495 -21.410 -77.711 1.00 89.87 C
+ATOM 3368 C SER L 9 -35.476 -21.738 -76.627 1.00 87.47 C
+ATOM 3369 O SER L 9 -34.445 -21.064 -76.521 1.00 88.69 O
+ATOM 3370 CB SER L 9 -37.538 -20.417 -77.196 1.00106.73 C
+ATOM 3371 OG SER L 9 -38.536 -21.077 -76.436 1.00119.73 O
+ATOM 3372 H SER L 9 -38.121 -22.779 -77.960 1.00 0.00 H
+ATOM 3373 HA SER L 9 -35.948 -20.952 -78.537 1.00 0.00 H
+ATOM 3374 1HB SER L 9 -37.049 -19.662 -76.581 1.00 0.00 H
+ATOM 3375 2HB SER L 9 -37.999 -19.904 -78.039 1.00 0.00 H
+ATOM 3376 HG SER L 9 -38.298 -22.007 -76.437 1.00 0.00 H
+ATOM 3377 N SER L 10 -35.740 -22.765 -75.825 1.00 78.08 N
+ATOM 3378 CA SER L 10 -34.799 -23.222 -74.813 1.00 85.54 C
+ATOM 3379 C SER L 10 -35.061 -24.695 -74.544 1.00 96.99 C
+ATOM 3380 O SER L 10 -36.216 -25.127 -74.496 1.00101.72 O
+ATOM 3381 CB SER L 10 -34.927 -22.421 -73.513 1.00 84.02 C
+ATOM 3382 OG SER L 10 -36.135 -22.737 -72.845 1.00 84.43 O
+ATOM 3383 H SER L 10 -36.625 -23.241 -75.925 1.00 0.00 H
+ATOM 3384 HA SER L 10 -33.786 -23.085 -75.195 1.00 0.00 H
+ATOM 3385 1HB SER L 10 -34.079 -22.641 -72.865 1.00 0.00 H
+ATOM 3386 2HB SER L 10 -34.898 -21.356 -73.738 1.00 0.00 H
+ATOM 3387 HG SER L 10 -36.577 -23.390 -73.392 1.00 0.00 H
+ATOM 3388 N VAL L 11 -33.984 -25.458 -74.367 1.00 95.99 N
+ATOM 3389 CA VAL L 11 -34.090 -26.889 -74.119 1.00 97.19 C
+ATOM 3390 C VAL L 11 -32.891 -27.322 -73.284 1.00 86.98 C
+ATOM 3391 O VAL L 11 -31.813 -26.725 -73.355 1.00 80.92 O
+ATOM 3392 CB VAL L 11 -34.197 -27.677 -75.448 1.00 96.61 C
+ATOM 3393 CG1 VAL L 11 -32.827 -27.894 -76.073 1.00 79.86 C
+ATOM 3394 CG2 VAL L 11 -34.929 -28.994 -75.236 1.00108.68 C
+ATOM 3395 H VAL L 11 -33.069 -25.032 -74.406 1.00 0.00 H
+ATOM 3396 HA VAL L 11 -34.993 -27.073 -73.536 1.00 0.00 H
+ATOM 3397 HB VAL L 11 -34.747 -27.076 -76.173 1.00 0.00 H
+ATOM 3398 1HG1 VAL L 11 -32.936 -28.450 -77.005 1.00 0.00 H
+ATOM 3399 2HG1 VAL L 11 -32.364 -26.929 -76.279 1.00 0.00 H
+ATOM 3400 3HG1 VAL L 11 -32.199 -28.460 -75.385 1.00 0.00 H
+ATOM 3401 1HG2 VAL L 11 -34.993 -29.531 -76.182 1.00 0.00 H
+ATOM 3402 2HG2 VAL L 11 -34.385 -29.600 -74.511 1.00 0.00 H
+ATOM 3403 3HG2 VAL L 11 -35.934 -28.796 -74.862 1.00 0.00 H
+ATOM 3404 N SER L 12 -33.092 -28.356 -72.470 1.00 88.23 N
+ATOM 3405 CA SER L 12 -32.071 -28.839 -71.551 1.00 95.23 C
+ATOM 3406 C SER L 12 -31.772 -30.306 -71.825 1.00 99.18 C
+ATOM 3407 O SER L 12 -32.686 -31.114 -72.019 1.00101.27 O
+ATOM 3408 CB SER L 12 -32.504 -28.657 -70.093 1.00100.72 C
+ATOM 3409 OG SER L 12 -33.644 -29.444 -69.800 1.00106.41 O
+ATOM 3410 H SER L 12 -33.989 -28.819 -72.496 1.00 0.00 H
+ATOM 3411 HA SER L 12 -31.160 -28.261 -71.711 1.00 0.00 H
+ATOM 3412 1HB SER L 12 -31.685 -28.939 -69.432 1.00 0.00 H
+ATOM 3413 2HB SER L 12 -32.727 -27.607 -69.908 1.00 0.00 H
+ATOM 3414 HG SER L 12 -33.863 -29.906 -70.613 1.00 0.00 H
+ATOM 3415 N ALA L 13 -30.485 -30.642 -71.832 1.00 86.01 N
+ATOM 3416 CA ALA L 13 -30.040 -31.992 -72.135 1.00 86.91 C
+ATOM 3417 C ALA L 13 -28.847 -32.338 -71.262 1.00 88.35 C
+ATOM 3418 O ALA L 13 -28.151 -31.461 -70.746 1.00 97.40 O
+ATOM 3419 CB ALA L 13 -29.662 -32.148 -73.613 1.00 89.69 C
+ATOM 3420 H ALA L 13 -29.797 -29.933 -71.619 1.00 0.00 H
+ATOM 3421 HA ALA L 13 -30.861 -32.676 -71.919 1.00 0.00 H
+ATOM 3422 1HB ALA L 13 -29.335 -33.171 -73.799 1.00 0.00 H
+ATOM 3423 2HB ALA L 13 -30.529 -31.926 -74.236 1.00 0.00 H
+ATOM 3424 3HB ALA L 13 -28.855 -31.459 -73.856 1.00 0.00 H
+ATOM 3425 N SER L 14 -28.617 -33.635 -71.108 1.00 90.50 N
+ATOM 3426 CA SER L 14 -27.464 -34.134 -70.380 1.00 92.24 C
+ATOM 3427 C SER L 14 -26.286 -34.332 -71.331 1.00 90.43 C
+ATOM 3428 O SER L 14 -26.420 -34.266 -72.555 1.00102.46 O
+ATOM 3429 CB SER L 14 -27.809 -35.441 -69.667 1.00103.84 C
+ATOM 3430 OG SER L 14 -28.928 -35.269 -68.814 1.00111.90 O
+ATOM 3431 H SER L 14 -29.267 -34.294 -71.512 1.00 0.00 H
+ATOM 3432 HA SER L 14 -27.179 -33.393 -69.632 1.00 0.00 H
+ATOM 3433 1HB SER L 14 -28.024 -36.213 -70.406 1.00 0.00 H
+ATOM 3434 2HB SER L 14 -26.951 -35.775 -69.086 1.00 0.00 H
+ATOM 3435 HG SER L 14 -29.191 -34.350 -68.904 1.00 0.00 H
+ATOM 3436 N VAL L 15 -25.112 -34.569 -70.750 1.00100.58 N
+ATOM 3437 CA VAL L 15 -23.918 -34.805 -71.552 1.00106.54 C
+ATOM 3438 C VAL L 15 -24.010 -36.182 -72.192 1.00115.13 C
+ATOM 3439 O VAL L 15 -24.212 -37.193 -71.506 1.00123.35 O
+ATOM 3440 CB VAL L 15 -22.653 -34.668 -70.692 1.00105.20 C
+ATOM 3441 CG1 VAL L 15 -21.410 -34.929 -71.528 1.00105.17 C
+ATOM 3442 CG2 VAL L 15 -22.591 -33.287 -70.053 1.00 99.21 C
+ATOM 3443 H VAL L 15 -25.040 -34.587 -69.743 1.00 0.00 H
+ATOM 3444 HA VAL L 15 -23.881 -34.058 -72.346 1.00 0.00 H
+ATOM 3445 HB VAL L 15 -22.674 -35.426 -69.909 1.00 0.00 H
+ATOM 3446 1HG1 VAL L 15 -20.523 -34.828 -70.902 1.00 0.00 H
+ATOM 3447 2HG1 VAL L 15 -21.452 -35.938 -71.937 1.00 0.00 H
+ATOM 3448 3HG1 VAL L 15 -21.362 -34.208 -72.343 1.00 0.00 H
+ATOM 3449 1HG2 VAL L 15 -21.689 -33.207 -69.447 1.00 0.00 H
+ATOM 3450 2HG2 VAL L 15 -22.573 -32.526 -70.833 1.00 0.00 H
+ATOM 3451 3HG2 VAL L 15 -23.467 -33.139 -69.421 1.00 0.00 H
+ATOM 3452 N GLY L 16 -23.868 -36.229 -73.514 1.00120.12 N
+ATOM 3453 CA GLY L 16 -23.976 -37.465 -74.256 1.00115.65 C
+ATOM 3454 C GLY L 16 -25.282 -37.655 -74.992 1.00110.93 C
+ATOM 3455 O GLY L 16 -25.490 -38.724 -75.579 1.00126.52 O
+ATOM 3456 H GLY L 16 -23.679 -35.371 -74.012 1.00 0.00 H
+ATOM 3457 1HA GLY L 16 -23.171 -37.521 -74.989 1.00 0.00 H
+ATOM 3458 2HA GLY L 16 -23.852 -38.308 -73.578 1.00 0.00 H
+ATOM 3459 N ASP L 17 -26.166 -36.664 -74.976 1.00 98.91 N
+ATOM 3460 CA ASP L 17 -27.435 -36.731 -75.681 1.00 94.28 C
+ATOM 3461 C ASP L 17 -27.331 -36.069 -77.048 1.00 85.63 C
+ATOM 3462 O ASP L 17 -26.388 -35.326 -77.340 1.00 83.50 O
+ATOM 3463 CB ASP L 17 -28.550 -36.060 -74.874 1.00 88.76 C
+ATOM 3464 CG ASP L 17 -28.818 -36.753 -73.562 1.00113.27 C
+ATOM 3465 OD1 ASP L 17 -28.392 -37.918 -73.402 1.00116.65 O
+ATOM 3466 OD2 ASP L 17 -29.471 -36.135 -72.696 1.00116.67 O
+ATOM 3467 H ASP L 17 -25.939 -35.833 -74.449 1.00 0.00 H
+ATOM 3468 HA ASP L 17 -27.697 -37.780 -75.822 1.00 0.00 H
+ATOM 3469 1HB ASP L 17 -28.281 -35.023 -74.674 1.00 0.00 H
+ATOM 3470 2HB ASP L 17 -29.469 -36.052 -75.460 1.00 0.00 H
+ATOM 3471 N ARG L 18 -28.324 -36.349 -77.885 1.00 85.72 N
+ATOM 3472 CA ARG L 18 -28.479 -35.681 -79.167 1.00 83.11 C
+ATOM 3473 C ARG L 18 -29.462 -34.534 -79.000 1.00 81.34 C
+ATOM 3474 O ARG L 18 -30.540 -34.717 -78.426 1.00 89.83 O
+ATOM 3475 CB ARG L 18 -28.976 -36.654 -80.237 1.00 84.93 C
+ATOM 3476 CG ARG L 18 -29.508 -35.978 -81.496 1.00102.32 C
+ATOM 3477 CD ARG L 18 -29.825 -36.990 -82.585 1.00110.41 C
+ATOM 3478 NE ARG L 18 -28.710 -37.904 -82.805 1.00122.56 N
+ATOM 3479 CZ ARG L 18 -28.555 -38.650 -83.893 1.00135.55 C
+ATOM 3480 NH1 ARG L 18 -29.441 -38.583 -84.877 1.00143.84 N
+ATOM 3481 NH2 ARG L 18 -27.508 -39.457 -83.998 1.00138.21 N
+ATOM 3482 H ARG L 18 -28.994 -37.055 -77.614 1.00 0.00 H
+ATOM 3483 HA ARG L 18 -27.507 -35.297 -79.477 1.00 0.00 H
+ATOM 3484 1HB ARG L 18 -28.164 -37.319 -80.529 1.00 0.00 H
+ATOM 3485 2HB ARG L 18 -29.773 -37.273 -79.824 1.00 0.00 H
+ATOM 3486 1HG ARG L 18 -30.421 -35.433 -81.258 1.00 0.00 H
+ATOM 3487 2HG ARG L 18 -28.760 -35.283 -81.880 1.00 0.00 H
+ATOM 3488 1HD ARG L 18 -30.698 -37.574 -82.296 1.00 0.00 H
+ATOM 3489 2HD ARG L 18 -30.032 -36.467 -83.518 1.00 0.00 H
+ATOM 3490 HE ARG L 18 -28.009 -37.973 -82.080 1.00 0.00 H
+ATOM 3491 1HH1 ARG L 18 -30.236 -37.964 -84.800 1.00 0.00 H
+ATOM 3492 2HH1 ARG L 18 -29.322 -39.151 -85.703 1.00 0.00 H
+ATOM 3493 1HH2 ARG L 18 -26.829 -39.504 -83.251 1.00 0.00 H
+ATOM 3494 2HH2 ARG L 18 -27.389 -40.024 -84.824 1.00 0.00 H
+ATOM 3495 N VAL L 19 -29.090 -33.356 -79.491 1.00 78.39 N
+ATOM 3496 CA VAL L 19 -29.962 -32.188 -79.460 1.00 79.75 C
+ATOM 3497 C VAL L 19 -30.077 -31.628 -80.873 1.00 80.57 C
+ATOM 3498 O VAL L 19 -29.081 -31.536 -81.600 1.00 73.33 O
+ATOM 3499 CB VAL L 19 -29.449 -31.117 -78.471 1.00 87.27 C
+ATOM 3500 CG1 VAL L 19 -28.010 -30.742 -78.777 1.00 96.31 C
+ATOM 3501 CG2 VAL L 19 -30.341 -29.887 -78.501 1.00 82.56 C
+ATOM 3502 H VAL L 19 -28.170 -33.272 -79.899 1.00 0.00 H
+ATOM 3503 HA VAL L 19 -30.953 -32.504 -79.131 1.00 0.00 H
+ATOM 3504 HB VAL L 19 -29.451 -31.535 -77.464 1.00 0.00 H
+ATOM 3505 1HG1 VAL L 19 -27.672 -29.987 -78.067 1.00 0.00 H
+ATOM 3506 2HG1 VAL L 19 -27.378 -31.626 -78.694 1.00 0.00 H
+ATOM 3507 3HG1 VAL L 19 -27.946 -30.342 -79.789 1.00 0.00 H
+ATOM 3508 1HG2 VAL L 19 -29.963 -29.146 -77.797 1.00 0.00 H
+ATOM 3509 2HG2 VAL L 19 -30.345 -29.465 -79.506 1.00 0.00 H
+ATOM 3510 3HG2 VAL L 19 -31.357 -30.167 -78.221 1.00 0.00 H
+ATOM 3511 N THR L 20 -31.300 -31.276 -81.269 1.00 87.28 N
+ATOM 3512 CA THR L 20 -31.580 -30.771 -82.607 1.00 80.14 C
+ATOM 3513 C THR L 20 -32.370 -29.473 -82.512 1.00 71.74 C
+ATOM 3514 O THR L 20 -33.379 -29.403 -81.802 1.00 73.16 O
+ATOM 3515 CB THR L 20 -32.354 -31.800 -83.439 1.00 78.44 C
+ATOM 3516 OG1 THR L 20 -33.597 -32.103 -82.794 1.00 89.51 O
+ATOM 3517 CG2 THR L 20 -31.545 -33.079 -83.589 1.00 79.18 C
+ATOM 3518 H THR L 20 -32.059 -31.366 -80.608 1.00 0.00 H
+ATOM 3519 HA THR L 20 -30.632 -30.571 -83.107 1.00 0.00 H
+ATOM 3520 HB THR L 20 -32.560 -31.388 -84.427 1.00 0.00 H
+ATOM 3521 HG1 THR L 20 -33.669 -31.593 -81.983 1.00 0.00 H
+ATOM 3522 1HG2 THR L 20 -32.109 -33.799 -84.182 1.00 0.00 H
+ATOM 3523 2HG2 THR L 20 -30.602 -32.856 -84.088 1.00 0.00 H
+ATOM 3524 3HG2 THR L 20 -31.344 -33.500 -82.605 1.00 0.00 H
+ATOM 3525 N ILE L 21 -31.906 -28.454 -83.229 1.00 69.39 N
+ATOM 3526 CA ILE L 21 -32.559 -27.153 -83.300 1.00 73.03 C
+ATOM 3527 C ILE L 21 -33.055 -26.956 -84.724 1.00 74.43 C
+ATOM 3528 O ILE L 21 -32.273 -27.053 -85.678 1.00 78.84 O
+ATOM 3529 CB ILE L 21 -31.602 -26.022 -82.888 1.00 72.07 C
+ATOM 3530 CG1 ILE L 21 -31.028 -26.296 -81.497 1.00 67.55 C
+ATOM 3531 CG2 ILE L 21 -32.316 -24.676 -82.923 1.00 74.79 C
+ATOM 3532 CD1 ILE L 21 -29.979 -25.297 -81.064 1.00 66.29 C
+ATOM 3533 H ILE L 21 -31.053 -28.605 -83.748 1.00 0.00 H
+ATOM 3534 HA ILE L 21 -33.403 -27.152 -82.612 1.00 0.00 H
+ATOM 3535 HB ILE L 21 -30.758 -25.991 -83.576 1.00 0.00 H
+ATOM 3536 1HG1 ILE L 21 -31.833 -26.287 -80.763 1.00 0.00 H
+ATOM 3537 2HG1 ILE L 21 -30.581 -27.290 -81.477 1.00 0.00 H
+ATOM 3538 1HG2 ILE L 21 -31.623 -23.889 -82.628 1.00 0.00 H
+ATOM 3539 2HG2 ILE L 21 -32.677 -24.482 -83.932 1.00 0.00 H
+ATOM 3540 3HG2 ILE L 21 -33.160 -24.694 -82.233 1.00 0.00 H
+ATOM 3541 1HD1 ILE L 21 -29.618 -25.556 -80.068 1.00 0.00 H
+ATOM 3542 2HD1 ILE L 21 -29.146 -25.315 -81.768 1.00 0.00 H
+ATOM 3543 3HD1 ILE L 21 -30.414 -24.299 -81.043 1.00 0.00 H
+ATOM 3544 N THR L 22 -34.348 -26.689 -84.871 1.00 81.57 N
+ATOM 3545 CA THR L 22 -34.961 -26.514 -86.180 1.00 85.29 C
+ATOM 3546 C THR L 22 -35.108 -25.033 -86.495 1.00 87.09 C
+ATOM 3547 O THR L 22 -35.432 -24.228 -85.619 1.00 94.85 O
+ATOM 3548 CB THR L 22 -36.331 -27.192 -86.251 1.00 76.59 C
+ATOM 3549 OG1 THR L 22 -37.216 -26.592 -85.297 1.00 89.65 O
+ATOM 3550 CG2 THR L 22 -36.206 -28.675 -85.952 1.00 72.99 C
+ATOM 3551 H THR L 22 -34.922 -26.605 -84.044 1.00 0.00 H
+ATOM 3552 HA THR L 22 -34.315 -26.973 -86.929 1.00 0.00 H
+ATOM 3553 HB THR L 22 -36.750 -27.062 -87.249 1.00 0.00 H
+ATOM 3554 HG1 THR L 22 -36.752 -25.897 -84.824 1.00 0.00 H
+ATOM 3555 1HG2 THR L 22 -37.189 -29.141 -86.007 1.00 0.00 H
+ATOM 3556 2HG2 THR L 22 -35.543 -29.139 -86.682 1.00 0.00 H
+ATOM 3557 3HG2 THR L 22 -35.796 -28.811 -84.952 1.00 0.00 H
+ATOM 3558 N CYS L 23 -34.866 -24.681 -87.753 1.00 82.58 N
+ATOM 3559 CA CYS L 23 -35.025 -23.317 -88.232 1.00 85.77 C
+ATOM 3560 C CYS L 23 -35.965 -23.322 -89.426 1.00 89.10 C
+ATOM 3561 O CYS L 23 -35.814 -24.143 -90.338 1.00 99.99 O
+ATOM 3562 CB CYS L 23 -33.677 -22.699 -88.613 1.00108.73 C
+ATOM 3563 SG CYS L 23 -33.700 -20.896 -88.718 1.00133.45 S
+ATOM 3564 H CYS L 23 -34.559 -25.396 -88.397 1.00 0.00 H
+ATOM 3565 HA CYS L 23 -35.461 -22.718 -87.432 1.00 0.00 H
+ATOM 3566 1HB CYS L 23 -32.924 -22.986 -87.878 1.00 0.00 H
+ATOM 3567 2HB CYS L 23 -33.357 -23.090 -89.579 1.00 0.00 H
+ATOM 3568 N ARG L 24 -36.932 -22.410 -89.411 1.00 81.94 N
+ATOM 3569 CA ARG L 24 -37.946 -22.290 -90.450 1.00 80.70 C
+ATOM 3570 C ARG L 24 -37.804 -20.930 -91.116 1.00 87.71 C
+ATOM 3571 O ARG L 24 -37.831 -19.896 -90.435 1.00101.92 O
+ATOM 3572 CB ARG L 24 -39.349 -22.450 -89.861 1.00 97.47 C
+ATOM 3573 CG ARG L 24 -40.478 -22.072 -90.803 1.00118.61 C
+ATOM 3574 CD ARG L 24 -40.873 -23.235 -91.692 1.00142.08 C
+ATOM 3575 NE ARG L 24 -41.448 -24.331 -90.919 1.00157.23 N
+ATOM 3576 CZ ARG L 24 -41.919 -25.455 -91.451 1.00168.61 C
+ATOM 3577 NH1 ARG L 24 -41.883 -25.634 -92.765 1.00169.17 N
+ATOM 3578 NH2 ARG L 24 -42.425 -26.400 -90.671 1.00175.02 N
+ATOM 3579 H ARG L 24 -36.951 -21.772 -88.629 1.00 0.00 H
+ATOM 3580 HA ARG L 24 -37.786 -23.082 -91.183 1.00 0.00 H
+ATOM 3581 1HB ARG L 24 -39.501 -23.485 -89.560 1.00 0.00 H
+ATOM 3582 2HB ARG L 24 -39.441 -21.832 -88.968 1.00 0.00 H
+ATOM 3583 1HG ARG L 24 -41.350 -21.770 -90.223 1.00 0.00 H
+ATOM 3584 2HG ARG L 24 -40.160 -21.245 -91.439 1.00 0.00 H
+ATOM 3585 1HD ARG L 24 -41.613 -22.902 -92.419 1.00 0.00 H
+ATOM 3586 2HD ARG L 24 -39.993 -23.608 -92.215 1.00 0.00 H
+ATOM 3587 HE ARG L 24 -41.490 -24.226 -89.914 1.00 0.00 H
+ATOM 3588 1HH1 ARG L 24 -41.498 -24.916 -93.362 1.00 0.00 H
+ATOM 3589 2HH1 ARG L 24 -42.241 -26.488 -93.168 1.00 0.00 H
+ATOM 3590 1HH2 ARG L 24 -42.453 -26.267 -89.669 1.00 0.00 H
+ATOM 3591 2HH2 ARG L 24 -42.782 -27.252 -91.077 1.00 0.00 H
+ATOM 3592 N ALA L 25 -37.652 -20.933 -92.439 1.00 79.09 N
+ATOM 3593 CA ALA L 25 -37.464 -19.715 -93.214 1.00 70.74 C
+ATOM 3594 C ALA L 25 -38.794 -19.239 -93.780 1.00 76.42 C
+ATOM 3595 O ALA L 25 -39.617 -20.046 -94.223 1.00 83.71 O
+ATOM 3596 CB ALA L 25 -36.464 -19.935 -94.350 1.00 63.89 C
+ATOM 3597 H ALA L 25 -37.669 -21.823 -92.917 1.00 0.00 H
+ATOM 3598 HA ALA L 25 -37.069 -18.947 -92.548 1.00 0.00 H
+ATOM 3599 1HB ALA L 25 -36.343 -19.009 -94.912 1.00 0.00 H
+ATOM 3600 2HB ALA L 25 -35.502 -20.236 -93.935 1.00 0.00 H
+ATOM 3601 3HB ALA L 25 -36.833 -20.716 -95.013 1.00 0.00 H
+ATOM 3602 N SER L 26 -38.999 -17.920 -93.756 1.00 76.12 N
+ATOM 3603 CA SER L 26 -40.223 -17.344 -94.302 1.00 75.35 C
+ATOM 3604 C SER L 26 -40.345 -17.643 -95.792 1.00 89.67 C
+ATOM 3605 O SER L 26 -41.406 -18.059 -96.272 1.00 83.71 O
+ATOM 3606 CB SER L 26 -40.243 -15.836 -94.044 1.00 70.81 C
+ATOM 3607 OG SER L 26 -41.315 -15.204 -94.719 1.00 91.02 O
+ATOM 3608 H SER L 26 -38.303 -17.307 -93.357 1.00 0.00 H
+ATOM 3609 HA SER L 26 -41.076 -17.802 -93.799 1.00 0.00 H
+ATOM 3610 1HB SER L 26 -40.332 -15.651 -92.974 1.00 0.00 H
+ATOM 3611 2HB SER L 26 -39.302 -15.398 -94.374 1.00 0.00 H
+ATOM 3612 HG SER L 26 -41.780 -15.901 -95.188 1.00 0.00 H
+ATOM 3613 N GLN L 27 -39.262 -17.443 -96.533 1.00 87.26 N
+ATOM 3614 CA GLN L 27 -39.192 -17.713 -97.958 1.00 82.23 C
+ATOM 3615 C GLN L 27 -38.092 -18.734 -98.215 1.00 81.50 C
+ATOM 3616 O GLN L 27 -37.248 -19.000 -97.355 1.00 84.27 O
+ATOM 3617 CB GLN L 27 -38.924 -16.426 -98.749 1.00 86.28 C
+ATOM 3618 CG GLN L 27 -39.743 -15.235 -98.283 1.00106.33 C
+ATOM 3619 CD GLN L 27 -39.295 -13.932 -98.915 1.00129.46 C
+ATOM 3620 OE1 GLN L 27 -38.710 -13.921 -99.999 1.00128.12 O
+ATOM 3621 NE2 GLN L 27 -39.561 -12.822 -98.232 1.00141.28 N
+ATOM 3622 H GLN L 27 -38.446 -17.081 -96.060 1.00 0.00 H
+ATOM 3623 HA GLN L 27 -40.150 -18.121 -98.280 1.00 0.00 H
+ATOM 3624 1HB GLN L 27 -37.869 -16.164 -98.670 1.00 0.00 H
+ATOM 3625 2HB GLN L 27 -39.141 -16.595 -99.804 1.00 0.00 H
+ATOM 3626 1HG GLN L 27 -40.787 -15.399 -98.549 1.00 0.00 H
+ATOM 3627 2HG GLN L 27 -39.643 -15.139 -97.202 1.00 0.00 H
+ATOM 3628 1HE2 GLN L 27 -39.289 -11.931 -98.599 1.00 0.00 H
+ATOM 3629 2HE2 GLN L 27 -40.033 -12.877 -97.352 1.00 0.00 H
+ATOM 3630 N GLY L 28 -38.107 -19.310 -99.414 1.00 77.48 N
+ATOM 3631 CA GLY L 28 -37.069 -20.243 -99.802 1.00 79.14 C
+ATOM 3632 C GLY L 28 -35.727 -19.543 -99.881 1.00 82.37 C
+ATOM 3633 O GLY L 28 -35.552 -18.612-100.685 1.00 94.54 O
+ATOM 3634 H GLY L 28 -38.848 -19.099-100.067 1.00 0.00 H
+ATOM 3635 1HA GLY L 28 -37.023 -21.058 -99.079 1.00 0.00 H
+ATOM 3636 2HA GLY L 28 -37.318 -20.683-100.767 1.00 0.00 H
+ATOM 3637 N ILE L 29 -34.775 -19.960 -99.048 1.00 68.39 N
+ATOM 3638 CA ILE L 29 -33.436 -19.387 -99.043 1.00 65.85 C
+ATOM 3639 C ILE L 29 -32.416 -20.337 -99.651 1.00 79.40 C
+ATOM 3640 O ILE L 29 -31.212 -20.057 -99.609 1.00 81.22 O
+ATOM 3641 CB ILE L 29 -33.004 -19.022 -97.611 1.00 75.04 C
+ATOM 3642 CG1 ILE L 29 -32.927 -20.278 -96.740 1.00 76.88 C
+ATOM 3643 CG2 ILE L 29 -33.964 -18.009 -97.007 1.00 75.92 C
+ATOM 3644 CD1 ILE L 29 -32.282 -20.048 -95.392 1.00 0.00 C
+ATOM 3645 H ILE L 29 -34.995 -20.701 -98.398 1.00 0.00 H
+ATOM 3646 HA ILE L 29 -33.437 -18.501 -99.677 1.00 0.00 H
+ATOM 3647 HB ILE L 29 -32.003 -18.592 -97.632 1.00 0.00 H
+ATOM 3648 1HG1 ILE L 29 -33.931 -20.669 -96.575 1.00 0.00 H
+ATOM 3649 2HG1 ILE L 29 -32.359 -21.049 -97.262 1.00 0.00 H
+ATOM 3650 1HG2 ILE L 29 -33.644 -17.763 -95.995 1.00 0.00 H
+ATOM 3651 2HG2 ILE L 29 -33.970 -17.106 -97.616 1.00 0.00 H
+ATOM 3652 3HG2 ILE L 29 -34.968 -18.433 -96.977 1.00 0.00 H
+ATOM 3653 1HD1 ILE L 29 -32.263 -20.984 -94.833 1.00 0.00 H
+ATOM 3654 2HD1 ILE L 29 -31.261 -19.690 -95.534 1.00 0.00 H
+ATOM 3655 3HD1 ILE L 29 -32.853 -19.306 -94.837 1.00 0.00 H
+ATOM 3656 N SER L 30 -32.872 -21.454-100.227 1.00 79.44 N
+ATOM 3657 CA SER L 30 -32.007 -22.493-100.794 1.00 72.75 C
+ATOM 3658 C SER L 30 -31.131 -23.037 -99.673 1.00 74.59 C
+ATOM 3659 O SER L 30 -31.681 -23.556 -98.685 1.00 81.71 O
+ATOM 3660 CB SER L 30 -31.259 -21.925-101.999 1.00 77.76 C
+ATOM 3661 OG SER L 30 -30.204 -22.788-102.391 1.00 86.45 O
+ATOM 3662 H SER L 30 -33.874 -21.573-100.265 1.00 0.00 H
+ATOM 3663 HA SER L 30 -32.633 -23.325-101.120 1.00 0.00 H
+ATOM 3664 1HB SER L 30 -31.953 -21.792-102.828 1.00 0.00 H
+ATOM 3665 2HB SER L 30 -30.858 -20.944-101.748 1.00 0.00 H
+ATOM 3666 HG SER L 30 -30.229 -23.530-101.782 1.00 0.00 H
+ATOM 3667 N ASN L 31 -29.805 -22.956 -99.767 1.00 63.43 N
+ATOM 3668 CA ASN L 31 -28.910 -23.404 -98.710 1.00 62.43 C
+ATOM 3669 C ASN L 31 -28.085 -22.246 -98.161 1.00 74.58 C
+ATOM 3670 O ASN L 31 -26.982 -22.443 -97.647 1.00 82.63 O
+ATOM 3671 CB ASN L 31 -28.002 -24.529 -99.205 1.00 71.58 C
+ATOM 3672 CG ASN L 31 -26.951 -24.045-100.183 1.00 82.27 C
+ATOM 3673 OD1 ASN L 31 -27.133 -23.038-100.868 1.00 91.02 O
+ATOM 3674 ND2 ASN L 31 -25.832 -24.754-100.237 1.00 76.63 N
+ATOM 3675 H ASN L 31 -29.412 -22.566-100.612 1.00 0.00 H
+ATOM 3676 HA ASN L 31 -29.513 -23.785 -97.884 1.00 0.00 H
+ATOM 3677 1HB ASN L 31 -27.502 -24.994 -98.354 1.00 0.00 H
+ATOM 3678 2HB ASN L 31 -28.605 -25.297 -99.690 1.00 0.00 H
+ATOM 3679 1HD2 ASN L 31 -25.099 -24.485-100.863 1.00 0.00 H
+ATOM 3680 2HD2 ASN L 31 -25.720 -25.557 -99.652 1.00 0.00 H
+ATOM 3681 N TRP L 32 -28.611 -21.026 -98.268 1.00 62.29 N
+ATOM 3682 CA TRP L 32 -27.938 -19.843 -97.736 1.00 62.71 C
+ATOM 3683 C TRP L 32 -28.350 -19.665 -96.280 1.00 67.51 C
+ATOM 3684 O TRP L 32 -29.172 -18.816 -95.926 1.00 74.06 O
+ATOM 3685 CB TRP L 32 -28.268 -18.618 -98.574 1.00 63.42 C
+ATOM 3686 CG TRP L 32 -27.599 -18.668 -99.884 1.00 65.05 C
+ATOM 3687 CD1 TRP L 32 -28.130 -19.109-101.058 1.00 62.64 C
+ATOM 3688 CD2 TRP L 32 -26.246 -18.306-100.161 1.00 57.53 C
+ATOM 3689 NE1 TRP L 32 -27.193 -19.024-102.058 1.00 67.85 N
+ATOM 3690 CE2 TRP L 32 -26.026 -18.535-101.531 1.00 65.87 C
+ATOM 3691 CE3 TRP L 32 -25.200 -17.801 -99.385 1.00 69.57 C
+ATOM 3692 CZ2 TRP L 32 -24.805 -18.278-102.142 1.00 69.24 C
+ATOM 3693 CZ3 TRP L 32 -23.990 -17.545 -99.991 1.00 82.32 C
+ATOM 3694 CH2 TRP L 32 -23.802 -17.781-101.358 1.00 84.55 C
+ATOM 3695 H TRP L 32 -29.502 -20.918 -98.731 1.00 0.00 H
+ATOM 3696 HA TRP L 32 -26.862 -20.011 -97.775 1.00 0.00 H
+ATOM 3697 1HB TRP L 32 -29.347 -18.556 -98.719 1.00 0.00 H
+ATOM 3698 2HB TRP L 32 -27.958 -17.719 -98.042 1.00 0.00 H
+ATOM 3699 HD1 TRP L 32 -29.148 -19.475-101.183 1.00 0.00 H
+ATOM 3700 HE1 TRP L 32 -27.338 -19.280-103.024 1.00 0.00 H
+ATOM 3701 HE3 TRP L 32 -25.341 -17.611 -98.321 1.00 0.00 H
+ATOM 3702 HZ2 TRP L 32 -24.639 -18.459-103.204 1.00 0.00 H
+ATOM 3703 HZ3 TRP L 32 -23.179 -17.153 -99.377 1.00 0.00 H
+ATOM 3704 HH2 TRP L 32 -22.832 -17.563-101.805 1.00 0.00 H
+ATOM 3705 N LEU L 33 -27.759 -20.494 -95.423 1.00 61.30 N
+ATOM 3706 CA LEU L 33 -28.079 -20.483 -94.004 1.00 62.49 C
+ATOM 3707 C LEU L 33 -26.836 -20.849 -93.206 1.00 73.27 C
+ATOM 3708 O LEU L 33 -26.079 -21.743 -93.595 1.00 75.78 O
+ATOM 3709 CB LEU L 33 -29.223 -21.452 -93.687 1.00 57.50 C
+ATOM 3710 CG LEU L 33 -29.637 -21.538 -92.221 1.00 66.36 C
+ATOM 3711 CD1 LEU L 33 -31.139 -21.520 -92.100 1.00 66.00 C
+ATOM 3712 CD2 LEU L 33 -29.075 -22.791 -91.577 1.00 88.56 C
+ATOM 3713 H LEU L 33 -27.070 -21.148 -95.767 1.00 0.00 H
+ATOM 3714 HA LEU L 33 -28.396 -19.478 -93.729 1.00 0.00 H
+ATOM 3715 1HB LEU L 33 -30.100 -21.153 -94.260 1.00 0.00 H
+ATOM 3716 2HB LEU L 33 -28.930 -22.452 -94.006 1.00 0.00 H
+ATOM 3717 HG LEU L 33 -29.259 -20.667 -91.685 1.00 0.00 H
+ATOM 3718 1HD1 LEU L 33 -31.420 -21.582 -91.049 1.00 0.00 H
+ATOM 3719 2HD1 LEU L 33 -31.527 -20.594 -92.525 1.00 0.00 H
+ATOM 3720 3HD1 LEU L 33 -31.557 -22.370 -92.638 1.00 0.00 H
+ATOM 3721 1HD2 LEU L 33 -29.382 -22.832 -90.531 1.00 0.00 H
+ATOM 3722 2HD2 LEU L 33 -29.452 -23.670 -92.100 1.00 0.00 H
+ATOM 3723 3HD2 LEU L 33 -27.987 -22.773 -91.635 1.00 0.00 H
+ATOM 3724 N ALA L 34 -26.638 -20.155 -92.088 1.00 72.73 N
+ATOM 3725 CA ALA L 34 -25.521 -20.409 -91.193 1.00 66.22 C
+ATOM 3726 C ALA L 34 -26.037 -20.599 -89.775 1.00 63.42 C
+ATOM 3727 O ALA L 34 -27.090 -20.070 -89.403 1.00 68.91 O
+ATOM 3728 CB ALA L 34 -24.499 -19.261 -91.227 1.00 59.13 C
+ATOM 3729 H ALA L 34 -27.295 -19.423 -91.859 1.00 0.00 H
+ATOM 3730 HA ALA L 34 -25.024 -21.321 -91.523 1.00 0.00 H
+ATOM 3731 1HB ALA L 34 -23.678 -19.485 -90.546 1.00 0.00 H
+ATOM 3732 2HB ALA L 34 -24.111 -19.149 -92.239 1.00 0.00 H
+ATOM 3733 3HB ALA L 34 -24.982 -18.335 -90.920 1.00 0.00 H
+ATOM 3734 N TRP L 35 -25.286 -21.365 -88.988 1.00 65.55 N
+ATOM 3735 CA TRP L 35 -25.554 -21.560 -87.571 1.00 60.36 C
+ATOM 3736 C TRP L 35 -24.424 -20.952 -86.754 1.00 56.47 C
+ATOM 3737 O TRP L 35 -23.252 -21.045 -87.135 1.00 72.47 O
+ATOM 3738 CB TRP L 35 -25.704 -23.047 -87.235 1.00 70.67 C
+ATOM 3739 CG TRP L 35 -26.981 -23.644 -87.732 1.00 71.52 C
+ATOM 3740 CD1 TRP L 35 -27.157 -24.368 -88.872 1.00 64.76 C
+ATOM 3741 CD2 TRP L 35 -28.264 -23.577 -87.098 1.00 59.31 C
+ATOM 3742 NE1 TRP L 35 -28.469 -24.751 -88.992 1.00 71.31 N
+ATOM 3743 CE2 TRP L 35 -29.170 -24.277 -87.915 1.00 60.17 C
+ATOM 3744 CE3 TRP L 35 -28.733 -22.989 -85.920 1.00 59.66 C
+ATOM 3745 CZ2 TRP L 35 -30.519 -24.408 -87.594 1.00 61.29 C
+ATOM 3746 CZ3 TRP L 35 -30.072 -23.120 -85.601 1.00 66.79 C
+ATOM 3747 CH2 TRP L 35 -30.949 -23.824 -86.435 1.00 68.54 C
+ATOM 3748 H TRP L 35 -24.493 -21.829 -89.407 1.00 0.00 H
+ATOM 3749 HA TRP L 35 -26.489 -21.057 -87.323 1.00 0.00 H
+ATOM 3750 1HB TRP L 35 -24.873 -23.604 -87.669 1.00 0.00 H
+ATOM 3751 2HB TRP L 35 -25.660 -23.182 -86.155 1.00 0.00 H
+ATOM 3752 HD1 TRP L 35 -26.370 -24.608 -89.585 1.00 0.00 H
+ATOM 3753 HE1 TRP L 35 -28.857 -25.293 -89.751 1.00 0.00 H
+ATOM 3754 HE3 TRP L 35 -28.056 -22.441 -85.265 1.00 0.00 H
+ATOM 3755 HZ2 TRP L 35 -31.216 -24.953 -88.231 1.00 0.00 H
+ATOM 3756 HZ3 TRP L 35 -30.429 -22.659 -84.680 1.00 0.00 H
+ATOM 3757 HH2 TRP L 35 -31.999 -23.906 -86.151 1.00 0.00 H
+ATOM 3758 N PHE L 36 -24.777 -20.327 -85.635 1.00 61.79 N
+ATOM 3759 CA PHE L 36 -23.812 -19.666 -84.769 1.00 61.61 C
+ATOM 3760 C PHE L 36 -23.906 -20.212 -83.352 1.00 65.28 C
+ATOM 3761 O PHE L 36 -24.999 -20.508 -82.860 1.00 59.41 O
+ATOM 3762 CB PHE L 36 -24.033 -18.152 -84.745 1.00 62.18 C
+ATOM 3763 CG PHE L 36 -23.470 -17.443 -85.936 1.00 68.88 C
+ATOM 3764 CD1 PHE L 36 -22.131 -17.099 -85.980 1.00 78.77 C
+ATOM 3765 CD2 PHE L 36 -24.281 -17.112 -87.009 1.00 58.08 C
+ATOM 3766 CE1 PHE L 36 -21.606 -16.444 -87.075 1.00 75.98 C
+ATOM 3767 CE2 PHE L 36 -23.763 -16.457 -88.105 1.00 66.14 C
+ATOM 3768 CZ PHE L 36 -22.423 -16.121 -88.140 1.00 75.51 C
+ATOM 3769 H PHE L 36 -25.755 -20.314 -85.382 1.00 0.00 H
+ATOM 3770 HA PHE L 36 -22.810 -19.859 -85.156 1.00 0.00 H
+ATOM 3771 1HB PHE L 36 -25.100 -17.941 -84.696 1.00 0.00 H
+ATOM 3772 2HB PHE L 36 -23.575 -17.732 -83.850 1.00 0.00 H
+ATOM 3773 HD1 PHE L 36 -21.488 -17.352 -85.136 1.00 0.00 H
+ATOM 3774 HD2 PHE L 36 -25.339 -17.376 -86.982 1.00 0.00 H
+ATOM 3775 HE1 PHE L 36 -20.548 -16.183 -87.098 1.00 0.00 H
+ATOM 3776 HE2 PHE L 36 -24.410 -16.203 -88.944 1.00 0.00 H
+ATOM 3777 HZ PHE L 36 -22.013 -15.601 -89.005 1.00 0.00 H
+ATOM 3778 N GLN L 37 -22.753 -20.343 -82.704 1.00 83.39 N
+ATOM 3779 CA GLN L 37 -22.662 -20.646 -81.281 1.00 79.36 C
+ATOM 3780 C GLN L 37 -22.246 -19.369 -80.571 1.00 64.52 C
+ATOM 3781 O GLN L 37 -21.224 -18.770 -80.920 1.00 75.30 O
+ATOM 3782 CB GLN L 37 -21.655 -21.768 -81.015 1.00 82.48 C
+ATOM 3783 CG GLN L 37 -21.369 -22.056 -79.541 1.00 64.12 C
+ATOM 3784 CD GLN L 37 -20.184 -22.993 -79.342 1.00 74.86 C
+ATOM 3785 OE1 GLN L 37 -19.827 -23.327 -78.218 1.00 98.74 O
+ATOM 3786 NE2 GLN L 37 -19.566 -23.412 -80.436 1.00 74.46 N
+ATOM 3787 H GLN L 37 -21.903 -20.224 -83.237 1.00 0.00 H
+ATOM 3788 HA GLN L 37 -23.641 -20.977 -80.935 1.00 0.00 H
+ATOM 3789 1HB GLN L 37 -22.015 -22.694 -81.463 1.00 0.00 H
+ATOM 3790 2HB GLN L 37 -20.704 -21.523 -81.489 1.00 0.00 H
+ATOM 3791 1HG GLN L 37 -21.147 -21.117 -79.034 1.00 0.00 H
+ATOM 3792 2HG GLN L 37 -22.248 -22.522 -79.095 1.00 0.00 H
+ATOM 3793 1HE2 GLN L 37 -18.781 -24.029 -80.363 1.00 0.00 H
+ATOM 3794 2HE2 GLN L 37 -19.883 -23.112 -81.336 1.00 0.00 H
+ATOM 3795 N HIS L 38 -23.035 -18.947 -79.591 1.00 64.01 N
+ATOM 3796 CA HIS L 38 -22.777 -17.707 -78.872 1.00 70.68 C
+ATOM 3797 C HIS L 38 -22.671 -18.003 -77.385 1.00 76.79 C
+ATOM 3798 O HIS L 38 -23.610 -18.538 -76.782 1.00 76.17 O
+ATOM 3799 CB HIS L 38 -23.870 -16.673 -79.139 1.00 64.06 C
+ATOM 3800 CG HIS L 38 -23.489 -15.285 -78.737 1.00 65.24 C
+ATOM 3801 ND1 HIS L 38 -24.412 -14.274 -78.578 1.00 78.14 N
+ATOM 3802 CD2 HIS L 38 -22.280 -14.739 -78.469 1.00 66.02 C
+ATOM 3803 CE1 HIS L 38 -23.786 -13.164 -78.229 1.00 80.75 C
+ATOM 3804 NE2 HIS L 38 -22.493 -13.420 -78.157 1.00 78.83 N
+ATOM 3805 H HIS L 38 -23.838 -19.504 -79.338 1.00 0.00 H
+ATOM 3806 HA HIS L 38 -21.830 -17.283 -79.206 1.00 0.00 H
+ATOM 3807 1HB HIS L 38 -24.114 -16.667 -80.202 1.00 0.00 H
+ATOM 3808 2HB HIS L 38 -24.774 -16.951 -78.597 1.00 0.00 H
+ATOM 3809 HD2 HIS L 38 -21.317 -15.250 -78.497 1.00 0.00 H
+ATOM 3810 HE1 HIS L 38 -24.257 -12.201 -78.033 1.00 0.00 H
+ATOM 3811 HE2 HIS L 38 -21.772 -12.756 -77.912 1.00 0.00 H
+ATOM 3812 N LYS L 39 -21.526 -17.660 -76.805 1.00 85.57 N
+ATOM 3813 CA LYS L 39 -21.228 -17.771 -75.389 1.00 85.69 C
+ATOM 3814 C LYS L 39 -21.039 -16.383 -74.790 1.00 91.33 C
+ATOM 3815 O LYS L 39 -20.633 -15.448 -75.488 1.00 95.66 O
+ATOM 3816 CB LYS L 39 -19.963 -18.605 -75.150 1.00 71.37 C
+ATOM 3817 CG LYS L 39 -20.167 -20.092 -75.367 1.00 74.08 C
+ATOM 3818 CD LYS L 39 -18.851 -20.848 -75.316 1.00 73.32 C
+ATOM 3819 CE LYS L 39 -19.081 -22.352 -75.313 1.00 71.79 C
+ATOM 3820 NZ LYS L 39 -17.814 -23.133 -75.412 1.00 86.13 N
+ATOM 3821 H LYS L 39 -20.821 -17.294 -77.429 1.00 0.00 H
+ATOM 3822 HA LYS L 39 -22.064 -18.270 -74.898 1.00 0.00 H
+ATOM 3823 1HB LYS L 39 -19.172 -18.267 -75.820 1.00 0.00 H
+ATOM 3824 2HB LYS L 39 -19.614 -18.453 -74.128 1.00 0.00 H
+ATOM 3825 1HG LYS L 39 -20.830 -20.485 -74.595 1.00 0.00 H
+ATOM 3826 2HG LYS L 39 -20.632 -20.257 -76.339 1.00 0.00 H
+ATOM 3827 1HD LYS L 39 -18.244 -20.581 -76.182 1.00 0.00 H
+ATOM 3828 2HD LYS L 39 -18.306 -20.570 -74.414 1.00 0.00 H
+ATOM 3829 1HE LYS L 39 -19.590 -22.640 -74.394 1.00 0.00 H
+ATOM 3830 2HE LYS L 39 -19.717 -22.624 -76.155 1.00 0.00 H
+ATOM 3831 1HZ LYS L 39 -18.025 -24.121 -75.406 1.00 0.00 H
+ATOM 3832 2HZ LYS L 39 -17.338 -22.896 -76.271 1.00 0.00 H
+ATOM 3833 3HZ LYS L 39 -17.219 -22.912 -74.626 1.00 0.00 H
+ATOM 3834 N PRO L 40 -21.330 -16.214 -73.503 1.00 95.66 N
+ATOM 3835 CA PRO L 40 -21.262 -14.874 -72.910 1.00 99.90 C
+ATOM 3836 C PRO L 40 -19.846 -14.320 -72.919 1.00 99.15 C
+ATOM 3837 O PRO L 40 -18.871 -15.036 -72.675 1.00 78.83 O
+ATOM 3838 CB PRO L 40 -21.772 -15.095 -71.483 1.00 80.88 C
+ATOM 3839 CG PRO L 40 -21.539 -16.544 -71.220 1.00 80.59 C
+ATOM 3840 CD PRO L 40 -21.757 -17.229 -72.528 1.00 89.19 C
+ATOM 3841 HA PRO L 40 -21.930 -14.199 -73.465 1.00 0.00 H
+ATOM 3842 1HB PRO L 40 -21.226 -14.445 -70.783 1.00 0.00 H
+ATOM 3843 2HB PRO L 40 -22.835 -14.818 -71.416 1.00 0.00 H
+ATOM 3844 1HG PRO L 40 -20.520 -16.701 -70.836 1.00 0.00 H
+ATOM 3845 2HG PRO L 40 -22.230 -16.905 -70.444 1.00 0.00 H
+ATOM 3846 1HD PRO L 40 -21.132 -18.132 -72.578 1.00 0.00 H
+ATOM 3847 2HD PRO L 40 -22.821 -17.487 -72.634 1.00 0.00 H
+ATOM 3848 N GLY L 41 -19.744 -13.024 -73.213 1.00 95.98 N
+ATOM 3849 CA GLY L 41 -18.488 -12.312 -73.146 1.00102.95 C
+ATOM 3850 C GLY L 41 -17.658 -12.345 -74.406 1.00100.34 C
+ATOM 3851 O GLY L 41 -16.621 -11.674 -74.462 1.00106.29 O
+ATOM 3852 H GLY L 41 -20.577 -12.526 -73.492 1.00 0.00 H
+ATOM 3853 1HA GLY L 41 -18.675 -11.266 -72.904 1.00 0.00 H
+ATOM 3854 2HA GLY L 41 -17.879 -12.723 -72.342 1.00 0.00 H
+ATOM 3855 N LYS L 42 -18.075 -13.095 -75.417 1.00102.59 N
+ATOM 3856 CA LYS L 42 -17.321 -13.215 -76.650 1.00100.61 C
+ATOM 3857 C LYS L 42 -18.263 -13.074 -77.837 1.00 89.72 C
+ATOM 3858 O LYS L 42 -19.489 -13.136 -77.703 1.00 86.00 O
+ATOM 3859 CB LYS L 42 -16.578 -14.551 -76.707 1.00 92.93 C
+ATOM 3860 CG LYS L 42 -15.524 -14.731 -75.623 1.00 87.84 C
+ATOM 3861 CD LYS L 42 -14.799 -16.060 -75.772 1.00 97.04 C
+ATOM 3862 CE LYS L 42 -13.749 -16.244 -74.686 1.00 92.14 C
+ATOM 3863 NZ LYS L 42 -13.029 -17.539 -74.823 1.00 0.00 N
+ATOM 3864 H LYS L 42 -18.946 -13.597 -75.322 1.00 0.00 H
+ATOM 3865 HA LYS L 42 -16.598 -12.400 -76.694 1.00 0.00 H
+ATOM 3866 1HB LYS L 42 -17.293 -15.369 -76.618 1.00 0.00 H
+ATOM 3867 2HB LYS L 42 -16.084 -14.651 -77.674 1.00 0.00 H
+ATOM 3868 1HG LYS L 42 -14.796 -13.921 -75.685 1.00 0.00 H
+ATOM 3869 2HG LYS L 42 -15.999 -14.694 -74.643 1.00 0.00 H
+ATOM 3870 1HD LYS L 42 -15.520 -16.877 -75.711 1.00 0.00 H
+ATOM 3871 2HD LYS L 42 -14.312 -16.102 -76.746 1.00 0.00 H
+ATOM 3872 1HE LYS L 42 -13.025 -15.432 -74.739 1.00 0.00 H
+ATOM 3873 2HE LYS L 42 -14.228 -16.211 -73.708 1.00 0.00 H
+ATOM 3874 1HZ LYS L 42 -12.343 -17.623 -74.086 1.00 0.00 H
+ATOM 3875 2HZ LYS L 42 -13.689 -18.301 -74.756 1.00 0.00 H
+ATOM 3876 3HZ LYS L 42 -12.564 -17.574 -75.719 1.00 0.00 H
+ATOM 3877 N ALA L 43 -17.668 -12.864 -79.007 1.00 81.92 N
+ATOM 3878 CA ALA L 43 -18.434 -12.716 -80.226 1.00 77.35 C
+ATOM 3879 C ALA L 43 -19.034 -14.056 -80.643 1.00 78.56 C
+ATOM 3880 O ALA L 43 -18.568 -15.117 -80.217 1.00 82.78 O
+ATOM 3881 CB ALA L 43 -17.549 -12.164 -81.340 1.00 73.78 C
+ATOM 3882 H ALA L 43 -16.661 -12.806 -79.049 1.00 0.00 H
+ATOM 3883 HA ALA L 43 -19.243 -12.011 -80.034 1.00 0.00 H
+ATOM 3884 1HB ALA L 43 -18.136 -12.057 -82.252 1.00 0.00 H
+ATOM 3885 2HB ALA L 43 -17.157 -11.191 -81.045 1.00 0.00 H
+ATOM 3886 3HB ALA L 43 -16.722 -12.849 -81.520 1.00 0.00 H
+ATOM 3887 N PRO L 44 -20.084 -14.031 -81.463 1.00 73.62 N
+ATOM 3888 CA PRO L 44 -20.626 -15.286 -81.998 1.00 60.67 C
+ATOM 3889 C PRO L 44 -19.587 -16.040 -82.815 1.00 65.56 C
+ATOM 3890 O PRO L 44 -18.782 -15.449 -83.538 1.00 71.26 O
+ATOM 3891 CB PRO L 44 -21.802 -14.825 -82.865 1.00 59.47 C
+ATOM 3892 CG PRO L 44 -22.195 -13.508 -82.295 1.00 60.79 C
+ATOM 3893 CD PRO L 44 -20.929 -12.873 -81.801 1.00 62.08 C
+ATOM 3894 HA PRO L 44 -20.977 -15.913 -81.165 1.00 0.00 H
+ATOM 3895 1HB PRO L 44 -21.489 -14.754 -83.917 1.00 0.00 H
+ATOM 3896 2HB PRO L 44 -22.615 -15.565 -82.821 1.00 0.00 H
+ATOM 3897 1HG PRO L 44 -22.687 -12.893 -83.063 1.00 0.00 H
+ATOM 3898 2HG PRO L 44 -22.925 -13.648 -81.484 1.00 0.00 H
+ATOM 3899 1HD PRO L 44 -20.485 -12.267 -82.604 1.00 0.00 H
+ATOM 3900 2HD PRO L 44 -21.149 -12.251 -80.921 1.00 0.00 H
+ATOM 3901 N LYS L 45 -19.611 -17.361 -82.689 1.00 68.19 N
+ATOM 3902 CA LYS L 45 -18.677 -18.245 -83.373 1.00 70.42 C
+ATOM 3903 C LYS L 45 -19.410 -18.932 -84.517 1.00 69.87 C
+ATOM 3904 O LYS L 45 -20.412 -19.621 -84.293 1.00 75.46 O
+ATOM 3905 CB LYS L 45 -18.097 -19.272 -82.400 1.00 65.35 C
+ATOM 3906 CG LYS L 45 -17.108 -20.257 -83.003 1.00 72.01 C
+ATOM 3907 CD LYS L 45 -16.631 -21.235 -81.933 1.00 87.00 C
+ATOM 3908 CE LYS L 45 -15.652 -22.267 -82.476 1.00 89.24 C
+ATOM 3909 NZ LYS L 45 -15.251 -23.248 -81.425 1.00 82.69 N
+ATOM 3910 H LYS L 45 -20.316 -17.761 -82.087 1.00 0.00 H
+ATOM 3911 HA LYS L 45 -17.859 -17.643 -83.771 1.00 0.00 H
+ATOM 3912 1HB LYS L 45 -17.586 -18.755 -81.587 1.00 0.00 H
+ATOM 3913 2HB LYS L 45 -18.907 -19.854 -81.960 1.00 0.00 H
+ATOM 3914 1HG LYS L 45 -17.589 -20.805 -83.814 1.00 0.00 H
+ATOM 3915 2HG LYS L 45 -16.256 -19.714 -83.410 1.00 0.00 H
+ATOM 3916 1HD LYS L 45 -16.139 -20.685 -81.130 1.00 0.00 H
+ATOM 3917 2HD LYS L 45 -17.488 -21.764 -81.515 1.00 0.00 H
+ATOM 3918 1HE LYS L 45 -16.112 -22.803 -83.305 1.00 0.00 H
+ATOM 3919 2HE LYS L 45 -14.761 -21.762 -82.848 1.00 0.00 H
+ATOM 3920 1HZ LYS L 45 -14.603 -23.916 -81.817 1.00 0.00 H
+ATOM 3921 2HZ LYS L 45 -14.808 -22.760 -80.659 1.00 0.00 H
+ATOM 3922 3HZ LYS L 45 -16.070 -23.733 -81.086 1.00 0.00 H
+ATOM 3923 N LEU L 46 -18.923 -18.732 -85.739 1.00 64.88 N
+ATOM 3924 CA LEU L 46 -19.511 -19.402 -86.890 1.00 67.70 C
+ATOM 3925 C LEU L 46 -19.144 -20.881 -86.857 1.00 68.40 C
+ATOM 3926 O LEU L 46 -17.961 -21.237 -86.801 1.00 68.85 O
+ATOM 3927 CB LEU L 46 -19.032 -18.753 -88.186 1.00 76.16 C
+ATOM 3928 CG LEU L 46 -19.545 -19.350 -89.503 1.00 65.79 C
+ATOM 3929 CD1 LEU L 46 -21.065 -19.285 -89.600 1.00 61.46 C
+ATOM 3930 CD2 LEU L 46 -18.895 -18.672 -90.698 1.00 55.09 C
+ATOM 3931 H LEU L 46 -18.138 -18.111 -85.879 1.00 0.00 H
+ATOM 3932 HA LEU L 46 -20.594 -19.304 -86.831 1.00 0.00 H
+ATOM 3933 1HB LEU L 46 -19.326 -17.705 -88.179 1.00 0.00 H
+ATOM 3934 2HB LEU L 46 -17.944 -18.804 -88.219 1.00 0.00 H
+ATOM 3935 HG LEU L 46 -19.311 -20.414 -89.535 1.00 0.00 H
+ATOM 3936 1HD1 LEU L 46 -21.388 -19.718 -90.547 1.00 0.00 H
+ATOM 3937 2HD1 LEU L 46 -21.507 -19.846 -88.776 1.00 0.00 H
+ATOM 3938 3HD1 LEU L 46 -21.389 -18.246 -89.547 1.00 0.00 H
+ATOM 3939 1HD2 LEU L 46 -19.276 -19.115 -91.619 1.00 0.00 H
+ATOM 3940 2HD2 LEU L 46 -19.128 -17.607 -90.684 1.00 0.00 H
+ATOM 3941 3HD2 LEU L 46 -17.814 -18.807 -90.650 1.00 0.00 H
+ATOM 3942 N LEU L 47 -20.160 -21.741 -86.871 1.00 68.33 N
+ATOM 3943 CA LEU L 47 -19.968 -23.185 -86.851 1.00 78.73 C
+ATOM 3944 C LEU L 47 -20.214 -23.828 -88.206 1.00 79.39 C
+ATOM 3945 O LEU L 47 -19.367 -24.578 -88.704 1.00 70.21 O
+ATOM 3946 CB LEU L 47 -20.892 -23.821 -85.804 1.00 78.87 C
+ATOM 3947 CG LEU L 47 -20.593 -23.571 -84.328 1.00 70.21 C
+ATOM 3948 CD1 LEU L 47 -21.590 -24.332 -83.474 1.00 67.80 C
+ATOM 3949 CD2 LEU L 47 -19.172 -23.998 -83.993 1.00 68.44 C
+ATOM 3950 H LEU L 47 -21.099 -21.370 -86.897 1.00 0.00 H
+ATOM 3951 HA LEU L 47 -18.933 -23.392 -86.581 1.00 0.00 H
+ATOM 3952 1HB LEU L 47 -21.907 -23.466 -85.975 1.00 0.00 H
+ATOM 3953 2HB LEU L 47 -20.880 -24.902 -85.940 1.00 0.00 H
+ATOM 3954 HG LEU L 47 -20.704 -22.509 -84.109 1.00 0.00 H
+ATOM 3955 1HD1 LEU L 47 -21.377 -24.154 -82.420 1.00 0.00 H
+ATOM 3956 2HD1 LEU L 47 -22.600 -23.991 -83.702 1.00 0.00 H
+ATOM 3957 3HD1 LEU L 47 -21.510 -25.398 -83.685 1.00 0.00 H
+ATOM 3958 1HD2 LEU L 47 -18.975 -23.812 -82.937 1.00 0.00 H
+ATOM 3959 2HD2 LEU L 47 -19.053 -25.061 -84.203 1.00 0.00 H
+ATOM 3960 3HD2 LEU L 47 -18.468 -23.427 -84.599 1.00 0.00 H
+ATOM 3961 N ILE L 48 -21.362 -23.549 -88.820 1.00 78.16 N
+ATOM 3962 CA ILE L 48 -21.774 -24.192 -90.060 1.00 65.52 C
+ATOM 3963 C ILE L 48 -22.277 -23.123 -91.015 1.00 66.01 C
+ATOM 3964 O ILE L 48 -23.095 -22.280 -90.633 1.00 72.82 O
+ATOM 3965 CB ILE L 48 -22.862 -25.255 -89.812 1.00 68.08 C
+ATOM 3966 CG1 ILE L 48 -22.315 -26.372 -88.918 1.00 75.05 C
+ATOM 3967 CG2 ILE L 48 -23.367 -25.822 -91.123 1.00 75.95 C
+ATOM 3968 CD1 ILE L 48 -23.307 -27.471 -88.649 1.00 81.72 C
+ATOM 3969 H ILE L 48 -21.967 -22.859 -88.399 1.00 0.00 H
+ATOM 3970 HA ILE L 48 -20.908 -24.689 -90.496 1.00 0.00 H
+ATOM 3971 HB ILE L 48 -23.698 -24.802 -89.280 1.00 0.00 H
+ATOM 3972 1HG1 ILE L 48 -21.434 -26.812 -89.384 1.00 0.00 H
+ATOM 3973 2HG1 ILE L 48 -22.003 -25.952 -87.961 1.00 0.00 H
+ATOM 3974 1HG2 ILE L 48 -24.134 -26.571 -90.924 1.00 0.00 H
+ATOM 3975 2HG2 ILE L 48 -23.791 -25.020 -91.727 1.00 0.00 H
+ATOM 3976 3HG2 ILE L 48 -22.540 -26.284 -91.662 1.00 0.00 H
+ATOM 3977 1HD1 ILE L 48 -22.849 -28.226 -88.009 1.00 0.00 H
+ATOM 3978 2HD1 ILE L 48 -24.184 -27.056 -88.151 1.00 0.00 H
+ATOM 3979 3HD1 ILE L 48 -23.607 -27.928 -89.591 1.00 0.00 H
+ATOM 3980 N TYR L 49 -21.776 -23.147 -92.246 1.00 72.32 N
+ATOM 3981 CA TYR L 49 -22.255 -22.287 -93.317 1.00 71.33 C
+ATOM 3982 C TYR L 49 -22.798 -23.154 -94.444 1.00 76.35 C
+ATOM 3983 O TYR L 49 -22.586 -24.368 -94.477 1.00 78.96 O
+ATOM 3984 CB TYR L 49 -21.144 -21.360 -93.831 1.00 60.65 C
+ATOM 3985 CG TYR L 49 -19.990 -22.067 -94.507 1.00 63.44 C
+ATOM 3986 CD1 TYR L 49 -19.991 -22.288 -95.878 1.00 66.96 C
+ATOM 3987 CD2 TYR L 49 -18.893 -22.502 -93.776 1.00 72.80 C
+ATOM 3988 CE1 TYR L 49 -18.931 -22.928 -96.500 1.00 78.03 C
+ATOM 3989 CE2 TYR L 49 -17.831 -23.144 -94.388 1.00 77.98 C
+ATOM 3990 CZ TYR L 49 -17.855 -23.353 -95.749 1.00 80.37 C
+ATOM 3991 OH TYR L 49 -16.797 -23.990 -96.357 1.00 81.24 O
+ATOM 3992 H TYR L 49 -21.027 -23.798 -92.435 1.00 0.00 H
+ATOM 3993 HA TYR L 49 -23.063 -21.667 -92.928 1.00 0.00 H
+ATOM 3994 1HB TYR L 49 -21.563 -20.651 -94.547 1.00 0.00 H
+ATOM 3995 2HB TYR L 49 -20.738 -20.784 -93.000 1.00 0.00 H
+ATOM 3996 HD1 TYR L 49 -20.835 -21.956 -96.483 1.00 0.00 H
+ATOM 3997 HD2 TYR L 49 -18.857 -22.341 -92.699 1.00 0.00 H
+ATOM 3998 HE1 TYR L 49 -18.950 -23.092 -97.577 1.00 0.00 H
+ATOM 3999 HE2 TYR L 49 -16.982 -23.482 -93.793 1.00 0.00 H
+ATOM 4000 HH TYR L 49 -16.139 -24.217 -95.696 1.00 0.00 H
+ATOM 4001 N ALA L 50 -23.509 -22.515 -95.375 1.00 76.60 N
+ATOM 4002 CA ALA L 50 -24.123 -23.206 -96.512 1.00 71.42 C
+ATOM 4003 C ALA L 50 -24.973 -24.388 -96.050 1.00 75.72 C
+ATOM 4004 O ALA L 50 -24.909 -25.484 -96.611 1.00 76.83 O
+ATOM 4005 CB ALA L 50 -23.064 -23.653 -97.520 1.00 68.43 C
+ATOM 4006 H ALA L 50 -23.624 -21.516 -95.286 1.00 0.00 H
+ATOM 4007 HA ALA L 50 -24.800 -22.509 -97.006 1.00 0.00 H
+ATOM 4008 1HB ALA L 50 -23.547 -24.163 -98.353 1.00 0.00 H
+ATOM 4009 2HB ALA L 50 -22.524 -22.782 -97.891 1.00 0.00 H
+ATOM 4010 3HB ALA L 50 -22.365 -24.333 -97.035 1.00 0.00 H
+ATOM 4011 N ALA L 51 -25.752 -24.162 -94.987 1.00 77.70 N
+ATOM 4012 CA ALA L 51 -26.712 -25.118 -94.439 1.00 78.99 C
+ATOM 4013 C ALA L 51 -26.053 -26.342 -93.809 1.00 84.27 C
+ATOM 4014 O ALA L 51 -26.525 -26.838 -92.780 1.00 83.85 O
+ATOM 4015 CB ALA L 51 -27.710 -25.559 -95.515 1.00 82.36 C
+ATOM 4016 H ALA L 51 -25.652 -23.258 -94.547 1.00 0.00 H
+ATOM 4017 HA ALA L 51 -27.259 -24.626 -93.635 1.00 0.00 H
+ATOM 4018 1HB ALA L 51 -28.416 -26.271 -95.087 1.00 0.00 H
+ATOM 4019 2HB ALA L 51 -28.252 -24.689 -95.887 1.00 0.00 H
+ATOM 4020 3HB ALA L 51 -27.174 -26.031 -96.337 1.00 0.00 H
+ATOM 4021 N SER L 52 -24.965 -26.840 -94.404 1.00 82.37 N
+ATOM 4022 CA SER L 52 -24.384 -28.084 -93.912 1.00 73.45 C
+ATOM 4023 C SER L 52 -22.862 -28.146 -94.007 1.00 65.08 C
+ATOM 4024 O SER L 52 -22.301 -29.225 -93.783 1.00 67.07 O
+ATOM 4025 CB SER L 52 -24.986 -29.273 -94.674 1.00 87.21 C
+ATOM 4026 OG SER L 52 -24.748 -29.163 -96.069 1.00 86.06 O
+ATOM 4027 H SER L 52 -24.535 -26.373 -95.189 1.00 0.00 H
+ATOM 4028 HA SER L 52 -24.624 -28.183 -92.852 1.00 0.00 H
+ATOM 4029 1HB SER L 52 -24.552 -30.201 -94.302 1.00 0.00 H
+ATOM 4030 2HB SER L 52 -26.059 -29.317 -94.490 1.00 0.00 H
+ATOM 4031 HG SER L 52 -24.255 -28.348 -96.190 1.00 0.00 H
+ATOM 4032 N SER L 53 -22.171 -27.058 -94.327 1.00 63.51 N
+ATOM 4033 CA SER L 53 -20.718 -27.078 -94.455 1.00 70.42 C
+ATOM 4034 C SER L 53 -20.098 -26.649 -93.130 1.00 80.92 C
+ATOM 4035 O SER L 53 -20.367 -25.545 -92.641 1.00 82.13 O
+ATOM 4036 CB SER L 53 -20.254 -26.165 -95.592 1.00 71.66 C
+ATOM 4037 OG SER L 53 -20.885 -26.492 -96.821 1.00 73.62 O
+ATOM 4038 H SER L 53 -22.667 -26.193 -94.486 1.00 0.00 H
+ATOM 4039 HA SER L 53 -20.405 -28.098 -94.683 1.00 0.00 H
+ATOM 4040 1HB SER L 53 -20.475 -25.128 -95.339 1.00 0.00 H
+ATOM 4041 2HB SER L 53 -19.174 -26.250 -95.709 1.00 0.00 H
+ATOM 4042 HG SER L 53 -21.468 -27.231 -96.631 1.00 0.00 H
+ATOM 4043 N LEU L 54 -19.273 -27.520 -92.553 1.00 91.42 N
+ATOM 4044 CA LEU L 54 -18.639 -27.244 -91.272 1.00 83.52 C
+ATOM 4045 C LEU L 54 -17.370 -26.426 -91.457 1.00 85.44 C
+ATOM 4046 O LEU L 54 -16.616 -26.629 -92.412 1.00 90.28 O
+ATOM 4047 CB LEU L 54 -18.308 -28.541 -90.535 1.00 81.19 C
+ATOM 4048 CG LEU L 54 -19.331 -29.011 -89.501 1.00 90.42 C
+ATOM 4049 CD1 LEU L 54 -20.598 -29.494 -90.184 1.00109.68 C
+ATOM 4050 CD2 LEU L 54 -18.745 -30.099 -88.617 1.00 83.00 C
+ATOM 4051 H LEU L 54 -19.082 -28.396 -93.018 1.00 0.00 H
+ATOM 4052 HA LEU L 54 -19.332 -26.668 -90.660 1.00 0.00 H
+ATOM 4053 1HB LEU L 54 -18.196 -29.338 -91.268 1.00 0.00 H
+ATOM 4054 2HB LEU L 54 -17.357 -28.414 -90.018 1.00 0.00 H
+ATOM 4055 HG LEU L 54 -19.627 -28.170 -88.873 1.00 0.00 H
+ATOM 4056 1HD1 LEU L 54 -21.314 -29.824 -89.431 1.00 0.00 H
+ATOM 4057 2HD1 LEU L 54 -21.032 -28.679 -90.764 1.00 0.00 H
+ATOM 4058 3HD1 LEU L 54 -20.360 -30.325 -90.847 1.00 0.00 H
+ATOM 4059 1HD2 LEU L 54 -19.491 -30.417 -87.888 1.00 0.00 H
+ATOM 4060 2HD2 LEU L 54 -18.453 -30.950 -89.233 1.00 0.00 H
+ATOM 4061 3HD2 LEU L 54 -17.870 -29.712 -88.095 1.00 0.00 H
+ATOM 4062 N LEU L 55 -17.141 -25.507 -90.526 1.00 80.62 N
+ATOM 4063 CA LEU L 55 -15.932 -24.704 -90.529 1.00 78.64 C
+ATOM 4064 C LEU L 55 -14.774 -25.509 -89.952 1.00 96.00 C
+ATOM 4065 O LEU L 55 -14.967 -26.415 -89.136 1.00111.18 O
+ATOM 4066 CB LEU L 55 -16.147 -23.423 -89.725 1.00 60.71 C
+ATOM 4067 CG LEU L 55 -15.507 -22.146 -90.269 1.00 71.95 C
+ATOM 4068 CD1 LEU L 55 -15.946 -21.902 -91.693 1.00 66.60 C
+ATOM 4069 CD2 LEU L 55 -15.872 -20.954 -89.405 1.00 73.07 C
+ATOM 4070 H LEU L 55 -17.825 -25.363 -89.797 1.00 0.00 H
+ATOM 4071 HA LEU L 55 -15.697 -24.436 -91.559 1.00 0.00 H
+ATOM 4072 1HB LEU L 55 -17.217 -23.236 -89.650 1.00 0.00 H
+ATOM 4073 2HB LEU L 55 -15.754 -23.573 -88.720 1.00 0.00 H
+ATOM 4074 HG LEU L 55 -14.422 -22.257 -90.276 1.00 0.00 H
+ATOM 4075 1HD1 LEU L 55 -15.481 -20.989 -92.066 1.00 0.00 H
+ATOM 4076 2HD1 LEU L 55 -15.643 -22.743 -92.316 1.00 0.00 H
+ATOM 4077 3HD1 LEU L 55 -17.030 -21.797 -91.726 1.00 0.00 H
+ATOM 4078 1HD2 LEU L 55 -15.406 -20.055 -89.809 1.00 0.00 H
+ATOM 4079 2HD2 LEU L 55 -16.955 -20.829 -89.397 1.00 0.00 H
+ATOM 4080 3HD2 LEU L 55 -15.518 -21.120 -88.387 1.00 0.00 H
+ATOM 4081 N SER L 56 -13.564 -25.182 -90.397 1.00100.51 N
+ATOM 4082 CA SER L 56 -12.383 -25.895 -89.932 1.00105.83 C
+ATOM 4083 C SER L 56 -12.194 -25.689 -88.434 1.00112.93 C
+ATOM 4084 O SER L 56 -12.203 -24.558 -87.940 1.00121.98 O
+ATOM 4085 CB SER L 56 -11.149 -25.423 -90.699 1.00117.00 C
+ATOM 4086 OG SER L 56 -10.992 -24.018 -90.595 1.00126.94 O
+ATOM 4087 H SER L 56 -13.455 -24.432 -91.065 1.00 0.00 H
+ATOM 4088 HA SER L 56 -12.527 -26.960 -90.117 1.00 0.00 H
+ATOM 4089 1HB SER L 56 -10.263 -25.921 -90.305 1.00 0.00 H
+ATOM 4090 2HB SER L 56 -11.243 -25.704 -91.747 1.00 0.00 H
+ATOM 4091 HG SER L 56 -11.722 -23.709 -90.053 1.00 0.00 H
+ATOM 4092 N GLY L 57 -12.031 -26.792 -87.709 1.00 96.84 N
+ATOM 4093 CA GLY L 57 -11.918 -26.771 -86.272 1.00 92.28 C
+ATOM 4094 C GLY L 57 -13.181 -27.169 -85.539 1.00 92.29 C
+ATOM 4095 O GLY L 57 -13.104 -27.565 -84.370 1.00101.78 O
+ATOM 4096 H GLY L 57 -11.985 -27.677 -88.193 1.00 0.00 H
+ATOM 4097 1HA GLY L 57 -11.120 -27.445 -85.960 1.00 0.00 H
+ATOM 4098 2HA GLY L 57 -11.639 -25.770 -85.944 1.00 0.00 H
+ATOM 4099 N VAL L 58 -14.333 -27.075 -86.189 1.00 82.00 N
+ATOM 4100 CA VAL L 58 -15.587 -27.481 -85.548 1.00 79.73 C
+ATOM 4101 C VAL L 58 -15.608 -29.000 -85.410 1.00 82.17 C
+ATOM 4102 O VAL L 58 -15.291 -29.711 -86.380 1.00 89.74 O
+ATOM 4103 CB VAL L 58 -16.781 -26.983 -86.357 1.00 66.87 C
+ATOM 4104 CG1 VAL L 58 -18.085 -27.466 -85.736 1.00 74.98 C
+ATOM 4105 CG2 VAL L 58 -16.751 -25.467 -86.439 1.00 63.34 C
+ATOM 4106 H VAL L 58 -14.356 -26.721 -87.135 1.00 0.00 H
+ATOM 4107 HA VAL L 58 -15.627 -27.035 -84.553 1.00 0.00 H
+ATOM 4108 HB VAL L 58 -16.729 -27.404 -87.361 1.00 0.00 H
+ATOM 4109 1HG1 VAL L 58 -18.926 -27.102 -86.326 1.00 0.00 H
+ATOM 4110 2HG1 VAL L 58 -18.099 -28.556 -85.720 1.00 0.00 H
+ATOM 4111 3HG1 VAL L 58 -18.166 -27.086 -84.718 1.00 0.00 H
+ATOM 4112 1HG2 VAL L 58 -17.605 -25.117 -87.018 1.00 0.00 H
+ATOM 4113 2HG2 VAL L 58 -16.797 -25.047 -85.434 1.00 0.00 H
+ATOM 4114 3HG2 VAL L 58 -15.829 -25.147 -86.924 1.00 0.00 H
+ATOM 4115 N PRO L 59 -15.954 -29.540 -84.243 1.00 75.60 N
+ATOM 4116 CA PRO L 59 -15.963 -30.997 -84.075 1.00 79.48 C
+ATOM 4117 C PRO L 59 -16.956 -31.670 -85.013 1.00 85.57 C
+ATOM 4118 O PRO L 59 -17.896 -31.054 -85.520 1.00 91.06 O
+ATOM 4119 CB PRO L 59 -16.372 -31.184 -82.609 1.00 84.77 C
+ATOM 4120 CG PRO L 59 -16.045 -29.883 -81.949 1.00 90.71 C
+ATOM 4121 CD PRO L 59 -16.275 -28.835 -82.990 1.00 79.85 C
+ATOM 4122 HA PRO L 59 -14.950 -31.388 -84.250 1.00 0.00 H
+ATOM 4123 1HB PRO L 59 -17.442 -31.430 -82.545 1.00 0.00 H
+ATOM 4124 2HB PRO L 59 -15.821 -32.029 -82.170 1.00 0.00 H
+ATOM 4125 1HG PRO L 59 -16.683 -29.734 -81.065 1.00 0.00 H
+ATOM 4126 2HG PRO L 59 -15.005 -29.889 -81.592 1.00 0.00 H
+ATOM 4127 1HD PRO L 59 -17.326 -28.513 -82.961 1.00 0.00 H
+ATOM 4128 2HD PRO L 59 -15.603 -27.983 -82.808 1.00 0.00 H
+ATOM 4129 N SER L 60 -16.734 -32.970 -85.227 1.00 91.00 N
+ATOM 4130 CA SER L 60 -17.596 -33.772 -86.088 1.00 85.31 C
+ATOM 4131 C SER L 60 -19.023 -33.885 -85.563 1.00 89.54 C
+ATOM 4132 O SER L 60 -19.943 -34.117 -86.355 1.00 87.22 O
+ATOM 4133 CB SER L 60 -17.005 -35.176 -86.249 1.00101.17 C
+ATOM 4134 OG SER L 60 -15.619 -35.130 -86.531 1.00109.74 O
+ATOM 4135 H SER L 60 -15.943 -33.408 -84.777 1.00 0.00 H
+ATOM 4136 HA SER L 60 -17.648 -33.294 -87.067 1.00 0.00 H
+ATOM 4137 1HB SER L 60 -17.168 -35.746 -85.335 1.00 0.00 H
+ATOM 4138 2HB SER L 60 -17.520 -35.697 -87.055 1.00 0.00 H
+ATOM 4139 HG SER L 60 -15.384 -34.199 -86.552 1.00 0.00 H
+ATOM 4140 N ARG L 61 -19.234 -33.738 -84.252 1.00 92.15 N
+ATOM 4141 CA ARG L 61 -20.560 -33.969 -83.685 1.00 85.41 C
+ATOM 4142 C ARG L 61 -21.581 -32.935 -84.146 1.00 87.04 C
+ATOM 4143 O ARG L 61 -22.787 -33.183 -84.039 1.00 90.51 O
+ATOM 4144 CB ARG L 61 -20.482 -34.002 -82.154 1.00 77.37 C
+ATOM 4145 CG ARG L 61 -19.736 -32.828 -81.532 1.00 88.28 C
+ATOM 4146 CD ARG L 61 -19.596 -32.978 -80.014 1.00 84.40 C
+ATOM 4147 NE ARG L 61 -19.026 -31.785 -79.389 1.00 75.98 N
+ATOM 4148 CZ ARG L 61 -17.756 -31.660 -79.015 1.00 85.99 C
+ATOM 4149 NH1 ARG L 61 -16.900 -32.654 -79.206 1.00 94.20 N
+ATOM 4150 NH2 ARG L 61 -17.337 -30.534 -78.455 1.00 80.98 N
+ATOM 4151 H ARG L 61 -18.478 -33.466 -83.640 1.00 0.00 H
+ATOM 4152 HA ARG L 61 -20.924 -34.934 -84.039 1.00 0.00 H
+ATOM 4153 1HB ARG L 61 -21.489 -34.014 -81.739 1.00 0.00 H
+ATOM 4154 2HB ARG L 61 -19.986 -34.918 -81.835 1.00 0.00 H
+ATOM 4155 1HG ARG L 61 -18.736 -32.764 -81.962 1.00 0.00 H
+ATOM 4156 2HG ARG L 61 -20.278 -31.904 -81.734 1.00 0.00 H
+ATOM 4157 1HD ARG L 61 -20.577 -33.153 -79.574 1.00 0.00 H
+ATOM 4158 2HD ARG L 61 -18.943 -33.821 -79.791 1.00 0.00 H
+ATOM 4159 HE ARG L 61 -19.641 -30.998 -79.230 1.00 0.00 H
+ATOM 4160 1HH1 ARG L 61 -17.211 -33.513 -79.638 1.00 0.00 H
+ATOM 4161 2HH1 ARG L 61 -15.937 -32.553 -78.920 1.00 0.00 H
+ATOM 4162 1HH2 ARG L 61 -17.983 -29.770 -78.312 1.00 0.00 H
+ATOM 4163 2HH2 ARG L 61 -16.373 -30.440 -78.171 1.00 0.00 H
+ATOM 4164 N PHE L 62 -21.133 -31.794 -84.661 1.00 71.41 N
+ATOM 4165 CA PHE L 62 -22.046 -30.799 -85.207 1.00 76.12 C
+ATOM 4166 C PHE L 62 -22.387 -31.147 -86.649 1.00 81.82 C
+ATOM 4167 O PHE L 62 -21.501 -31.468 -87.448 1.00 76.67 O
+ATOM 4168 CB PHE L 62 -21.430 -29.405 -85.122 1.00 74.56 C
+ATOM 4169 CG PHE L 62 -21.300 -28.890 -83.718 1.00 84.91 C
+ATOM 4170 CD1 PHE L 62 -20.214 -29.246 -82.932 1.00 93.54 C
+ATOM 4171 CD2 PHE L 62 -22.261 -28.048 -83.185 1.00 75.02 C
+ATOM 4172 CE1 PHE L 62 -20.095 -28.776 -81.642 1.00 94.11 C
+ATOM 4173 CE2 PHE L 62 -22.145 -27.572 -81.898 1.00 78.89 C
+ATOM 4174 CZ PHE L 62 -21.061 -27.936 -81.124 1.00 93.44 C
+ATOM 4175 H PHE L 62 -20.140 -31.611 -84.675 1.00 0.00 H
+ATOM 4176 HA PHE L 62 -22.964 -30.811 -84.618 1.00 0.00 H
+ATOM 4177 1HB PHE L 62 -20.439 -29.417 -85.575 1.00 0.00 H
+ATOM 4178 2HB PHE L 62 -22.040 -28.703 -85.689 1.00 0.00 H
+ATOM 4179 HD1 PHE L 62 -19.450 -29.904 -83.346 1.00 0.00 H
+ATOM 4180 HD2 PHE L 62 -23.117 -27.761 -83.797 1.00 0.00 H
+ATOM 4181 HE1 PHE L 62 -19.239 -29.067 -81.033 1.00 0.00 H
+ATOM 4182 HE2 PHE L 62 -22.908 -26.909 -81.489 1.00 0.00 H
+ATOM 4183 HZ PHE L 62 -20.970 -27.562 -80.105 1.00 0.00 H
+ATOM 4184 N SER L 63 -23.674 -31.087 -86.979 1.00 94.35 N
+ATOM 4185 CA SER L 63 -24.162 -31.515 -88.280 1.00 87.39 C
+ATOM 4186 C SER L 63 -25.270 -30.578 -88.739 1.00 80.46 C
+ATOM 4187 O SER L 63 -26.107 -30.150 -87.938 1.00 76.74 O
+ATOM 4188 CB SER L 63 -24.669 -32.961 -88.222 1.00 72.69 C
+ATOM 4189 OG SER L 63 -24.944 -33.458 -89.517 1.00 91.33 O
+ATOM 4190 H SER L 63 -24.331 -30.731 -86.300 1.00 0.00 H
+ATOM 4191 HA SER L 63 -23.337 -31.466 -88.992 1.00 0.00 H
+ATOM 4192 1HB SER L 63 -23.920 -33.590 -87.741 1.00 0.00 H
+ATOM 4193 2HB SER L 63 -25.572 -33.006 -87.615 1.00 0.00 H
+ATOM 4194 HG SER L 63 -24.738 -32.743 -90.124 1.00 0.00 H
+ATOM 4195 N GLY L 64 -25.263 -30.258 -90.029 1.00 77.09 N
+ATOM 4196 CA GLY L 64 -26.247 -29.368 -90.610 1.00 74.66 C
+ATOM 4197 C GLY L 64 -27.086 -30.081 -91.654 1.00 80.18 C
+ATOM 4198 O GLY L 64 -26.604 -30.966 -92.364 1.00 76.95 O
+ATOM 4199 H GLY L 64 -24.545 -30.651 -90.621 1.00 0.00 H
+ATOM 4200 1HA GLY L 64 -26.894 -28.977 -89.824 1.00 0.00 H
+ATOM 4201 2HA GLY L 64 -25.743 -28.516 -91.064 1.00 0.00 H
+ATOM 4202 N SER L 65 -28.352 -29.683 -91.743 1.00 84.41 N
+ATOM 4203 CA SER L 65 -29.290 -30.327 -92.647 1.00 78.95 C
+ATOM 4204 C SER L 65 -30.358 -29.325 -93.057 1.00 85.66 C
+ATOM 4205 O SER L 65 -30.485 -28.243 -92.478 1.00 97.94 O
+ATOM 4206 CB SER L 65 -29.931 -31.558 -92.002 1.00 94.97 C
+ATOM 4207 OG SER L 65 -31.036 -32.015 -92.761 1.00108.56 O
+ATOM 4208 H SER L 65 -28.670 -28.915 -91.169 1.00 0.00 H
+ATOM 4209 HA SER L 65 -28.747 -30.652 -93.536 1.00 0.00 H
+ATOM 4210 1HB SER L 65 -29.190 -32.353 -91.920 1.00 0.00 H
+ATOM 4211 2HB SER L 65 -30.258 -31.311 -90.993 1.00 0.00 H
+ATOM 4212 HG SER L 65 -31.106 -31.420 -93.511 1.00 0.00 H
+ATOM 4213 N GLY L 66 -31.130 -29.706 -94.066 1.00 86.84 N
+ATOM 4214 CA GLY L 66 -32.236 -28.902 -94.534 1.00 89.27 C
+ATOM 4215 C GLY L 66 -31.913 -28.172 -95.828 1.00 89.84 C
+ATOM 4216 O GLY L 66 -30.753 -27.992 -96.210 1.00 83.78 O
+ATOM 4217 H GLY L 66 -30.936 -30.587 -94.520 1.00 0.00 H
+ATOM 4218 1HA GLY L 66 -33.107 -29.538 -94.691 1.00 0.00 H
+ATOM 4219 2HA GLY L 66 -32.504 -28.173 -93.770 1.00 0.00 H
+ATOM 4220 N SER L 67 -32.973 -27.741 -96.510 1.00 95.04 N
+ATOM 4221 CA SER L 67 -32.823 -27.022 -97.770 1.00 95.84 C
+ATOM 4222 C SER L 67 -34.132 -26.358 -98.176 1.00102.59 C
+ATOM 4223 O SER L 67 -35.193 -26.992 -98.149 1.00110.04 O
+ATOM 4224 CB SER L 67 -32.345 -27.959 -98.880 1.00 98.85 C
+ATOM 4225 OG SER L 67 -32.124 -27.244-100.083 1.00107.38 O
+ATOM 4226 H SER L 67 -33.901 -27.914 -96.150 1.00 0.00 H
+ATOM 4227 HA SER L 67 -32.076 -26.238 -97.635 1.00 0.00 H
+ATOM 4228 1HB SER L 67 -31.423 -28.450 -98.569 1.00 0.00 H
+ATOM 4229 2HB SER L 67 -33.090 -28.736 -99.046 1.00 0.00 H
+ATOM 4230 HG SER L 67 -32.337 -26.328 -99.889 1.00 0.00 H
+ATOM 4231 N GLY L 68 -34.067 -25.085 -98.554 1.00 96.18 N
+ATOM 4232 CA GLY L 68 -35.252 -24.356 -98.957 1.00 97.22 C
+ATOM 4233 C GLY L 68 -35.837 -23.509 -97.847 1.00 87.27 C
+ATOM 4234 O GLY L 68 -35.570 -22.306 -97.771 1.00 85.45 O
+ATOM 4235 H GLY L 68 -33.174 -24.614 -98.561 1.00 0.00 H
+ATOM 4236 1HA GLY L 68 -35.012 -23.708 -99.800 1.00 0.00 H
+ATOM 4237 2HA GLY L 68 -36.012 -25.058 -99.298 1.00 0.00 H
+ATOM 4238 N THR L 69 -36.644 -24.124 -96.981 1.00 76.17 N
+ATOM 4239 CA THR L 69 -37.242 -23.421 -95.856 1.00 71.39 C
+ATOM 4240 C THR L 69 -37.126 -24.157 -94.531 1.00 80.10 C
+ATOM 4241 O THR L 69 -37.433 -23.561 -93.494 1.00 90.06 O
+ATOM 4242 CB THR L 69 -38.729 -23.132 -96.119 1.00 75.55 C
+ATOM 4243 OG1 THR L 69 -39.380 -24.329 -96.564 1.00 85.17 O
+ATOM 4244 CG2 THR L 69 -38.894 -22.040 -97.164 1.00 70.67 C
+ATOM 4245 H THR L 69 -36.845 -25.105 -97.111 1.00 0.00 H
+ATOM 4246 HA THR L 69 -36.723 -22.471 -95.727 1.00 0.00 H
+ATOM 4247 HB THR L 69 -39.206 -22.811 -95.193 1.00 0.00 H
+ATOM 4248 HG1 THR L 69 -38.742 -25.046 -96.599 1.00 0.00 H
+ATOM 4249 1HG2 THR L 69 -39.955 -21.854 -97.332 1.00 0.00 H
+ATOM 4250 2HG2 THR L 69 -38.416 -21.126 -96.813 1.00 0.00 H
+ATOM 4251 3HG2 THR L 69 -38.430 -22.357 -98.097 1.00 0.00 H
+ATOM 4252 N ASP L 70 -36.705 -25.420 -94.525 1.00 82.04 N
+ATOM 4253 CA ASP L 70 -36.562 -26.201 -93.304 1.00 80.92 C
+ATOM 4254 C ASP L 70 -35.097 -26.564 -93.113 1.00 89.34 C
+ATOM 4255 O ASP L 70 -34.461 -27.104 -94.029 1.00103.03 O
+ATOM 4256 CB ASP L 70 -37.426 -27.463 -93.348 1.00 99.85 C
+ATOM 4257 CG ASP L 70 -38.905 -27.152 -93.478 1.00117.66 C
+ATOM 4258 OD1 ASP L 70 -39.331 -26.075 -93.013 1.00118.33 O
+ATOM 4259 OD2 ASP L 70 -39.644 -27.986 -94.043 1.00135.18 O
+ATOM 4260 H ASP L 70 -36.477 -25.847 -95.412 1.00 0.00 H
+ATOM 4261 HA ASP L 70 -36.891 -25.591 -92.462 1.00 0.00 H
+ATOM 4262 1HB ASP L 70 -37.121 -28.083 -94.191 1.00 0.00 H
+ATOM 4263 2HB ASP L 70 -37.267 -28.045 -92.439 1.00 0.00 H
+ATOM 4264 N PHE L 71 -34.565 -26.258 -91.930 1.00 75.63 N
+ATOM 4265 CA PHE L 71 -33.159 -26.481 -91.633 1.00 65.84 C
+ATOM 4266 C PHE L 71 -33.027 -27.056 -90.231 1.00 84.36 C
+ATOM 4267 O PHE L 71 -33.906 -26.887 -89.381 1.00 81.18 O
+ATOM 4268 CB PHE L 71 -32.346 -25.187 -91.774 1.00 70.97 C
+ATOM 4269 CG PHE L 71 -32.419 -24.577 -93.148 1.00 74.47 C
+ATOM 4270 CD1 PHE L 71 -31.454 -24.866 -94.099 1.00 73.69 C
+ATOM 4271 CD2 PHE L 71 -33.452 -23.716 -93.488 1.00 69.15 C
+ATOM 4272 CE1 PHE L 71 -31.521 -24.313 -95.362 1.00 76.74 C
+ATOM 4273 CE2 PHE L 71 -33.521 -23.157 -94.747 1.00 71.34 C
+ATOM 4274 CZ PHE L 71 -32.555 -23.456 -95.685 1.00 80.14 C
+ATOM 4275 H PHE L 71 -35.161 -25.858 -91.219 1.00 0.00 H
+ATOM 4276 HA PHE L 71 -32.766 -27.210 -92.344 1.00 0.00 H
+ATOM 4277 1HB PHE L 71 -32.704 -24.452 -91.054 1.00 0.00 H
+ATOM 4278 2HB PHE L 71 -31.300 -25.388 -91.544 1.00 0.00 H
+ATOM 4279 HD1 PHE L 71 -30.636 -25.539 -93.840 1.00 0.00 H
+ATOM 4280 HD2 PHE L 71 -34.215 -23.481 -92.745 1.00 0.00 H
+ATOM 4281 HE1 PHE L 71 -30.759 -24.553 -96.103 1.00 0.00 H
+ATOM 4282 HE2 PHE L 71 -34.336 -22.480 -95.002 1.00 0.00 H
+ATOM 4283 HZ PHE L 71 -32.608 -23.015 -96.679 1.00 0.00 H
+ATOM 4284 N THR L 72 -31.914 -27.749 -89.999 1.00 87.25 N
+ATOM 4285 CA THR L 72 -31.732 -28.508 -88.769 1.00 80.51 C
+ATOM 4286 C THR L 72 -30.268 -28.484 -88.365 1.00 68.23 C
+ATOM 4287 O THR L 72 -29.390 -28.738 -89.195 1.00 69.69 O
+ATOM 4288 CB THR L 72 -32.200 -29.960 -88.942 1.00 95.84 C
+ATOM 4289 OG1 THR L 72 -33.550 -29.978 -89.423 1.00113.13 O
+ATOM 4290 CG2 THR L 72 -32.129 -30.707 -87.623 1.00100.52 C
+ATOM 4291 H THR L 72 -31.178 -27.749 -90.691 1.00 0.00 H
+ATOM 4292 HA THR L 72 -32.332 -28.045 -87.985 1.00 0.00 H
+ATOM 4293 HB THR L 72 -31.564 -30.463 -89.671 1.00 0.00 H
+ATOM 4294 HG1 THR L 72 -33.863 -29.076 -89.531 1.00 0.00 H
+ATOM 4295 1HG2 THR L 72 -32.465 -31.734 -87.768 1.00 0.00 H
+ATOM 4296 2HG2 THR L 72 -31.101 -30.708 -87.261 1.00 0.00 H
+ATOM 4297 3HG2 THR L 72 -32.770 -30.216 -86.892 1.00 0.00 H
+ATOM 4298 N LEU L 73 -30.015 -28.178 -87.096 1.00 65.76 N
+ATOM 4299 CA LEU L 73 -28.698 -28.312 -86.489 1.00 65.37 C
+ATOM 4300 C LEU L 73 -28.741 -29.460 -85.489 1.00 67.50 C
+ATOM 4301 O LEU L 73 -29.674 -29.551 -84.686 1.00 68.50 O
+ATOM 4302 CB LEU L 73 -28.274 -27.016 -85.796 1.00 66.37 C
+ATOM 4303 CG LEU L 73 -26.916 -27.059 -85.098 1.00 66.65 C
+ATOM 4304 CD1 LEU L 73 -25.825 -27.357 -86.108 1.00 66.81 C
+ATOM 4305 CD2 LEU L 73 -26.632 -25.759 -84.369 1.00 63.17 C
+ATOM 4306 H LEU L 73 -30.783 -27.837 -86.535 1.00 0.00 H
+ATOM 4307 HA LEU L 73 -27.976 -28.532 -87.275 1.00 0.00 H
+ATOM 4308 1HB LEU L 73 -28.243 -26.220 -86.538 1.00 0.00 H
+ATOM 4309 2HB LEU L 73 -29.025 -26.759 -85.049 1.00 0.00 H
+ATOM 4310 HG LEU L 73 -26.905 -27.873 -84.373 1.00 0.00 H
+ATOM 4311 1HD1 LEU L 73 -24.860 -27.386 -85.603 1.00 0.00 H
+ATOM 4312 2HD1 LEU L 73 -26.017 -28.322 -86.577 1.00 0.00 H
+ATOM 4313 3HD1 LEU L 73 -25.812 -26.578 -86.870 1.00 0.00 H
+ATOM 4314 1HD2 LEU L 73 -25.659 -25.820 -83.881 1.00 0.00 H
+ATOM 4315 2HD2 LEU L 73 -26.629 -24.935 -85.083 1.00 0.00 H
+ATOM 4316 3HD2 LEU L 73 -27.404 -25.587 -83.619 1.00 0.00 H
+ATOM 4317 N THR L 74 -27.743 -30.340 -85.544 1.00 70.64 N
+ATOM 4318 CA THR L 74 -27.735 -31.547 -84.727 1.00 80.42 C
+ATOM 4319 C THR L 74 -26.395 -31.707 -84.027 1.00 84.61 C
+ATOM 4320 O THR L 74 -25.342 -31.642 -84.669 1.00 94.82 O
+ATOM 4321 CB THR L 74 -28.029 -32.792 -85.576 1.00 74.83 C
+ATOM 4322 OG1 THR L 74 -29.323 -32.669 -86.178 1.00 73.46 O
+ATOM 4323 CG2 THR L 74 -27.988 -34.046 -84.720 1.00 83.39 C
+ATOM 4324 H THR L 74 -26.970 -30.165 -86.170 1.00 0.00 H
+ATOM 4325 HA THR L 74 -28.514 -31.457 -83.969 1.00 0.00 H
+ATOM 4326 HB THR L 74 -27.285 -32.876 -86.368 1.00 0.00 H
+ATOM 4327 HG1 THR L 74 -29.719 -31.834 -85.916 1.00 0.00 H
+ATOM 4328 1HG2 THR L 74 -28.198 -34.917 -85.340 1.00 0.00 H
+ATOM 4329 2HG2 THR L 74 -27.000 -34.149 -84.273 1.00 0.00 H
+ATOM 4330 3HG2 THR L 74 -28.737 -33.973 -83.932 1.00 0.00 H
+ATOM 4331 N ILE L 75 -26.439 -31.919 -82.716 1.00 72.25 N
+ATOM 4332 CA ILE L 75 -25.273 -32.319 -81.937 1.00 79.78 C
+ATOM 4333 C ILE L 75 -25.522 -33.741 -81.448 1.00 79.80 C
+ATOM 4334 O ILE L 75 -26.503 -33.998 -80.737 1.00 81.46 O
+ATOM 4335 CB ILE L 75 -25.010 -31.363 -80.766 1.00 80.71 C
+ATOM 4336 CG1 ILE L 75 -25.060 -29.911 -81.244 1.00 86.01 C
+ATOM 4337 CG2 ILE L 75 -23.654 -31.654 -80.160 1.00 73.50 C
+ATOM 4338 CD1 ILE L 75 -24.937 -28.890 -80.123 1.00 69.30 C
+ATOM 4339 H ILE L 75 -27.325 -31.795 -82.247 1.00 0.00 H
+ATOM 4340 HA ILE L 75 -24.400 -32.300 -82.588 1.00 0.00 H
+ATOM 4341 HB ILE L 75 -25.780 -31.498 -80.007 1.00 0.00 H
+ATOM 4342 1HG1 ILE L 75 -24.255 -29.735 -81.956 1.00 0.00 H
+ATOM 4343 2HG1 ILE L 75 -26.001 -29.732 -81.765 1.00 0.00 H
+ATOM 4344 1HG2 ILE L 75 -23.473 -30.972 -79.330 1.00 0.00 H
+ATOM 4345 2HG2 ILE L 75 -23.631 -32.681 -79.797 1.00 0.00 H
+ATOM 4346 3HG2 ILE L 75 -22.881 -31.518 -80.916 1.00 0.00 H
+ATOM 4347 1HD1 ILE L 75 -24.981 -27.884 -80.541 1.00 0.00 H
+ATOM 4348 2HD1 ILE L 75 -25.756 -29.026 -79.416 1.00 0.00 H
+ATOM 4349 3HD1 ILE L 75 -23.987 -29.027 -79.609 1.00 0.00 H
+ATOM 4350 N SER L 76 -24.632 -34.660 -81.831 1.00 69.95 N
+ATOM 4351 CA SER L 76 -24.876 -36.086 -81.635 1.00 83.04 C
+ATOM 4352 C SER L 76 -24.646 -36.508 -80.188 1.00117.40 C
+ATOM 4353 O SER L 76 -25.542 -37.058 -79.540 1.00139.71 O
+ATOM 4354 CB SER L 76 -23.989 -36.898 -82.578 1.00 88.75 C
+ATOM 4355 OG SER L 76 -24.291 -38.280 -82.485 1.00109.67 O
+ATOM 4356 H SER L 76 -23.770 -34.364 -82.266 1.00 0.00 H
+ATOM 4357 HA SER L 76 -25.922 -36.293 -81.866 1.00 0.00 H
+ATOM 4358 1HB SER L 76 -24.138 -36.556 -83.602 1.00 0.00 H
+ATOM 4359 2HB SER L 76 -22.942 -36.731 -82.326 1.00 0.00 H
+ATOM 4360 HG SER L 76 -24.995 -38.354 -81.836 1.00 0.00 H
+ATOM 4361 N SER L 77 -23.439 -36.286 -79.673 1.00116.96 N
+ATOM 4362 CA SER L 77 -23.121 -36.546 -78.272 1.00114.57 C
+ATOM 4363 C SER L 77 -22.613 -35.244 -77.670 1.00112.54 C
+ATOM 4364 O SER L 77 -21.490 -34.817 -77.959 1.00123.22 O
+ATOM 4365 CB SER L 77 -22.089 -37.665 -78.127 1.00115.20 C
+ATOM 4366 OG SER L 77 -20.802 -37.232 -78.527 1.00119.98 O
+ATOM 4367 H SER L 77 -22.719 -35.923 -80.282 1.00 0.00 H
+ATOM 4368 HA SER L 77 -24.033 -36.858 -77.762 1.00 0.00 H
+ATOM 4369 1HB SER L 77 -22.055 -37.996 -77.089 1.00 0.00 H
+ATOM 4370 2HB SER L 77 -22.390 -38.518 -78.733 1.00 0.00 H
+ATOM 4371 HG SER L 77 -20.903 -36.316 -78.797 1.00 0.00 H
+ATOM 4372 N LEU L 78 -23.444 -34.614 -76.843 1.00 97.23 N
+ATOM 4373 CA LEU L 78 -23.098 -33.323 -76.270 1.00 85.86 C
+ATOM 4374 C LEU L 78 -21.874 -33.428 -75.368 1.00 96.65 C
+ATOM 4375 O LEU L 78 -21.585 -34.476 -74.785 1.00 93.44 O
+ATOM 4376 CB LEU L 78 -24.277 -32.762 -75.476 1.00 84.56 C
+ATOM 4377 CG LEU L 78 -25.311 -31.963 -76.263 1.00 77.34 C
+ATOM 4378 CD1 LEU L 78 -26.487 -31.605 -75.371 1.00 84.68 C
+ATOM 4379 CD2 LEU L 78 -24.664 -30.711 -76.821 1.00 64.90 C
+ATOM 4380 H LEU L 78 -24.331 -35.035 -76.606 1.00 0.00 H
+ATOM 4381 HA LEU L 78 -22.865 -32.636 -77.082 1.00 0.00 H
+ATOM 4382 1HB LEU L 78 -24.802 -33.590 -75.002 1.00 0.00 H
+ATOM 4383 2HB LEU L 78 -23.890 -32.108 -74.694 1.00 0.00 H
+ATOM 4384 HG LEU L 78 -25.693 -32.571 -77.083 1.00 0.00 H
+ATOM 4385 1HD1 LEU L 78 -27.218 -31.035 -75.944 1.00 0.00 H
+ATOM 4386 2HD1 LEU L 78 -26.952 -32.518 -74.998 1.00 0.00 H
+ATOM 4387 3HD1 LEU L 78 -26.137 -31.005 -74.531 1.00 0.00 H
+ATOM 4388 1HD2 LEU L 78 -25.403 -30.140 -77.384 1.00 0.00 H
+ATOM 4389 2HD2 LEU L 78 -24.283 -30.102 -76.001 1.00 0.00 H
+ATOM 4390 3HD2 LEU L 78 -23.841 -30.989 -77.480 1.00 0.00 H
+ATOM 4391 N GLN L 79 -21.151 -32.324 -75.265 1.00104.51 N
+ATOM 4392 CA GLN L 79 -20.025 -32.164 -74.362 1.00107.67 C
+ATOM 4393 C GLN L 79 -20.192 -30.850 -73.619 1.00108.57 C
+ATOM 4394 O GLN L 79 -20.920 -29.962 -74.075 1.00111.17 O
+ATOM 4395 CB GLN L 79 -18.688 -32.191 -75.120 1.00104.72 C
+ATOM 4396 CG GLN L 79 -18.266 -33.584 -75.564 1.00106.51 C
+ATOM 4397 CD GLN L 79 -16.764 -33.718 -75.715 1.00126.00 C
+ATOM 4398 OE1 GLN L 79 -16.021 -32.756 -75.525 1.00129.38 O
+ATOM 4399 NE2 GLN L 79 -16.309 -34.918 -76.054 1.00139.28 N
+ATOM 4400 H GLN L 79 -21.416 -31.554 -75.862 1.00 0.00 H
+ATOM 4401 HA GLN L 79 -20.030 -32.991 -73.653 1.00 0.00 H
+ATOM 4402 1HB GLN L 79 -18.758 -31.557 -76.004 1.00 0.00 H
+ATOM 4403 2HB GLN L 79 -17.902 -31.782 -74.486 1.00 0.00 H
+ATOM 4404 1HG GLN L 79 -18.599 -34.308 -74.820 1.00 0.00 H
+ATOM 4405 2HG GLN L 79 -18.725 -33.802 -76.528 1.00 0.00 H
+ATOM 4406 1HE2 GLN L 79 -15.326 -35.067 -76.168 1.00 0.00 H
+ATOM 4407 2HE2 GLN L 79 -16.948 -35.674 -76.195 1.00 0.00 H
+ATOM 4408 N PRO L 80 -19.551 -30.702 -72.452 1.00104.19 N
+ATOM 4409 CA PRO L 80 -19.754 -29.471 -71.667 1.00 98.92 C
+ATOM 4410 C PRO L 80 -19.428 -28.202 -72.433 1.00 93.41 C
+ATOM 4411 O PRO L 80 -20.113 -27.186 -72.265 1.00 85.19 O
+ATOM 4412 CB PRO L 80 -18.819 -29.671 -70.468 1.00105.09 C
+ATOM 4413 CG PRO L 80 -18.687 -31.150 -70.344 1.00104.65 C
+ATOM 4414 CD PRO L 80 -18.699 -31.673 -71.743 1.00 89.10 C
+ATOM 4415 HA PRO L 80 -20.804 -29.417 -71.344 1.00 0.00 H
+ATOM 4416 1HB PRO L 80 -17.856 -29.172 -70.654 1.00 0.00 H
+ATOM 4417 2HB PRO L 80 -19.253 -29.206 -69.571 1.00 0.00 H
+ATOM 4418 1HG PRO L 80 -17.757 -31.405 -69.816 1.00 0.00 H
+ATOM 4419 2HG PRO L 80 -19.515 -31.556 -69.744 1.00 0.00 H
+ATOM 4420 1HD PRO L 80 -17.673 -31.682 -72.141 1.00 0.00 H
+ATOM 4421 2HD PRO L 80 -19.128 -32.686 -71.753 1.00 0.00 H
+ATOM 4422 N GLU L 81 -18.413 -28.240 -73.293 1.00 91.08 N
+ATOM 4423 CA GLU L 81 -18.020 -27.070 -74.067 1.00 86.17 C
+ATOM 4424 C GLU L 81 -19.051 -26.664 -75.115 1.00 79.95 C
+ATOM 4425 O GLU L 81 -18.824 -25.672 -75.815 1.00 89.39 O
+ATOM 4426 CB GLU L 81 -16.672 -27.339 -74.736 1.00106.84 C
+ATOM 4427 CG GLU L 81 -16.593 -28.699 -75.411 1.00126.02 C
+ATOM 4428 CD GLU L 81 -15.226 -28.985 -75.993 1.00146.52 C
+ATOM 4429 OE1 GLU L 81 -14.318 -28.146 -75.818 1.00155.40 O
+ATOM 4430 OE2 GLU L 81 -15.061 -30.047 -76.628 1.00154.14 O
+ATOM 4431 H GLU L 81 -17.902 -29.103 -73.412 1.00 0.00 H
+ATOM 4432 HA GLU L 81 -17.922 -26.223 -73.388 1.00 0.00 H
+ATOM 4433 1HB GLU L 81 -16.478 -26.571 -75.485 1.00 0.00 H
+ATOM 4434 2HB GLU L 81 -15.878 -27.278 -73.992 1.00 0.00 H
+ATOM 4435 1HG GLU L 81 -16.834 -29.470 -74.680 1.00 0.00 H
+ATOM 4436 2HG GLU L 81 -17.338 -28.743 -76.204 1.00 0.00 H
+ATOM 4437 N ASP L 82 -20.169 -27.382 -75.237 1.00 66.76 N
+ATOM 4438 CA ASP L 82 -21.142 -27.133 -76.292 1.00 71.24 C
+ATOM 4439 C ASP L 82 -22.407 -26.434 -75.816 1.00 70.76 C
+ATOM 4440 O ASP L 82 -23.251 -26.092 -76.651 1.00 82.48 O
+ATOM 4441 CB ASP L 82 -21.533 -28.451 -76.975 1.00 76.14 C
+ATOM 4442 CG ASP L 82 -20.386 -29.069 -77.747 1.00 81.71 C
+ATOM 4443 OD1 ASP L 82 -19.555 -28.307 -78.287 1.00 84.81 O
+ATOM 4444 OD2 ASP L 82 -20.317 -30.316 -77.810 1.00 78.76 O
+ATOM 4445 H ASP L 82 -20.342 -28.123 -74.573 1.00 0.00 H
+ATOM 4446 HA ASP L 82 -20.688 -26.475 -77.033 1.00 0.00 H
+ATOM 4447 1HB ASP L 82 -21.875 -29.163 -76.223 1.00 0.00 H
+ATOM 4448 2HB ASP L 82 -22.363 -28.274 -77.660 1.00 0.00 H
+ATOM 4449 N PHE L 83 -22.567 -26.216 -74.514 1.00 68.79 N
+ATOM 4450 CA PHE L 83 -23.770 -25.579 -73.988 1.00 67.76 C
+ATOM 4451 C PHE L 83 -23.642 -24.070 -74.147 1.00 70.15 C
+ATOM 4452 O PHE L 83 -22.796 -23.439 -73.504 1.00 78.87 O
+ATOM 4453 CB PHE L 83 -23.989 -25.974 -72.530 1.00 65.01 C
+ATOM 4454 CG PHE L 83 -24.380 -27.414 -72.349 1.00 83.65 C
+ATOM 4455 CD1 PHE L 83 -25.713 -27.772 -72.231 1.00 87.67 C
+ATOM 4456 CD2 PHE L 83 -23.419 -28.411 -72.308 1.00 82.25 C
+ATOM 4457 CE1 PHE L 83 -26.080 -29.096 -72.074 1.00 92.11 C
+ATOM 4458 CE2 PHE L 83 -23.781 -29.736 -72.151 1.00 87.11 C
+ATOM 4459 CZ PHE L 83 -25.113 -30.077 -72.033 1.00 89.55 C
+ATOM 4460 H PHE L 83 -21.839 -26.498 -73.873 1.00 0.00 H
+ATOM 4461 HA PHE L 83 -24.626 -25.918 -74.574 1.00 0.00 H
+ATOM 4462 1HB PHE L 83 -23.076 -25.794 -71.963 1.00 0.00 H
+ATOM 4463 2HB PHE L 83 -24.771 -25.351 -72.098 1.00 0.00 H
+ATOM 4464 HD1 PHE L 83 -26.478 -26.996 -72.264 1.00 0.00 H
+ATOM 4465 HD2 PHE L 83 -22.366 -28.141 -72.401 1.00 0.00 H
+ATOM 4466 HE1 PHE L 83 -27.133 -29.362 -71.983 1.00 0.00 H
+ATOM 4467 HE2 PHE L 83 -23.016 -30.511 -72.119 1.00 0.00 H
+ATOM 4468 HZ PHE L 83 -25.399 -31.120 -71.906 1.00 0.00 H
+ATOM 4469 N ALA L 84 -24.476 -23.492 -75.005 1.00 65.08 N
+ATOM 4470 CA ALA L 84 -24.431 -22.064 -75.294 1.00 75.99 C
+ATOM 4471 C ALA L 84 -25.774 -21.655 -75.886 1.00 78.13 C
+ATOM 4472 O ALA L 84 -26.758 -22.400 -75.815 1.00 77.63 O
+ATOM 4473 CB ALA L 84 -23.266 -21.731 -76.231 1.00 69.62 C
+ATOM 4474 H ALA L 84 -25.164 -24.067 -75.471 1.00 0.00 H
+ATOM 4475 HA ALA L 84 -24.284 -21.533 -74.354 1.00 0.00 H
+ATOM 4476 1HB ALA L 84 -23.255 -20.660 -76.431 1.00 0.00 H
+ATOM 4477 2HB ALA L 84 -22.326 -22.022 -75.761 1.00 0.00 H
+ATOM 4478 3HB ALA L 84 -23.386 -22.273 -77.168 1.00 0.00 H
+ATOM 4479 N THR L 85 -25.819 -20.461 -76.470 1.00 77.94 N
+ATOM 4480 CA THR L 85 -27.002 -19.971 -77.162 1.00 74.97 C
+ATOM 4481 C THR L 85 -26.724 -20.004 -78.656 1.00 79.67 C
+ATOM 4482 O THR L 85 -25.840 -19.290 -79.138 1.00 84.58 O
+ATOM 4483 CB THR L 85 -27.363 -18.557 -76.710 1.00 78.61 C
+ATOM 4484 OG1 THR L 85 -27.727 -18.575 -75.325 1.00 89.87 O
+ATOM 4485 CG2 THR L 85 -28.527 -18.024 -77.522 1.00 75.83 C
+ATOM 4486 H THR L 85 -24.996 -19.877 -76.428 1.00 0.00 H
+ATOM 4487 HA THR L 85 -27.838 -20.629 -76.926 1.00 0.00 H
+ATOM 4488 HB THR L 85 -26.502 -17.902 -76.843 1.00 0.00 H
+ATOM 4489 HG1 THR L 85 -27.663 -19.473 -74.990 1.00 0.00 H
+ATOM 4490 1HG2 THR L 85 -28.772 -17.016 -77.188 1.00 0.00 H
+ATOM 4491 2HG2 THR L 85 -28.254 -18.001 -78.577 1.00 0.00 H
+ATOM 4492 3HG2 THR L 85 -29.392 -18.671 -77.385 1.00 0.00 H
+ATOM 4493 N TYR L 86 -27.474 -20.823 -79.385 1.00 58.36 N
+ATOM 4494 CA TYR L 86 -27.247 -21.013 -80.811 1.00 61.39 C
+ATOM 4495 C TYR L 86 -28.226 -20.178 -81.627 1.00 64.03 C
+ATOM 4496 O TYR L 86 -29.404 -20.060 -81.277 1.00 62.53 O
+ATOM 4497 CB TYR L 86 -27.360 -22.493 -81.177 1.00 57.28 C
+ATOM 4498 CG TYR L 86 -26.234 -23.312 -80.588 1.00 73.39 C
+ATOM 4499 CD1 TYR L 86 -26.252 -23.692 -79.249 1.00 72.56 C
+ATOM 4500 CD2 TYR L 86 -25.139 -23.678 -81.359 1.00 63.08 C
+ATOM 4501 CE1 TYR L 86 -25.220 -24.428 -78.699 1.00 72.80 C
+ATOM 4502 CE2 TYR L 86 -24.102 -24.413 -80.819 1.00 68.88 C
+ATOM 4503 CZ TYR L 86 -24.146 -24.785 -79.486 1.00 70.71 C
+ATOM 4504 OH TYR L 86 -23.114 -25.518 -78.941 1.00 65.36 O
+ATOM 4505 H TYR L 86 -28.224 -21.328 -78.935 1.00 0.00 H
+ATOM 4506 HA TYR L 86 -26.240 -20.670 -81.050 1.00 0.00 H
+ATOM 4507 1HB TYR L 86 -28.312 -22.885 -80.817 1.00 0.00 H
+ATOM 4508 2HB TYR L 86 -27.350 -22.601 -82.261 1.00 0.00 H
+ATOM 4509 HD1 TYR L 86 -27.091 -23.409 -78.613 1.00 0.00 H
+ATOM 4510 HD2 TYR L 86 -25.088 -23.384 -82.407 1.00 0.00 H
+ATOM 4511 HE1 TYR L 86 -25.255 -24.715 -77.648 1.00 0.00 H
+ATOM 4512 HE2 TYR L 86 -23.253 -24.697 -81.442 1.00 0.00 H
+ATOM 4513 HH TYR L 86 -22.451 -25.685 -79.615 1.00 0.00 H
+ATOM 4514 N TYR L 87 -27.725 -19.594 -82.715 1.00 66.04 N
+ATOM 4515 CA TYR L 87 -28.486 -18.684 -83.559 1.00 71.48 C
+ATOM 4516 C TYR L 87 -28.551 -19.201 -84.992 1.00 80.24 C
+ATOM 4517 O TYR L 87 -27.634 -19.873 -85.475 1.00 63.09 O
+ATOM 4518 CB TYR L 87 -27.880 -17.272 -83.536 1.00 64.11 C
+ATOM 4519 CG TYR L 87 -28.158 -16.514 -82.257 1.00 64.28 C
+ATOM 4520 CD1 TYR L 87 -29.357 -15.837 -82.082 1.00 62.07 C
+ATOM 4521 CD2 TYR L 87 -27.228 -16.476 -81.226 1.00 69.74 C
+ATOM 4522 CE1 TYR L 87 -29.625 -15.145 -80.923 1.00 62.05 C
+ATOM 4523 CE2 TYR L 87 -27.488 -15.784 -80.058 1.00 73.35 C
+ATOM 4524 CZ TYR L 87 -28.689 -15.120 -79.912 1.00 73.43 C
+ATOM 4525 OH TYR L 87 -28.955 -14.428 -78.750 1.00 75.03 O
+ATOM 4526 H TYR L 87 -26.766 -19.802 -82.955 1.00 0.00 H
+ATOM 4527 HA TYR L 87 -29.505 -18.627 -83.175 1.00 0.00 H
+ATOM 4528 1HB TYR L 87 -26.799 -17.338 -83.667 1.00 0.00 H
+ATOM 4529 2HB TYR L 87 -28.276 -16.693 -84.370 1.00 0.00 H
+ATOM 4530 HD1 TYR L 87 -30.109 -15.847 -82.872 1.00 0.00 H
+ATOM 4531 HD2 TYR L 87 -26.276 -16.996 -81.331 1.00 0.00 H
+ATOM 4532 HE1 TYR L 87 -30.573 -14.621 -80.808 1.00 0.00 H
+ATOM 4533 HE2 TYR L 87 -26.746 -15.764 -79.259 1.00 0.00 H
+ATOM 4534 HH TYR L 87 -28.208 -14.509 -78.152 1.00 0.00 H
+ATOM 4535 N CYS L 88 -29.650 -18.874 -85.670 1.00 93.69 N
+ATOM 4536 CA CYS L 88 -29.895 -19.268 -87.053 1.00 65.84 C
+ATOM 4537 C CYS L 88 -29.911 -18.012 -87.915 1.00 57.79 C
+ATOM 4538 O CYS L 88 -30.762 -17.139 -87.721 1.00 72.84 O
+ATOM 4539 CB CYS L 88 -31.218 -20.026 -87.174 1.00 63.60 C
+ATOM 4540 SG CYS L 88 -31.741 -20.368 -88.862 1.00130.04 S
+ATOM 4541 H CYS L 88 -30.343 -18.322 -85.186 1.00 0.00 H
+ATOM 4542 HA CYS L 88 -29.088 -19.927 -87.373 1.00 0.00 H
+ATOM 4543 1HB CYS L 88 -31.140 -20.980 -86.652 1.00 0.00 H
+ATOM 4544 2HB CYS L 88 -32.011 -19.454 -86.692 1.00 0.00 H
+ATOM 4545 N GLN L 89 -28.972 -17.919 -88.856 1.00 63.90 N
+ATOM 4546 CA GLN L 89 -28.858 -16.764 -89.737 1.00 75.32 C
+ATOM 4547 C GLN L 89 -29.090 -17.169 -91.187 1.00 80.42 C
+ATOM 4548 O GLN L 89 -28.785 -18.295 -91.590 1.00 91.93 O
+ATOM 4549 CB GLN L 89 -27.481 -16.102 -89.612 1.00 74.20 C
+ATOM 4550 CG GLN L 89 -27.333 -14.820 -90.416 1.00 62.97 C
+ATOM 4551 CD GLN L 89 -25.991 -14.704 -91.112 1.00 69.56 C
+ATOM 4552 OE1 GLN L 89 -25.080 -15.497 -90.876 1.00 84.41 O
+ATOM 4553 NE2 GLN L 89 -25.864 -13.710 -91.977 1.00 74.00 N
+ATOM 4554 H GLN L 89 -28.317 -18.682 -88.957 1.00 0.00 H
+ATOM 4555 HA GLN L 89 -29.615 -16.034 -89.450 1.00 0.00 H
+ATOM 4556 1HB GLN L 89 -27.283 -15.869 -88.566 1.00 0.00 H
+ATOM 4557 2HB GLN L 89 -26.711 -16.799 -89.943 1.00 0.00 H
+ATOM 4558 1HG GLN L 89 -28.110 -14.790 -91.180 1.00 0.00 H
+ATOM 4559 2HG GLN L 89 -27.437 -13.968 -89.744 1.00 0.00 H
+ATOM 4560 1HE2 GLN L 89 -25.002 -13.581 -92.469 1.00 0.00 H
+ATOM 4561 2HE2 GLN L 89 -26.629 -13.087 -92.140 1.00 0.00 H
+ATOM 4562 N GLN L 90 -29.640 -16.241 -91.968 1.00 78.44 N
+ATOM 4563 CA GLN L 90 -29.745 -16.388 -93.413 1.00 78.54 C
+ATOM 4564 C GLN L 90 -28.631 -15.612 -94.107 1.00 83.67 C
+ATOM 4565 O GLN L 90 -28.049 -14.674 -93.555 1.00 88.25 O
+ATOM 4566 CB GLN L 90 -31.094 -15.888 -93.929 1.00 61.76 C
+ATOM 4567 CG GLN L 90 -31.164 -14.377 -93.989 1.00 85.31 C
+ATOM 4568 CD GLN L 90 -32.245 -13.872 -94.908 1.00 95.88 C
+ATOM 4569 OE1 GLN L 90 -33.046 -14.648 -95.425 1.00111.09 O
+ATOM 4570 NE2 GLN L 90 -32.276 -12.562 -95.120 1.00 91.73 N
+ATOM 4571 H GLN L 90 -29.997 -15.403 -91.532 1.00 0.00 H
+ATOM 4572 HA GLN L 90 -29.657 -17.446 -93.660 1.00 0.00 H
+ATOM 4573 1HB GLN L 90 -31.274 -16.290 -94.926 1.00 0.00 H
+ATOM 4574 2HB GLN L 90 -31.890 -16.253 -93.280 1.00 0.00 H
+ATOM 4575 1HG GLN L 90 -31.367 -13.993 -92.989 1.00 0.00 H
+ATOM 4576 2HG GLN L 90 -30.210 -13.993 -94.350 1.00 0.00 H
+ATOM 4577 1HE2 GLN L 90 -32.972 -12.168 -95.722 1.00 0.00 H
+ATOM 4578 2HE2 GLN L 90 -31.604 -11.967 -94.679 1.00 0.00 H
+ATOM 4579 N ALA L 91 -28.347 -16.014 -95.343 1.00 74.55 N
+ATOM 4580 CA ALA L 91 -27.385 -15.310 -96.180 1.00 78.16 C
+ATOM 4581 C ALA L 91 -27.941 -15.089 -97.579 1.00 84.21 C
+ATOM 4582 O ALA L 91 -27.177 -14.860 -98.521 1.00 80.13 O
+ATOM 4583 CB ALA L 91 -26.060 -16.072 -96.245 1.00 71.15 C
+ATOM 4584 H ALA L 91 -28.813 -16.831 -95.710 1.00 0.00 H
+ATOM 4585 HA ALA L 91 -27.203 -14.331 -95.737 1.00 0.00 H
+ATOM 4586 1HB ALA L 91 -25.357 -15.527 -96.876 1.00 0.00 H
+ATOM 4587 2HB ALA L 91 -25.647 -16.169 -95.241 1.00 0.00 H
+ATOM 4588 3HB ALA L 91 -26.230 -17.062 -96.664 1.00 0.00 H
+ATOM 4589 N ASN L 92 -29.263 -15.138 -97.723 1.00 90.07 N
+ATOM 4590 CA ASN L 92 -29.906 -15.189 -99.027 1.00 84.32 C
+ATOM 4591 C ASN L 92 -30.294 -13.813 -99.549 1.00 79.20 C
+ATOM 4592 O ASN L 92 -30.151 -13.552-100.746 1.00 64.86 O
+ATOM 4593 CB ASN L 92 -31.143 -16.087 -98.950 1.00 85.08 C
+ATOM 4594 CG ASN L 92 -31.887 -16.168-100.257 1.00 87.63 C
+ATOM 4595 OD1 ASN L 92 -33.104 -16.336-100.282 1.00 93.28 O
+ATOM 4596 ND2 ASN L 92 -31.159 -16.061-101.357 1.00100.55 N
+ATOM 4597 H ASN L 92 -29.836 -15.140 -96.891 1.00 0.00 H
+ATOM 4598 HA ASN L 92 -29.201 -15.612 -99.744 1.00 0.00 H
+ATOM 4599 1HB ASN L 92 -30.844 -17.094 -98.654 1.00 0.00 H
+ATOM 4600 2HB ASN L 92 -31.821 -15.708 -98.185 1.00 0.00 H
+ATOM 4601 1HD2 ASN L 92 -31.599 -16.107-102.254 1.00 0.00 H
+ATOM 4602 2HD2 ASN L 92 -30.170 -15.934-101.291 1.00 0.00 H
+ATOM 4603 N SER L 93 -30.786 -12.929 -98.684 1.00 84.14 N
+ATOM 4604 CA SER L 93 -31.289 -11.643 -99.143 1.00 84.27 C
+ATOM 4605 C SER L 93 -31.108 -10.600 -98.054 1.00 76.62 C
+ATOM 4606 O SER L 93 -30.893 -10.923 -96.884 1.00 90.78 O
+ATOM 4607 CB SER L 93 -32.768 -11.727 -99.538 1.00 96.38 C
+ATOM 4608 OG SER L 93 -33.580 -12.055 -98.424 1.00 98.24 O
+ATOM 4609 H SER L 93 -30.814 -13.145 -97.698 1.00 0.00 H
+ATOM 4610 HA SER L 93 -30.719 -11.342-100.023 1.00 0.00 H
+ATOM 4611 1HB SER L 93 -33.088 -10.772 -99.953 1.00 0.00 H
+ATOM 4612 2HB SER L 93 -32.895 -12.480-100.315 1.00 0.00 H
+ATOM 4613 HG SER L 93 -32.982 -12.145 -97.678 1.00 0.00 H
+ATOM 4614 N PHE L 94 -31.204 -9.339 -98.459 1.00 78.66 N
+ATOM 4615 CA PHE L 94 -31.251 -8.231 -97.519 1.00 70.89 C
+ATOM 4616 C PHE L 94 -32.713 -7.851 -97.283 1.00 90.65 C
+ATOM 4617 O PHE L 94 -33.519 -7.863 -98.215 1.00109.72 O
+ATOM 4618 CB PHE L 94 -30.458 -7.027 -98.033 1.00 70.28 C
+ATOM 4619 CG PHE L 94 -28.968 -7.249 -98.090 1.00 67.82 C
+ATOM 4620 CD1 PHE L 94 -28.389 -8.371 -97.519 1.00 65.40 C
+ATOM 4621 CD2 PHE L 94 -28.142 -6.316 -98.695 1.00 68.35 C
+ATOM 4622 CE1 PHE L 94 -27.020 -8.566 -97.567 1.00 63.72 C
+ATOM 4623 CE2 PHE L 94 -26.775 -6.503 -98.745 1.00 66.58 C
+ATOM 4624 CZ PHE L 94 -26.213 -7.629 -98.180 1.00 64.85 C
+ATOM 4625 H PHE L 94 -31.245 -9.146 -99.450 1.00 0.00 H
+ATOM 4626 HA PHE L 94 -30.804 -8.556 -96.578 1.00 0.00 H
+ATOM 4627 1HB PHE L 94 -30.798 -6.768 -99.035 1.00 0.00 H
+ATOM 4628 2HB PHE L 94 -30.646 -6.167 -97.391 1.00 0.00 H
+ATOM 4629 HD1 PHE L 94 -29.026 -9.107 -97.027 1.00 0.00 H
+ATOM 4630 HD2 PHE L 94 -28.587 -5.426 -99.141 1.00 0.00 H
+ATOM 4631 HE1 PHE L 94 -26.581 -9.458 -97.121 1.00 0.00 H
+ATOM 4632 HE2 PHE L 94 -26.139 -5.762 -99.229 1.00 0.00 H
+ATOM 4633 HZ PHE L 94 -25.135 -7.777 -98.216 1.00 0.00 H
+ATOM 4634 N PRO L 95 -33.068 -7.513 -96.034 1.00 86.33 N
+ATOM 4635 CA PRO L 95 -32.175 -7.436 -94.874 1.00 71.74 C
+ATOM 4636 C PRO L 95 -31.813 -8.800 -94.293 1.00 78.33 C
+ATOM 4637 O PRO L 95 -32.653 -9.701 -94.245 1.00100.01 O
+ATOM 4638 CB PRO L 95 -32.992 -6.627 -93.873 1.00 74.55 C
+ATOM 4639 CG PRO L 95 -34.400 -6.972 -94.201 1.00 76.78 C
+ATOM 4640 CD PRO L 95 -34.449 -7.133 -95.687 1.00 76.87 C
+ATOM 4641 HA PRO L 95 -31.257 -6.902 -95.159 1.00 0.00 H
+ATOM 4642 1HB PRO L 95 -32.710 -6.903 -92.846 1.00 0.00 H
+ATOM 4643 2HB PRO L 95 -32.774 -5.555 -93.989 1.00 0.00 H
+ATOM 4644 1HG PRO L 95 -34.697 -7.894 -93.679 1.00 0.00 H
+ATOM 4645 2HG PRO L 95 -35.077 -6.178 -93.853 1.00 0.00 H
+ATOM 4646 1HD PRO L 95 -35.164 -7.927 -95.947 1.00 0.00 H
+ATOM 4647 2HD PRO L 95 -34.743 -6.179 -96.150 1.00 0.00 H
+ATOM 4648 N ILE L 96 -30.556 -8.942 -93.872 1.00 66.74 N
+ATOM 4649 CA ILE L 96 -30.102 -10.169 -93.230 1.00 64.43 C
+ATOM 4650 C ILE L 96 -30.808 -10.330 -91.892 1.00 69.88 C
+ATOM 4651 O ILE L 96 -30.906 -9.380 -91.104 1.00 91.19 O
+ATOM 4652 CB ILE L 96 -28.577 -10.147 -93.059 1.00 62.65 C
+ATOM 4653 CG1 ILE L 96 -27.887 -10.377 -94.405 1.00 75.95 C
+ATOM 4654 CG2 ILE L 96 -28.132 -11.163 -92.022 1.00 61.02 C
+ATOM 4655 CD1 ILE L 96 -26.384 -10.231 -94.341 1.00 84.92 C
+ATOM 4656 H ILE L 96 -29.902 -8.183 -94.000 1.00 0.00 H
+ATOM 4657 HA ILE L 96 -30.371 -11.012 -93.866 1.00 0.00 H
+ATOM 4658 HB ILE L 96 -28.262 -9.156 -92.735 1.00 0.00 H
+ATOM 4659 1HG1 ILE L 96 -28.122 -11.377 -94.768 1.00 0.00 H
+ATOM 4660 2HG1 ILE L 96 -28.271 -9.666 -95.137 1.00 0.00 H
+ATOM 4661 1HG2 ILE L 96 -27.048 -11.128 -91.920 1.00 0.00 H
+ATOM 4662 2HG2 ILE L 96 -28.594 -10.930 -91.063 1.00 0.00 H
+ATOM 4663 3HG2 ILE L 96 -28.434 -12.162 -92.338 1.00 0.00 H
+ATOM 4664 1HD1 ILE L 96 -25.959 -10.407 -95.330 1.00 0.00 H
+ATOM 4665 2HD1 ILE L 96 -26.130 -9.223 -94.011 1.00 0.00 H
+ATOM 4666 3HD1 ILE L 96 -25.978 -10.957 -93.638 1.00 0.00 H
+ATOM 4667 N THR L 97 -31.314 -11.531 -91.628 1.00 64.35 N
+ATOM 4668 CA THR L 97 -32.107 -11.778 -90.434 1.00 73.62 C
+ATOM 4669 C THR L 97 -31.600 -13.016 -89.713 1.00 71.37 C
+ATOM 4670 O THR L 97 -31.226 -14.010 -90.344 1.00 68.88 O
+ATOM 4671 CB THR L 97 -33.595 -11.949 -90.773 1.00 67.48 C
+ATOM 4672 OG1 THR L 97 -33.750 -12.950 -91.785 1.00 66.73 O
+ATOM 4673 CG2 THR L 97 -34.176 -10.637 -91.278 1.00 70.27 C
+ATOM 4674 H THR L 97 -31.144 -12.291 -92.272 1.00 0.00 H
+ATOM 4675 HA THR L 97 -32.006 -10.920 -89.768 1.00 0.00 H
+ATOM 4676 HB THR L 97 -34.137 -12.263 -89.881 1.00 0.00 H
+ATOM 4677 HG1 THR L 97 -32.887 -13.294 -92.029 1.00 0.00 H
+ATOM 4678 1HG2 THR L 97 -35.231 -10.773 -91.514 1.00 0.00 H
+ATOM 4679 2HG2 THR L 97 -34.072 -9.873 -90.508 1.00 0.00 H
+ATOM 4680 3HG2 THR L 97 -33.642 -10.324 -92.174 1.00 0.00 H
+ATOM 4681 N PHE L 98 -31.593 -12.943 -88.384 1.00 83.89 N
+ATOM 4682 CA PHE L 98 -31.211 -14.048 -87.524 1.00 61.86 C
+ATOM 4683 C PHE L 98 -32.457 -14.680 -86.907 1.00 63.03 C
+ATOM 4684 O PHE L 98 -33.587 -14.244 -87.132 1.00 67.78 O
+ATOM 4685 CB PHE L 98 -30.265 -13.576 -86.419 1.00 61.74 C
+ATOM 4686 CG PHE L 98 -28.941 -13.065 -86.910 1.00 60.59 C
+ATOM 4687 CD1 PHE L 98 -28.799 -11.749 -87.316 1.00 61.83 C
+ATOM 4688 CD2 PHE L 98 -27.828 -13.886 -86.921 1.00 60.91 C
+ATOM 4689 CE1 PHE L 98 -27.576 -11.271 -87.749 1.00 61.26 C
+ATOM 4690 CE2 PHE L 98 -26.602 -13.413 -87.351 1.00 58.46 C
+ATOM 4691 CZ PHE L 98 -26.477 -12.105 -87.766 1.00 74.75 C
+ATOM 4692 H PHE L 98 -31.870 -12.067 -87.965 1.00 0.00 H
+ATOM 4693 HA PHE L 98 -30.692 -14.793 -88.128 1.00 0.00 H
+ATOM 4694 1HB PHE L 98 -30.740 -12.778 -85.850 1.00 0.00 H
+ATOM 4695 2HB PHE L 98 -30.071 -14.398 -85.731 1.00 0.00 H
+ATOM 4696 HD1 PHE L 98 -29.665 -11.088 -87.291 1.00 0.00 H
+ATOM 4697 HD2 PHE L 98 -27.928 -14.921 -86.593 1.00 0.00 H
+ATOM 4698 HE1 PHE L 98 -27.481 -10.236 -88.076 1.00 0.00 H
+ATOM 4699 HE2 PHE L 98 -25.735 -14.073 -87.363 1.00 0.00 H
+ATOM 4700 HZ PHE L 98 -25.513 -11.731 -88.108 1.00 0.00 H
+ATOM 4701 N GLY L 99 -32.239 -15.721 -86.105 1.00 61.98 N
+ATOM 4702 CA GLY L 99 -33.297 -16.302 -85.308 1.00 70.12 C
+ATOM 4703 C GLY L 99 -33.362 -15.680 -83.925 1.00 82.32 C
+ATOM 4704 O GLY L 99 -32.579 -14.802 -83.562 1.00 98.97 O
+ATOM 4705 H GLY L 99 -31.310 -16.115 -86.052 1.00 0.00 H
+ATOM 4706 1HA GLY L 99 -34.252 -16.163 -85.814 1.00 0.00 H
+ATOM 4707 2HA GLY L 99 -33.136 -17.375 -85.216 1.00 0.00 H
+ATOM 4708 N GLN L 100 -34.329 -16.150 -83.139 1.00 84.30 N
+ATOM 4709 CA GLN L 100 -34.479 -15.664 -81.773 1.00 88.04 C
+ATOM 4710 C GLN L 100 -33.536 -16.355 -80.795 1.00 86.53 C
+ATOM 4711 O GLN L 100 -33.552 -16.026 -79.604 1.00100.75 O
+ATOM 4712 CB GLN L 100 -35.929 -15.827 -81.302 1.00 96.88 C
+ATOM 4713 CG GLN L 100 -36.304 -17.231 -80.846 1.00112.60 C
+ATOM 4714 CD GLN L 100 -36.628 -18.167 -81.994 1.00127.76 C
+ATOM 4715 OE1 GLN L 100 -36.490 -17.811 -83.166 1.00132.09 O
+ATOM 4716 NE2 GLN L 100 -37.065 -19.376 -81.659 1.00129.69 N
+ATOM 4717 H GLN L 100 -34.969 -16.850 -83.485 1.00 0.00 H
+ATOM 4718 HA GLN L 100 -34.223 -14.605 -81.753 1.00 0.00 H
+ATOM 4719 1HB GLN L 100 -36.120 -15.149 -80.470 1.00 0.00 H
+ATOM 4720 2HB GLN L 100 -36.607 -15.552 -82.110 1.00 0.00 H
+ATOM 4721 1HG GLN L 100 -35.467 -17.658 -80.293 1.00 0.00 H
+ATOM 4722 2HG GLN L 100 -37.184 -17.171 -80.205 1.00 0.00 H
+ATOM 4723 1HE2 GLN L 100 -37.296 -20.040 -82.371 1.00 0.00 H
+ATOM 4724 2HE2 GLN L 100 -37.163 -19.623 -80.695 1.00 0.00 H
+ATOM 4725 N GLY L 101 -32.720 -17.292 -81.264 1.00 78.20 N
+ATOM 4726 CA GLY L 101 -31.776 -17.990 -80.420 1.00 66.56 C
+ATOM 4727 C GLY L 101 -32.374 -19.225 -79.768 1.00 70.58 C
+ATOM 4728 O GLY L 101 -33.586 -19.434 -79.743 1.00 73.23 O
+ATOM 4729 H GLY L 101 -32.765 -17.521 -82.247 1.00 0.00 H
+ATOM 4730 1HA GLY L 101 -30.910 -18.287 -81.011 1.00 0.00 H
+ATOM 4731 2HA GLY L 101 -31.418 -17.318 -79.641 1.00 0.00 H
+ATOM 4732 N THR L 102 -31.485 -20.060 -79.233 1.00 80.74 N
+ATOM 4733 CA THR L 102 -31.869 -21.261 -78.498 1.00 78.67 C
+ATOM 4734 C THR L 102 -30.872 -21.471 -77.371 1.00 83.24 C
+ATOM 4735 O THR L 102 -29.685 -21.695 -77.626 1.00 88.10 O
+ATOM 4736 CB THR L 102 -31.912 -22.493 -79.411 1.00 72.37 C
+ATOM 4737 OG1 THR L 102 -32.945 -22.334 -80.392 1.00 71.46 O
+ATOM 4738 CG2 THR L 102 -32.175 -23.752 -78.603 1.00 69.98 C
+ATOM 4739 H THR L 102 -30.505 -19.845 -79.346 1.00 0.00 H
+ATOM 4740 HA THR L 102 -32.867 -21.110 -78.086 1.00 0.00 H
+ATOM 4741 HB THR L 102 -30.959 -22.595 -79.929 1.00 0.00 H
+ATOM 4742 HG1 THR L 102 -33.383 -21.490 -80.261 1.00 0.00 H
+ATOM 4743 1HG2 THR L 102 -32.201 -24.613 -79.270 1.00 0.00 H
+ATOM 4744 2HG2 THR L 102 -31.381 -23.885 -77.868 1.00 0.00 H
+ATOM 4745 3HG2 THR L 102 -33.132 -23.662 -78.090 1.00 0.00 H
+ATOM 4746 N ARG L 103 -31.346 -21.388 -76.131 1.00 79.58 N
+ATOM 4747 CA ARG L 103 -30.490 -21.633 -74.979 1.00 79.02 C
+ATOM 4748 C ARG L 103 -30.384 -23.128 -74.717 1.00 74.26 C
+ATOM 4749 O ARG L 103 -31.399 -23.821 -74.595 1.00 73.15 O
+ATOM 4750 CB ARG L 103 -31.028 -20.918 -73.741 1.00 94.12 C
+ATOM 4751 CG ARG L 103 -30.622 -19.461 -73.639 1.00113.37 C
+ATOM 4752 CD ARG L 103 -31.045 -18.849 -72.307 1.00124.43 C
+ATOM 4753 NE ARG L 103 -30.442 -19.518 -71.155 1.00123.46 N
+ATOM 4754 CZ ARG L 103 -31.086 -20.365 -70.356 1.00117.00 C
+ATOM 4755 NH1 ARG L 103 -32.363 -20.650 -70.577 1.00112.23 N
+ATOM 4756 NH2 ARG L 103 -30.455 -20.924 -69.330 1.00108.59 N
+ATOM 4757 H ARG L 103 -32.316 -21.151 -75.981 1.00 0.00 H
+ATOM 4758 HA ARG L 103 -29.495 -21.244 -75.198 1.00 0.00 H
+ATOM 4759 1HB ARG L 103 -32.116 -20.965 -73.738 1.00 0.00 H
+ATOM 4760 2HB ARG L 103 -30.676 -21.429 -72.844 1.00 0.00 H
+ATOM 4761 1HG ARG L 103 -29.538 -19.378 -73.725 1.00 0.00 H
+ATOM 4762 2HG ARG L 103 -31.095 -18.894 -74.442 1.00 0.00 H
+ATOM 4763 1HD ARG L 103 -30.745 -17.802 -72.276 1.00 0.00 H
+ATOM 4764 2HD ARG L 103 -32.127 -18.919 -72.202 1.00 0.00 H
+ATOM 4765 HE ARG L 103 -29.470 -19.323 -70.953 1.00 0.00 H
+ATOM 4766 1HH1 ARG L 103 -32.849 -20.224 -71.353 1.00 0.00 H
+ATOM 4767 2HH1 ARG L 103 -32.849 -21.293 -69.969 1.00 0.00 H
+ATOM 4768 1HH2 ARG L 103 -29.483 -20.706 -69.155 1.00 0.00 H
+ATOM 4769 2HH2 ARG L 103 -30.945 -21.566 -68.725 1.00 0.00 H
+ATOM 4770 N LEU L 104 -29.153 -23.623 -74.637 1.00 72.52 N
+ATOM 4771 CA LEU L 104 -28.875 -25.010 -74.297 1.00 71.78 C
+ATOM 4772 C LEU L 104 -28.308 -25.061 -72.885 1.00 78.53 C
+ATOM 4773 O LEU L 104 -27.354 -24.342 -72.571 1.00 84.80 O
+ATOM 4774 CB LEU L 104 -27.896 -25.632 -75.293 1.00 71.70 C
+ATOM 4775 CG LEU L 104 -27.864 -27.159 -75.300 1.00 69.36 C
+ATOM 4776 CD1 LEU L 104 -29.225 -27.703 -75.683 1.00 63.59 C
+ATOM 4777 CD2 LEU L 104 -26.789 -27.671 -76.242 1.00 76.32 C
+ATOM 4778 H LEU L 104 -28.382 -22.998 -74.823 1.00 0.00 H
+ATOM 4779 HA LEU L 104 -29.809 -25.570 -74.337 1.00 0.00 H
+ATOM 4780 1HB LEU L 104 -28.159 -25.295 -76.295 1.00 0.00 H
+ATOM 4781 2HB LEU L 104 -26.892 -25.274 -75.064 1.00 0.00 H
+ATOM 4782 HG LEU L 104 -27.652 -27.523 -74.294 1.00 0.00 H
+ATOM 4783 1HD1 LEU L 104 -29.194 -28.793 -75.685 1.00 0.00 H
+ATOM 4784 2HD1 LEU L 104 -29.969 -27.364 -74.962 1.00 0.00 H
+ATOM 4785 3HD1 LEU L 104 -29.493 -27.346 -76.677 1.00 0.00 H
+ATOM 4786 1HD2 LEU L 104 -26.784 -28.761 -76.230 1.00 0.00 H
+ATOM 4787 2HD2 LEU L 104 -26.994 -27.320 -77.254 1.00 0.00 H
+ATOM 4788 3HD2 LEU L 104 -25.816 -27.300 -75.920 1.00 0.00 H
+ATOM 4789 N GLU L 105 -28.894 -25.909 -72.042 1.00 77.23 N
+ATOM 4790 CA GLU L 105 -28.599 -25.942 -70.616 1.00 74.09 C
+ATOM 4791 C GLU L 105 -28.376 -27.379 -70.163 1.00 83.20 C
+ATOM 4792 O GLU L 105 -29.017 -28.305 -70.669 1.00 81.47 O
+ATOM 4793 CB GLU L 105 -29.742 -25.282 -69.820 1.00 74.23 C
+ATOM 4794 CG GLU L 105 -30.039 -25.901 -68.462 1.00 93.70 C
+ATOM 4795 CD GLU L 105 -31.273 -25.305 -67.810 1.00114.68 C
+ATOM 4796 OE1 GLU L 105 -31.656 -24.174 -68.180 1.00116.96 O
+ATOM 4797 OE2 GLU L 105 -31.868 -25.972 -66.936 1.00124.11 O
+ATOM 4798 H GLU L 105 -29.573 -26.555 -72.419 1.00 0.00 H
+ATOM 4799 HA GLU L 105 -27.680 -25.382 -70.440 1.00 0.00 H
+ATOM 4800 1HB GLU L 105 -29.508 -24.231 -69.652 1.00 0.00 H
+ATOM 4801 2HB GLU L 105 -30.662 -25.324 -70.402 1.00 0.00 H
+ATOM 4802 1HG GLU L 105 -30.186 -26.973 -68.587 1.00 0.00 H
+ATOM 4803 2HG GLU L 105 -29.178 -25.754 -67.811 1.00 0.00 H
+ATOM 4804 N ILE L 106 -27.456 -27.564 -69.214 1.00 95.30 N
+ATOM 4805 CA ILE L 106 -27.118 -28.896 -68.722 1.00 92.06 C
+ATOM 4806 C ILE L 106 -28.196 -29.374 -67.760 1.00 89.79 C
+ATOM 4807 O ILE L 106 -28.681 -28.613 -66.913 1.00 80.72 O
+ATOM 4808 CB ILE L 106 -25.748 -28.904 -68.019 1.00 82.45 C
+ATOM 4809 CG1 ILE L 106 -24.634 -28.578 -69.016 1.00 92.31 C
+ATOM 4810 CG2 ILE L 106 -25.498 -30.251 -67.358 1.00 71.69 C
+ATOM 4811 CD1 ILE L 106 -23.292 -28.318 -68.370 1.00 0.00 C
+ATOM 4812 H ILE L 106 -26.981 -26.761 -68.826 1.00 0.00 H
+ATOM 4813 HA ILE L 106 -27.086 -29.580 -69.570 1.00 0.00 H
+ATOM 4814 HB ILE L 106 -25.727 -28.126 -67.256 1.00 0.00 H
+ATOM 4815 1HG1 ILE L 106 -24.521 -29.403 -69.718 1.00 0.00 H
+ATOM 4816 2HG1 ILE L 106 -24.909 -27.695 -69.594 1.00 0.00 H
+ATOM 4817 1HG2 ILE L 106 -24.526 -30.239 -66.866 1.00 0.00 H
+ATOM 4818 2HG2 ILE L 106 -26.275 -30.444 -66.620 1.00 0.00 H
+ATOM 4819 3HG2 ILE L 106 -25.513 -31.036 -68.114 1.00 0.00 H
+ATOM 4820 1HD1 ILE L 106 -22.554 -28.094 -69.140 1.00 0.00 H
+ATOM 4821 2HD1 ILE L 106 -23.375 -27.471 -67.688 1.00 0.00 H
+ATOM 4822 3HD1 ILE L 106 -22.979 -29.202 -67.815 1.00 0.00 H
+ATOM 4823 N LYS L 107 -28.571 -30.644 -67.883 1.00 93.08 N
+ATOM 4824 CA LYS L 107 -29.554 -31.261 -67.003 1.00 84.62 C
+ATOM 4825 C LYS L 107 -28.836 -31.990 -65.875 1.00 95.43 C
+ATOM 4826 O LYS L 107 -27.922 -32.782 -66.125 1.00110.30 O
+ATOM 4827 CB LYS L 107 -30.455 -32.224 -67.778 1.00 72.10 C
+ATOM 4828 CG LYS L 107 -31.565 -32.853 -66.946 1.00 0.00 C
+ATOM 4829 CD LYS L 107 -32.452 -33.751 -67.797 1.00 0.00 C
+ATOM 4830 CE LYS L 107 -33.550 -34.394 -66.964 1.00 0.00 C
+ATOM 4831 NZ LYS L 107 -34.426 -35.276 -67.783 1.00 0.00 N
+ATOM 4832 H LYS L 107 -28.153 -31.197 -68.618 1.00 0.00 H
+ATOM 4833 HA LYS L 107 -30.180 -30.475 -66.579 1.00 0.00 H
+ATOM 4834 1HB LYS L 107 -30.920 -31.697 -68.611 1.00 0.00 H
+ATOM 4835 2HB LYS L 107 -29.852 -33.030 -68.195 1.00 0.00 H
+ATOM 4836 1HG LYS L 107 -31.127 -33.446 -66.143 1.00 0.00 H
+ATOM 4837 2HG LYS L 107 -32.177 -32.068 -66.502 1.00 0.00 H
+ATOM 4838 1HD LYS L 107 -32.909 -33.162 -68.593 1.00 0.00 H
+ATOM 4839 2HD LYS L 107 -31.846 -34.535 -68.250 1.00 0.00 H
+ATOM 4840 1HE LYS L 107 -33.103 -34.987 -66.167 1.00 0.00 H
+ATOM 4841 2HE LYS L 107 -34.164 -33.617 -66.508 1.00 0.00 H
+ATOM 4842 1HZ LYS L 107 -35.140 -35.682 -67.195 1.00 0.00 H
+ATOM 4843 2HZ LYS L 107 -34.862 -34.732 -68.515 1.00 0.00 H
+ATOM 4844 3HZ LYS L 107 -33.871 -36.012 -68.196 1.00 0.00 H
+ATOM 4845 N ARG L 108 -29.249 -31.713 -64.639 1.00 86.08 N
+ATOM 4846 CA ARG L 108 -28.719 -32.384 -63.462 1.00 84.68 C
+ATOM 4847 C ARG L 108 -29.886 -32.762 -62.558 1.00 84.44 C
+ATOM 4848 O ARG L 108 -31.053 -32.523 -62.884 1.00 81.17 O
+ATOM 4849 CB ARG L 108 -27.713 -31.498 -62.720 1.00 90.03 C
+ATOM 4850 CG ARG L 108 -28.352 -30.371 -61.922 1.00 91.95 C
+ATOM 4851 CD ARG L 108 -27.317 -29.614 -61.113 1.00 99.57 C
+ATOM 4852 NE ARG L 108 -26.595 -30.472 -60.178 1.00101.96 N
+ATOM 4853 CZ ARG L 108 -26.885 -30.580 -58.887 1.00107.72 C
+ATOM 4854 NH1 ARG L 108 -27.882 -29.876 -58.371 1.00105.61 N
+ATOM 4855 NH2 ARG L 108 -26.174 -31.386 -58.110 1.00125.52 N
+ATOM 4856 H ARG L 108 -29.961 -31.006 -64.523 1.00 0.00 H
+ATOM 4857 HA ARG L 108 -28.204 -33.290 -63.783 1.00 0.00 H
+ATOM 4858 1HB ARG L 108 -27.128 -32.108 -62.034 1.00 0.00 H
+ATOM 4859 2HB ARG L 108 -27.021 -31.055 -63.436 1.00 0.00 H
+ATOM 4860 1HG ARG L 108 -28.838 -29.673 -62.604 1.00 0.00 H
+ATOM 4861 2HG ARG L 108 -29.093 -30.785 -61.237 1.00 0.00 H
+ATOM 4862 1HD ARG L 108 -26.587 -29.165 -61.786 1.00 0.00 H
+ATOM 4863 2HD ARG L 108 -27.808 -28.831 -60.536 1.00 0.00 H
+ATOM 4864 HE ARG L 108 -25.825 -31.018 -60.540 1.00 0.00 H
+ATOM 4865 1HH1 ARG L 108 -28.421 -29.257 -58.960 1.00 0.00 H
+ATOM 4866 2HH1 ARG L 108 -28.103 -29.958 -57.389 1.00 0.00 H
+ATOM 4867 1HH2 ARG L 108 -25.409 -31.920 -58.501 1.00 0.00 H
+ATOM 4868 2HH2 ARG L 108 -26.396 -31.467 -57.129 1.00 0.00 H
+ATOM 4869 N THR L 109 -29.562 -33.362 -61.414 1.00 89.81 N
+ATOM 4870 CA THR L 109 -30.575 -33.706 -60.424 1.00 87.80 C
+ATOM 4871 C THR L 109 -31.145 -32.441 -59.795 1.00 85.08 C
+ATOM 4872 O THR L 109 -30.435 -31.448 -59.613 1.00 89.30 O
+ATOM 4873 CB THR L 109 -29.973 -34.608 -59.344 1.00112.04 C
+ATOM 4874 OG1 THR L 109 -29.371 -35.755 -59.956 1.00115.56 O
+ATOM 4875 CG2 THR L 109 -31.035 -35.069 -58.354 1.00128.16 C
+ATOM 4876 H THR L 109 -28.595 -33.584 -61.226 1.00 0.00 H
+ATOM 4877 HA THR L 109 -31.379 -34.246 -60.925 1.00 0.00 H
+ATOM 4878 HB THR L 109 -29.202 -34.061 -58.802 1.00 0.00 H
+ATOM 4879 HG1 THR L 109 -29.479 -35.702 -60.909 1.00 0.00 H
+ATOM 4880 1HG2 THR L 109 -30.576 -35.707 -57.599 1.00 0.00 H
+ATOM 4881 2HG2 THR L 109 -31.484 -34.201 -57.871 1.00 0.00 H
+ATOM 4882 3HG2 THR L 109 -31.806 -35.629 -58.882 1.00 0.00 H
+ATOM 4883 N VAL L 110 -32.442 -32.476 -59.476 1.00 86.38 N
+ATOM 4884 CA VAL L 110 -33.077 -31.337 -58.824 1.00 99.35 C
+ATOM 4885 C VAL L 110 -32.373 -31.041 -57.506 1.00 95.60 C
+ATOM 4886 O VAL L 110 -31.971 -31.954 -56.772 1.00 99.41 O
+ATOM 4887 CB VAL L 110 -34.575 -31.611 -58.608 1.00102.57 C
+ATOM 4888 CG1 VAL L 110 -35.258 -30.397 -57.987 1.00 95.14 C
+ATOM 4889 CG2 VAL L 110 -35.236 -31.993 -59.923 1.00 98.50 C
+ATOM 4890 H VAL L 110 -32.995 -33.295 -59.685 1.00 0.00 H
+ATOM 4891 HA VAL L 110 -32.971 -30.465 -59.470 1.00 0.00 H
+ATOM 4892 HB VAL L 110 -34.686 -32.430 -57.897 1.00 0.00 H
+ATOM 4893 1HG1 VAL L 110 -36.317 -30.610 -57.841 1.00 0.00 H
+ATOM 4894 2HG1 VAL L 110 -34.798 -30.173 -57.025 1.00 0.00 H
+ATOM 4895 3HG1 VAL L 110 -35.149 -29.539 -58.651 1.00 0.00 H
+ATOM 4896 1HG2 VAL L 110 -36.295 -32.185 -59.755 1.00 0.00 H
+ATOM 4897 2HG2 VAL L 110 -35.123 -31.177 -60.637 1.00 0.00 H
+ATOM 4898 3HG2 VAL L 110 -34.763 -32.891 -60.320 1.00 0.00 H
+ATOM 4899 N ALA L 111 -32.205 -29.752 -57.209 1.00 86.83 N
+ATOM 4900 CA ALA L 111 -31.504 -29.307 -56.009 1.00 97.55 C
+ATOM 4901 C ALA L 111 -32.278 -28.157 -55.381 1.00 97.80 C
+ATOM 4902 O ALA L 111 -32.484 -27.123 -56.025 1.00 91.11 O
+ATOM 4903 CB ALA L 111 -30.072 -28.875 -56.336 1.00102.13 C
+ATOM 4904 H ALA L 111 -32.580 -29.062 -57.844 1.00 0.00 H
+ATOM 4905 HA ALA L 111 -31.463 -30.143 -55.311 1.00 0.00 H
+ATOM 4906 1HB ALA L 111 -29.573 -28.548 -55.424 1.00 0.00 H
+ATOM 4907 2HB ALA L 111 -29.528 -29.716 -56.766 1.00 0.00 H
+ATOM 4908 3HB ALA L 111 -30.094 -28.054 -57.051 1.00 0.00 H
+ATOM 4909 N ALA L 112 -32.692 -28.332 -54.129 1.00101.11 N
+ATOM 4910 CA ALA L 112 -33.474 -27.306 -53.458 1.00105.15 C
+ATOM 4911 C ALA L 112 -32.612 -26.075 -53.182 1.00110.82 C
+ATOM 4912 O ALA L 112 -31.426 -26.206 -52.860 1.00107.59 O
+ATOM 4913 CB ALA L 112 -34.053 -27.844 -52.152 1.00119.20 C
+ATOM 4914 H ALA L 112 -32.466 -29.182 -53.632 1.00 0.00 H
+ATOM 4915 HA ALA L 112 -34.295 -27.021 -54.116 1.00 0.00 H
+ATOM 4916 1HB ALA L 112 -34.635 -27.063 -51.663 1.00 0.00 H
+ATOM 4917 2HB ALA L 112 -34.697 -28.698 -52.364 1.00 0.00 H
+ATOM 4918 3HB ALA L 112 -33.242 -28.156 -51.496 1.00 0.00 H
+ATOM 4919 N PRO L 113 -33.173 -24.873 -53.297 1.00115.71 N
+ATOM 4920 CA PRO L 113 -32.387 -23.662 -53.039 1.00112.21 C
+ATOM 4921 C PRO L 113 -32.122 -23.464 -51.556 1.00110.29 C
+ATOM 4922 O PRO L 113 -32.809 -24.011 -50.691 1.00107.31 O
+ATOM 4923 CB PRO L 113 -33.275 -22.542 -53.591 1.00110.28 C
+ATOM 4924 CG PRO L 113 -34.661 -23.076 -53.448 1.00110.72 C
+ATOM 4925 CD PRO L 113 -34.550 -24.557 -53.717 1.00111.33 C
+ATOM 4926 HA PRO L 113 -31.440 -23.720 -53.595 1.00 0.00 H
+ATOM 4927 1HB PRO L 113 -33.112 -21.616 -53.020 1.00 0.00 H
+ATOM 4928 2HB PRO L 113 -33.004 -22.327 -54.635 1.00 0.00 H
+ATOM 4929 1HG PRO L 113 -35.047 -22.866 -52.440 1.00 0.00 H
+ATOM 4930 2HG PRO L 113 -35.336 -22.575 -54.158 1.00 0.00 H
+ATOM 4931 1HD PRO L 113 -35.293 -25.097 -53.111 1.00 0.00 H
+ATOM 4932 2HD PRO L 113 -34.710 -24.749 -54.788 1.00 0.00 H
+ATOM 4933 N SER L 114 -31.096 -22.662 -51.270 1.00 99.95 N
+ATOM 4934 CA SER L 114 -30.816 -22.196 -49.915 1.00102.95 C
+ATOM 4935 C SER L 114 -31.247 -20.736 -49.824 1.00107.84 C
+ATOM 4936 O SER L 114 -30.643 -19.865 -50.458 1.00122.81 O
+ATOM 4937 CB SER L 114 -29.338 -22.362 -49.569 1.00102.64 C
+ATOM 4938 OG SER L 114 -28.973 -23.731 -49.544 1.00113.36 O
+ATOM 4939 H SER L 114 -30.493 -22.369 -52.025 1.00 0.00 H
+ATOM 4940 HA SER L 114 -31.401 -22.795 -49.215 1.00 0.00 H
+ATOM 4941 1HB SER L 114 -28.731 -21.834 -50.304 1.00 0.00 H
+ATOM 4942 2HB SER L 114 -29.139 -21.912 -48.597 1.00 0.00 H
+ATOM 4943 HG SER L 114 -29.770 -24.221 -49.757 1.00 0.00 H
+ATOM 4944 N VAL L 115 -32.289 -20.471 -49.038 1.00 94.23 N
+ATOM 4945 CA VAL L 115 -32.945 -19.166 -49.011 1.00 86.18 C
+ATOM 4946 C VAL L 115 -32.382 -18.336 -47.866 1.00 85.08 C
+ATOM 4947 O VAL L 115 -32.395 -18.768 -46.707 1.00 98.93 O
+ATOM 4948 CB VAL L 115 -34.470 -19.311 -48.880 1.00 89.44 C
+ATOM 4949 CG1 VAL L 115 -35.124 -17.941 -48.823 1.00 87.74 C
+ATOM 4950 CG2 VAL L 115 -35.027 -20.128 -50.035 1.00104.67 C
+ATOM 4951 H VAL L 115 -32.634 -21.207 -48.439 1.00 0.00 H
+ATOM 4952 HA VAL L 115 -32.730 -18.651 -49.948 1.00 0.00 H
+ATOM 4953 HB VAL L 115 -34.698 -19.815 -47.941 1.00 0.00 H
+ATOM 4954 1HG1 VAL L 115 -36.204 -18.057 -48.730 1.00 0.00 H
+ATOM 4955 2HG1 VAL L 115 -34.743 -17.392 -47.962 1.00 0.00 H
+ATOM 4956 3HG1 VAL L 115 -34.896 -17.391 -49.736 1.00 0.00 H
+ATOM 4957 1HG2 VAL L 115 -36.107 -20.222 -49.927 1.00 0.00 H
+ATOM 4958 2HG2 VAL L 115 -34.798 -19.629 -50.977 1.00 0.00 H
+ATOM 4959 3HG2 VAL L 115 -34.575 -21.120 -50.030 1.00 0.00 H
+ATOM 4960 N PHE L 116 -31.903 -17.136 -48.191 1.00 92.45 N
+ATOM 4961 CA PHE L 116 -31.412 -16.176 -47.214 1.00 89.42 C
+ATOM 4962 C PHE L 116 -32.146 -14.857 -47.407 1.00 91.48 C
+ATOM 4963 O PHE L 116 -32.741 -14.606 -48.457 1.00 96.82 O
+ATOM 4964 CB PHE L 116 -29.895 -15.960 -47.344 1.00 78.51 C
+ATOM 4965 CG PHE L 116 -29.087 -17.225 -47.239 1.00 85.59 C
+ATOM 4966 CD1 PHE L 116 -28.591 -17.648 -46.019 1.00 89.75 C
+ATOM 4967 CD2 PHE L 116 -28.823 -17.991 -48.362 1.00 97.06 C
+ATOM 4968 CE1 PHE L 116 -27.847 -18.810 -45.920 1.00 97.89 C
+ATOM 4969 CE2 PHE L 116 -28.080 -19.155 -48.269 1.00 96.30 C
+ATOM 4970 CZ PHE L 116 -27.592 -19.564 -47.047 1.00 92.89 C
+ATOM 4971 H PHE L 116 -31.886 -16.893 -49.171 1.00 0.00 H
+ATOM 4972 HA PHE L 116 -31.614 -16.565 -46.215 1.00 0.00 H
+ATOM 4973 1HB PHE L 116 -29.675 -15.496 -48.305 1.00 0.00 H
+ATOM 4974 2HB PHE L 116 -29.557 -15.277 -46.566 1.00 0.00 H
+ATOM 4975 HD1 PHE L 116 -28.793 -17.054 -45.127 1.00 0.00 H
+ATOM 4976 HD2 PHE L 116 -29.209 -17.667 -49.329 1.00 0.00 H
+ATOM 4977 HE1 PHE L 116 -27.463 -19.129 -44.952 1.00 0.00 H
+ATOM 4978 HE2 PHE L 116 -27.880 -19.748 -49.161 1.00 0.00 H
+ATOM 4979 HZ PHE L 116 -27.006 -20.479 -46.971 1.00 0.00 H
+ATOM 4980 N ILE L 117 -32.108 -14.010 -46.382 1.00 88.82 N
+ATOM 4981 CA ILE L 117 -32.736 -12.694 -46.446 1.00 94.93 C
+ATOM 4982 C ILE L 117 -31.859 -11.694 -45.703 1.00 98.98 C
+ATOM 4983 O ILE L 117 -31.384 -11.971 -44.596 1.00 96.52 O
+ATOM 4984 CB ILE L 117 -34.171 -12.709 -45.878 1.00100.20 C
+ATOM 4985 CG1 ILE L 117 -34.796 -11.312 -45.954 1.00101.13 C
+ATOM 4986 CG2 ILE L 117 -34.197 -13.257 -44.454 1.00101.71 C
+ATOM 4987 CD1 ILE L 117 -36.293 -11.304 -45.738 1.00108.56 C
+ATOM 4988 H ILE L 117 -31.631 -14.287 -45.536 1.00 0.00 H
+ATOM 4989 HA ILE L 117 -32.793 -12.388 -47.490 1.00 0.00 H
+ATOM 4990 HB ILE L 117 -34.803 -13.339 -46.503 1.00 0.00 H
+ATOM 4991 1HG1 ILE L 117 -34.338 -10.667 -45.205 1.00 0.00 H
+ATOM 4992 2HG1 ILE L 117 -34.590 -10.874 -46.931 1.00 0.00 H
+ATOM 4993 1HG2 ILE L 117 -35.221 -13.254 -44.082 1.00 0.00 H
+ATOM 4994 2HG2 ILE L 117 -33.812 -14.276 -44.449 1.00 0.00 H
+ATOM 4995 3HG2 ILE L 117 -33.576 -12.632 -43.812 1.00 0.00 H
+ATOM 4996 1HD1 ILE L 117 -36.665 -10.281 -45.806 1.00 0.00 H
+ATOM 4997 2HD1 ILE L 117 -36.774 -11.917 -46.501 1.00 0.00 H
+ATOM 4998 3HD1 ILE L 117 -36.520 -11.707 -44.752 1.00 0.00 H
+ATOM 4999 N PHE L 118 -31.629 -10.539 -46.323 1.00 99.85 N
+ATOM 5000 CA PHE L 118 -30.769 -9.504 -45.767 1.00 85.28 C
+ATOM 5001 C PHE L 118 -31.561 -8.215 -45.606 1.00 84.16 C
+ATOM 5002 O PHE L 118 -32.127 -7.707 -46.593 1.00 89.12 O
+ATOM 5003 CB PHE L 118 -29.544 -9.267 -46.651 1.00 78.31 C
+ATOM 5004 CG PHE L 118 -28.662 -10.471 -46.800 1.00 76.54 C
+ATOM 5005 CD1 PHE L 118 -27.650 -10.718 -45.890 1.00 81.11 C
+ATOM 5006 CD2 PHE L 118 -28.835 -11.349 -47.855 1.00 76.41 C
+ATOM 5007 CE1 PHE L 118 -26.834 -11.821 -46.023 1.00 88.08 C
+ATOM 5008 CE2 PHE L 118 -28.019 -12.456 -47.996 1.00 84.35 C
+ATOM 5009 CZ PHE L 118 -27.017 -12.692 -47.077 1.00 88.74 C
+ATOM 5010 H PHE L 118 -32.074 -10.382 -47.216 1.00 0.00 H
+ATOM 5011 HA PHE L 118 -30.424 -9.831 -44.785 1.00 0.00 H
+ATOM 5012 1HB PHE L 118 -29.867 -8.957 -47.644 1.00 0.00 H
+ATOM 5013 2HB PHE L 118 -28.946 -8.458 -46.234 1.00 0.00 H
+ATOM 5014 HD1 PHE L 118 -27.501 -10.028 -45.059 1.00 0.00 H
+ATOM 5015 HD2 PHE L 118 -29.627 -11.160 -48.580 1.00 0.00 H
+ATOM 5016 HE1 PHE L 118 -26.044 -12.005 -45.295 1.00 0.00 H
+ATOM 5017 HE2 PHE L 118 -28.164 -13.141 -48.831 1.00 0.00 H
+ATOM 5018 HZ PHE L 118 -26.371 -13.563 -47.184 1.00 0.00 H
+ATOM 5019 N PRO L 119 -31.624 -7.665 -44.397 1.00 88.39 N
+ATOM 5020 CA PRO L 119 -32.344 -6.414 -44.170 1.00 94.15 C
+ATOM 5021 C PRO L 119 -31.501 -5.223 -44.587 1.00 97.90 C
+ATOM 5022 O PRO L 119 -30.284 -5.356 -44.788 1.00 99.89 O
+ATOM 5023 CB PRO L 119 -32.580 -6.428 -42.653 1.00 91.50 C
+ATOM 5024 CG PRO L 119 -31.414 -7.185 -42.118 1.00 88.27 C
+ATOM 5025 CD PRO L 119 -31.076 -8.228 -43.150 1.00 90.68 C
+ATOM 5026 HA PRO L 119 -33.297 -6.440 -44.719 1.00 0.00 H
+ATOM 5027 1HB PRO L 119 -32.636 -5.398 -42.271 1.00 0.00 H
+ATOM 5028 2HB PRO L 119 -33.544 -6.907 -42.427 1.00 0.00 H
+ATOM 5029 1HG PRO L 119 -30.569 -6.504 -41.937 1.00 0.00 H
+ATOM 5030 2HG PRO L 119 -31.668 -7.640 -41.149 1.00 0.00 H
+ATOM 5031 1HD PRO L 119 -29.984 -8.348 -43.207 1.00 0.00 H
+ATOM 5032 2HD PRO L 119 -31.558 -9.180 -42.882 1.00 0.00 H
+ATOM 5033 N PRO L 120 -32.103 -4.040 -44.720 1.00 97.42 N
+ATOM 5034 CA PRO L 120 -31.330 -2.876 -45.167 1.00 96.38 C
+ATOM 5035 C PRO L 120 -30.371 -2.392 -44.092 1.00 91.67 C
+ATOM 5036 O PRO L 120 -30.725 -2.293 -42.915 1.00108.23 O
+ATOM 5037 CB PRO L 120 -32.408 -1.829 -45.463 1.00 93.85 C
+ATOM 5038 CG PRO L 120 -33.526 -2.196 -44.562 1.00 86.76 C
+ATOM 5039 CD PRO L 120 -33.520 -3.699 -44.497 1.00 92.08 C
+ATOM 5040 HA PRO L 120 -30.778 -3.138 -46.081 1.00 0.00 H
+ATOM 5041 1HB PRO L 120 -32.016 -0.820 -45.268 1.00 0.00 H
+ATOM 5042 2HB PRO L 120 -32.686 -1.866 -46.527 1.00 0.00 H
+ATOM 5043 1HG PRO L 120 -33.381 -1.740 -43.571 1.00 0.00 H
+ATOM 5044 2HG PRO L 120 -34.475 -1.804 -44.956 1.00 0.00 H
+ATOM 5045 1HD PRO L 120 -33.864 -4.025 -43.504 1.00 0.00 H
+ATOM 5046 2HD PRO L 120 -34.171 -4.103 -45.286 1.00 0.00 H
+ATOM 5047 N SER L 121 -29.148 -2.087 -44.513 1.00 81.72 N
+ATOM 5048 CA SER L 121 -28.167 -1.519 -43.603 1.00 97.12 C
+ATOM 5049 C SER L 121 -28.601 -0.126 -43.161 1.00 98.66 C
+ATOM 5050 O SER L 121 -29.343 0.570 -43.860 1.00 95.10 O
+ATOM 5051 CB SER L 121 -26.793 -1.460 -44.270 1.00101.27 C
+ATOM 5052 OG SER L 121 -26.823 -0.646 -45.428 1.00104.21 O
+ATOM 5053 H SER L 121 -28.890 -2.249 -45.476 1.00 0.00 H
+ATOM 5054 HA SER L 121 -28.101 -2.159 -42.722 1.00 0.00 H
+ATOM 5055 1HB SER L 121 -26.063 -1.065 -43.564 1.00 0.00 H
+ATOM 5056 2HB SER L 121 -26.476 -2.467 -44.539 1.00 0.00 H
+ATOM 5057 HG SER L 121 -27.726 -0.327 -45.504 1.00 0.00 H
+ATOM 5058 N ASP L 122 -28.132 0.279 -41.978 1.00105.28 N
+ATOM 5059 CA ASP L 122 -28.522 1.576 -41.436 1.00111.01 C
+ATOM 5060 C ASP L 122 -27.937 2.737 -42.230 1.00111.60 C
+ATOM 5061 O ASP L 122 -28.471 3.850 -42.155 1.00111.23 O
+ATOM 5062 CB ASP L 122 -28.086 1.690 -39.973 1.00105.89 C
+ATOM 5063 CG ASP L 122 -28.898 0.800 -39.042 1.00 0.00 C
+ATOM 5064 OD1 ASP L 122 -29.931 0.328 -39.454 1.00 0.00 O
+ATOM 5065 OD2 ASP L 122 -28.478 0.601 -37.927 1.00 0.00 O
+ATOM 5066 H ASP L 122 -27.504 -0.307 -41.447 1.00 0.00 H
+ATOM 5067 HA ASP L 122 -29.607 1.666 -41.501 1.00 0.00 H
+ATOM 5068 1HB ASP L 122 -27.034 1.418 -39.885 1.00 0.00 H
+ATOM 5069 2HB ASP L 122 -28.186 2.724 -39.643 1.00 0.00 H
+ATOM 5070 N GLU L 123 -26.865 2.502 -42.993 1.00111.79 N
+ATOM 5071 CA GLU L 123 -26.266 3.568 -43.791 1.00119.50 C
+ATOM 5072 C GLU L 123 -27.260 4.114 -44.809 1.00122.22 C
+ATOM 5073 O GLU L 123 -27.555 5.315 -44.828 1.00134.10 O
+ATOM 5074 CB GLU L 123 -25.004 3.063 -44.496 1.00122.82 C
+ATOM 5075 CG GLU L 123 -23.889 2.595 -43.575 1.00127.10 C
+ATOM 5076 CD GLU L 123 -24.032 1.138 -43.175 1.00123.12 C
+ATOM 5077 OE1 GLU L 123 -25.124 0.754 -42.703 1.00122.22 O
+ATOM 5078 OE2 GLU L 123 -23.055 0.376 -43.342 1.00108.51 O
+ATOM 5079 H GLU L 123 -26.459 1.578 -43.023 1.00 0.00 H
+ATOM 5080 HA GLU L 123 -25.990 4.386 -43.124 1.00 0.00 H
+ATOM 5081 1HB GLU L 123 -25.261 2.228 -45.148 1.00 0.00 H
+ATOM 5082 2HB GLU L 123 -24.597 3.855 -45.124 1.00 0.00 H
+ATOM 5083 1HG GLU L 123 -22.933 2.731 -44.081 1.00 0.00 H
+ATOM 5084 2HG GLU L 123 -23.887 3.216 -42.680 1.00 0.00 H
+ATOM 5085 N GLN L 124 -27.791 3.241 -45.669 1.00102.57 N
+ATOM 5086 CA GLN L 124 -28.711 3.704 -46.702 1.00106.65 C
+ATOM 5087 C GLN L 124 -30.030 4.179 -46.104 1.00111.77 C
+ATOM 5088 O GLN L 124 -30.626 5.145 -46.597 1.00117.91 O
+ATOM 5089 CB GLN L 124 -28.949 2.602 -47.735 1.00107.58 C
+ATOM 5090 CG GLN L 124 -29.393 1.266 -47.170 1.00103.41 C
+ATOM 5091 CD GLN L 124 -29.767 0.281 -48.262 1.00 95.58 C
+ATOM 5092 OE1 GLN L 124 -30.242 0.674 -49.329 1.00 98.18 O
+ATOM 5093 NE2 GLN L 124 -29.537 -1.004 -48.008 1.00 84.00 N
+ATOM 5094 H GLN L 124 -27.565 2.258 -45.616 1.00 0.00 H
+ATOM 5095 HA GLN L 124 -28.264 4.562 -47.203 1.00 0.00 H
+ATOM 5096 1HB GLN L 124 -29.712 2.925 -48.443 1.00 0.00 H
+ATOM 5097 2HB GLN L 124 -28.033 2.428 -48.299 1.00 0.00 H
+ATOM 5098 1HG GLN L 124 -28.577 0.841 -46.586 1.00 0.00 H
+ATOM 5099 2HG GLN L 124 -30.264 1.424 -46.534 1.00 0.00 H
+ATOM 5100 1HE2 GLN L 124 -29.764 -1.698 -48.692 1.00 0.00 H
+ATOM 5101 2HE2 GLN L 124 -29.137 -1.278 -47.133 1.00 0.00 H
+ATOM 5102 N LEU L 125 -30.500 3.523 -45.041 1.00108.71 N
+ATOM 5103 CA LEU L 125 -31.754 3.945 -44.426 1.00 99.85 C
+ATOM 5104 C LEU L 125 -31.620 5.319 -43.784 1.00111.13 C
+ATOM 5105 O LEU L 125 -32.601 6.067 -43.716 1.00120.76 O
+ATOM 5106 CB LEU L 125 -32.197 2.923 -43.371 1.00 89.03 C
+ATOM 5107 CG LEU L 125 -33.589 3.152 -42.767 1.00 89.98 C
+ATOM 5108 CD1 LEU L 125 -34.634 3.127 -43.875 1.00 0.00 C
+ATOM 5109 CD2 LEU L 125 -33.872 2.081 -41.725 1.00 0.00 C
+ATOM 5110 H LEU L 125 -30.002 2.735 -44.652 1.00 0.00 H
+ATOM 5111 HA LEU L 125 -32.510 4.028 -45.206 1.00 0.00 H
+ATOM 5112 1HB LEU L 125 -32.191 1.933 -43.823 1.00 0.00 H
+ATOM 5113 2HB LEU L 125 -31.476 2.932 -42.554 1.00 0.00 H
+ATOM 5114 HG LEU L 125 -33.625 4.135 -42.297 1.00 0.00 H
+ATOM 5115 1HD1 LEU L 125 -35.622 3.290 -43.446 1.00 0.00 H
+ATOM 5116 2HD1 LEU L 125 -34.418 3.916 -44.596 1.00 0.00 H
+ATOM 5117 3HD1 LEU L 125 -34.610 2.160 -44.376 1.00 0.00 H
+ATOM 5118 1HD2 LEU L 125 -34.861 2.243 -41.295 1.00 0.00 H
+ATOM 5119 2HD2 LEU L 125 -33.838 1.097 -42.194 1.00 0.00 H
+ATOM 5120 3HD2 LEU L 125 -33.121 2.132 -40.936 1.00 0.00 H
+ATOM 5121 N LYS L 126 -30.421 5.673 -43.322 1.00122.76 N
+ATOM 5122 CA LYS L 126 -30.144 7.025 -42.855 1.00138.20 C
+ATOM 5123 C LYS L 126 -29.979 8.017 -44.001 1.00147.37 C
+ATOM 5124 O LYS L 126 -29.634 9.178 -43.753 1.00153.97 O
+ATOM 5125 CB LYS L 126 -28.890 7.031 -41.979 1.00137.69 C
+ATOM 5126 CG LYS L 126 -29.040 6.284 -40.661 1.00 0.00 C
+ATOM 5127 CD LYS L 126 -27.761 6.351 -39.840 1.00 0.00 C
+ATOM 5128 CE LYS L 126 -27.911 5.611 -38.519 1.00 0.00 C
+ATOM 5129 NZ LYS L 126 -26.657 5.643 -37.717 1.00 0.00 N
+ATOM 5130 H LYS L 126 -29.684 4.983 -43.296 1.00 0.00 H
+ATOM 5131 HA LYS L 126 -30.992 7.366 -42.261 1.00 0.00 H
+ATOM 5132 1HB LYS L 126 -28.062 6.581 -42.527 1.00 0.00 H
+ATOM 5133 2HB LYS L 126 -28.611 8.060 -41.751 1.00 0.00 H
+ATOM 5134 1HG LYS L 126 -29.855 6.723 -40.084 1.00 0.00 H
+ATOM 5135 2HG LYS L 126 -29.280 5.240 -40.859 1.00 0.00 H
+ATOM 5136 1HD LYS L 126 -26.941 5.905 -40.405 1.00 0.00 H
+ATOM 5137 2HD LYS L 126 -27.513 7.392 -39.635 1.00 0.00 H
+ATOM 5138 1HE LYS L 126 -28.712 6.064 -37.937 1.00 0.00 H
+ATOM 5139 2HE LYS L 126 -28.176 4.571 -38.712 1.00 0.00 H
+ATOM 5140 1HZ LYS L 126 -26.798 5.142 -36.851 1.00 0.00 H
+ATOM 5141 2HZ LYS L 126 -25.911 5.207 -38.240 1.00 0.00 H
+ATOM 5142 3HZ LYS L 126 -26.411 6.601 -37.515 1.00 0.00 H
+ATOM 5143 N SER L 127 -30.215 7.583 -45.243 1.00146.04 N
+ATOM 5144 CA SER L 127 -30.102 8.442 -46.411 1.00146.53 C
+ATOM 5145 C SER L 127 -31.407 8.627 -47.170 1.00145.78 C
+ATOM 5146 O SER L 127 -31.468 9.492 -48.051 1.00153.67 O
+ATOM 5147 CB SER L 127 -29.040 7.896 -47.378 1.00143.25 C
+ATOM 5148 OG SER L 127 -27.755 7.928 -46.786 1.00150.59 O
+ATOM 5149 H SER L 127 -30.482 6.617 -45.367 1.00 0.00 H
+ATOM 5150 HA SER L 127 -29.796 9.436 -46.081 1.00 0.00 H
+ATOM 5151 1HB SER L 127 -29.292 6.873 -47.655 1.00 0.00 H
+ATOM 5152 2HB SER L 127 -29.039 8.491 -48.290 1.00 0.00 H
+ATOM 5153 HG SER L 127 -27.878 8.293 -45.906 1.00 0.00 H
+ATOM 5154 N GLY L 128 -32.443 7.845 -46.870 1.00138.33 N
+ATOM 5155 CA GLY L 128 -33.737 8.055 -47.489 1.00132.27 C
+ATOM 5156 C GLY L 128 -34.387 6.808 -48.051 1.00124.77 C
+ATOM 5157 O GLY L 128 -35.615 6.683 -48.031 1.00119.04 O
+ATOM 5158 H GLY L 128 -32.332 7.094 -46.203 1.00 0.00 H
+ATOM 5159 1HA GLY L 128 -34.423 8.487 -46.760 1.00 0.00 H
+ATOM 5160 2HA GLY L 128 -33.639 8.773 -48.302 1.00 0.00 H
+ATOM 5161 N THR L 129 -33.581 5.881 -48.563 1.00125.64 N
+ATOM 5162 CA THR L 129 -34.086 4.676 -49.204 1.00125.93 C
+ATOM 5163 C THR L 129 -33.533 3.440 -48.509 1.00125.33 C
+ATOM 5164 O THR L 129 -32.400 3.435 -48.019 1.00132.35 O
+ATOM 5165 CB THR L 129 -33.718 4.637 -50.694 1.00117.66 C
+ATOM 5166 OG1 THR L 129 -32.293 4.626 -50.838 1.00117.54 O
+ATOM 5167 CG2 THR L 129 -34.285 5.851 -51.414 1.00119.74 C
+ATOM 5168 H THR L 129 -32.583 6.024 -48.502 1.00 0.00 H
+ATOM 5169 HA THR L 129 -35.173 4.670 -49.122 1.00 0.00 H
+ATOM 5170 HB THR L 129 -34.123 3.731 -51.145 1.00 0.00 H
+ATOM 5171 HG1 THR L 129 -31.884 4.645 -49.969 1.00 0.00 H
+ATOM 5172 1HG2 THR L 129 -34.015 5.807 -52.469 1.00 0.00 H
+ATOM 5173 2HG2 THR L 129 -35.370 5.858 -51.317 1.00 0.00 H
+ATOM 5174 3HG2 THR L 129 -33.876 6.759 -50.973 1.00 0.00 H
+ATOM 5175 N ALA L 130 -34.347 2.387 -48.475 1.00111.53 N
+ATOM 5176 CA ALA L 130 -33.966 1.115 -47.878 1.00 99.83 C
+ATOM 5177 C ALA L 130 -34.318 -0.007 -48.841 1.00101.55 C
+ATOM 5178 O ALA L 130 -35.427 -0.036 -49.382 1.00111.14 O
+ATOM 5179 CB ALA L 130 -34.667 0.899 -46.535 1.00 94.80 C
+ATOM 5180 H ALA L 130 -35.266 2.483 -48.883 1.00 0.00 H
+ATOM 5181 HA ALA L 130 -32.890 1.130 -47.707 1.00 0.00 H
+ATOM 5182 1HB ALA L 130 -34.361 -0.059 -46.115 1.00 0.00 H
+ATOM 5183 2HB ALA L 130 -34.393 1.700 -45.848 1.00 0.00 H
+ATOM 5184 3HB ALA L 130 -35.746 0.902 -46.683 1.00 0.00 H
+ATOM 5185 N SER L 131 -33.380 -0.927 -49.054 1.00 95.50 N
+ATOM 5186 CA SER L 131 -33.583 -2.052 -49.958 1.00 94.14 C
+ATOM 5187 C SER L 131 -33.297 -3.352 -49.220 1.00 95.00 C
+ATOM 5188 O SER L 131 -32.164 -3.589 -48.786 1.00 92.99 O
+ATOM 5189 CB SER L 131 -32.700 -1.926 -51.204 1.00 98.02 C
+ATOM 5190 OG SER L 131 -31.362 -1.617 -50.859 1.00 96.32 O
+ATOM 5191 H SER L 131 -32.498 -0.838 -48.570 1.00 0.00 H
+ATOM 5192 HA SER L 131 -34.626 -2.056 -50.276 1.00 0.00 H
+ATOM 5193 1HB SER L 131 -32.724 -2.861 -51.763 1.00 0.00 H
+ATOM 5194 2HB SER L 131 -33.097 -1.147 -51.853 1.00 0.00 H
+ATOM 5195 HG SER L 131 -31.342 -1.562 -49.901 1.00 0.00 H
+ATOM 5196 N VAL L 132 -34.330 -4.183 -49.072 1.00 93.02 N
+ATOM 5197 CA VAL L 132 -34.215 -5.532 -48.526 1.00 88.35 C
+ATOM 5198 C VAL L 132 -33.892 -6.483 -49.667 1.00 86.67 C
+ATOM 5199 O VAL L 132 -34.415 -6.325 -50.775 1.00 97.43 O
+ATOM 5200 CB VAL L 132 -35.522 -5.940 -47.821 1.00 87.16 C
+ATOM 5201 CG1 VAL L 132 -35.364 -7.281 -47.119 1.00 94.92 C
+ATOM 5202 CG2 VAL L 132 -35.959 -4.862 -46.851 1.00 93.03 C
+ATOM 5203 H VAL L 132 -35.237 -3.844 -49.359 1.00 0.00 H
+ATOM 5204 HA VAL L 132 -33.406 -5.541 -47.794 1.00 0.00 H
+ATOM 5205 HB VAL L 132 -36.299 -6.084 -48.572 1.00 0.00 H
+ATOM 5206 1HG1 VAL L 132 -36.301 -7.548 -46.629 1.00 0.00 H
+ATOM 5207 2HG1 VAL L 132 -35.107 -8.047 -47.851 1.00 0.00 H
+ATOM 5208 3HG1 VAL L 132 -34.572 -7.210 -46.373 1.00 0.00 H
+ATOM 5209 1HG2 VAL L 132 -36.884 -5.166 -46.362 1.00 0.00 H
+ATOM 5210 2HG2 VAL L 132 -35.183 -4.712 -46.100 1.00 0.00 H
+ATOM 5211 3HG2 VAL L 132 -36.124 -3.930 -47.393 1.00 0.00 H
+ATOM 5212 N VAL L 133 -33.039 -7.478 -49.421 1.00 76.10 N
+ATOM 5213 CA VAL L 133 -32.723 -8.420 -50.490 1.00 86.16 C
+ATOM 5214 C VAL L 133 -33.031 -9.840 -50.032 1.00 93.40 C
+ATOM 5215 O VAL L 133 -32.980 -10.160 -48.840 1.00102.46 O
+ATOM 5216 CB VAL L 133 -31.258 -8.304 -50.979 1.00 79.94 C
+ATOM 5217 CG1 VAL L 133 -30.873 -6.845 -51.204 1.00 72.32 C
+ATOM 5218 CG2 VAL L 133 -30.306 -8.977 -50.020 1.00 84.20 C
+ATOM 5219 H VAL L 133 -32.606 -7.597 -48.516 1.00 0.00 H
+ATOM 5220 HA VAL L 133 -33.371 -8.207 -51.341 1.00 0.00 H
+ATOM 5221 HB VAL L 133 -31.171 -8.782 -51.955 1.00 0.00 H
+ATOM 5222 1HG1 VAL L 133 -29.840 -6.790 -51.547 1.00 0.00 H
+ATOM 5223 2HG1 VAL L 133 -31.529 -6.408 -51.957 1.00 0.00 H
+ATOM 5224 3HG1 VAL L 133 -30.974 -6.294 -50.269 1.00 0.00 H
+ATOM 5225 1HG2 VAL L 133 -29.286 -8.879 -50.391 1.00 0.00 H
+ATOM 5226 2HG2 VAL L 133 -30.383 -8.506 -49.040 1.00 0.00 H
+ATOM 5227 3HG2 VAL L 133 -30.561 -10.034 -49.935 1.00 0.00 H
+ATOM 5228 N CYS L 134 -33.379 -10.690 -51.001 1.00 82.79 N
+ATOM 5229 CA CYS L 134 -33.624 -12.110 -50.784 1.00 81.40 C
+ATOM 5230 C CYS L 134 -32.747 -12.909 -51.736 1.00 87.92 C
+ATOM 5231 O CYS L 134 -32.549 -12.514 -52.890 1.00 97.06 O
+ATOM 5232 CB CYS L 134 -35.104 -12.470 -50.996 1.00 97.01 C
+ATOM 5233 SG CYS L 134 -35.618 -14.080 -50.326 1.00120.15 S
+ATOM 5234 H CYS L 134 -33.474 -10.311 -51.932 1.00 0.00 H
+ATOM 5235 HA CYS L 134 -33.361 -12.353 -49.754 1.00 0.00 H
+ATOM 5236 1HB CYS L 134 -35.733 -11.709 -50.533 1.00 0.00 H
+ATOM 5237 2HB CYS L 134 -35.328 -12.475 -52.063 1.00 0.00 H
+ATOM 5238 N LEU L 135 -32.231 -14.035 -51.250 1.00 92.12 N
+ATOM 5239 CA LEU L 135 -31.236 -14.820 -51.969 1.00 90.13 C
+ATOM 5240 C LEU L 135 -31.685 -16.271 -52.054 1.00100.96 C
+ATOM 5241 O LEU L 135 -32.143 -16.847 -51.063 1.00111.71 O
+ATOM 5242 CB LEU L 135 -29.876 -14.729 -51.273 1.00 83.15 C
+ATOM 5243 CG LEU L 135 -28.588 -15.007 -52.049 1.00 90.36 C
+ATOM 5244 CD1 LEU L 135 -27.421 -14.499 -51.231 1.00 95.56 C
+ATOM 5245 CD2 LEU L 135 -28.401 -16.478 -52.365 1.00 95.92 C
+ATOM 5246 H LEU L 135 -32.547 -14.352 -50.345 1.00 0.00 H
+ATOM 5247 HA LEU L 135 -31.139 -14.416 -52.976 1.00 0.00 H
+ATOM 5248 1HB LEU L 135 -29.757 -13.723 -50.874 1.00 0.00 H
+ATOM 5249 2HB LEU L 135 -29.864 -15.432 -50.440 1.00 0.00 H
+ATOM 5250 HG LEU L 135 -28.608 -14.463 -52.994 1.00 0.00 H
+ATOM 5251 1HD1 LEU L 135 -26.491 -14.688 -51.768 1.00 0.00 H
+ATOM 5252 2HD1 LEU L 135 -27.532 -13.427 -51.065 1.00 0.00 H
+ATOM 5253 3HD1 LEU L 135 -27.397 -15.015 -50.272 1.00 0.00 H
+ATOM 5254 1HD2 LEU L 135 -27.471 -16.616 -52.917 1.00 0.00 H
+ATOM 5255 2HD2 LEU L 135 -28.360 -17.047 -51.436 1.00 0.00 H
+ATOM 5256 3HD2 LEU L 135 -29.238 -16.830 -52.969 1.00 0.00 H
+ATOM 5257 N LEU L 136 -31.544 -16.857 -53.240 1.00 94.22 N
+ATOM 5258 CA LEU L 136 -31.778 -18.276 -53.481 1.00 85.01 C
+ATOM 5259 C LEU L 136 -30.479 -18.849 -54.027 1.00 88.58 C
+ATOM 5260 O LEU L 136 -30.068 -18.516 -55.145 1.00 83.45 O
+ATOM 5261 CB LEU L 136 -32.935 -18.494 -54.455 1.00 87.90 C
+ATOM 5262 CG LEU L 136 -34.355 -18.170 -53.982 1.00101.49 C
+ATOM 5263 CD1 LEU L 136 -34.586 -16.672 -53.866 1.00101.64 C
+ATOM 5264 CD2 LEU L 136 -35.364 -18.789 -54.930 1.00106.48 C
+ATOM 5265 H LEU L 136 -31.257 -16.268 -54.009 1.00 0.00 H
+ATOM 5266 HA LEU L 136 -32.037 -18.749 -52.535 1.00 0.00 H
+ATOM 5267 1HB LEU L 136 -32.762 -17.886 -55.341 1.00 0.00 H
+ATOM 5268 2HB LEU L 136 -32.944 -19.542 -54.755 1.00 0.00 H
+ATOM 5269 HG LEU L 136 -34.506 -18.574 -52.980 1.00 0.00 H
+ATOM 5270 1HD1 LEU L 136 -35.605 -16.486 -53.527 1.00 0.00 H
+ATOM 5271 2HD1 LEU L 136 -33.883 -16.250 -53.147 1.00 0.00 H
+ATOM 5272 3HD1 LEU L 136 -34.436 -16.205 -54.838 1.00 0.00 H
+ATOM 5273 1HD2 LEU L 136 -36.374 -18.557 -54.589 1.00 0.00 H
+ATOM 5274 2HD2 LEU L 136 -35.217 -18.385 -55.932 1.00 0.00 H
+ATOM 5275 3HD2 LEU L 136 -35.228 -19.870 -54.951 1.00 0.00 H
+ATOM 5276 N ASN L 137 -29.830 -19.701 -53.241 1.00 92.66 N
+ATOM 5277 CA ASN L 137 -28.464 -20.127 -53.506 1.00 84.33 C
+ATOM 5278 C ASN L 137 -28.433 -21.570 -53.989 1.00 87.79 C
+ATOM 5279 O ASN L 137 -29.007 -22.459 -53.346 1.00 96.55 O
+ATOM 5280 CB ASN L 137 -27.603 -19.977 -52.252 1.00 89.50 C
+ATOM 5281 CG ASN L 137 -26.137 -19.823 -52.573 1.00 97.11 C
+ATOM 5282 OD1 ASN L 137 -25.774 -19.185 -53.560 1.00 98.54 O
+ATOM 5283 ND2 ASN L 137 -25.282 -20.410 -51.743 1.00100.85 N
+ATOM 5284 H ASN L 137 -30.310 -20.063 -52.429 1.00 0.00 H
+ATOM 5285 HA ASN L 137 -28.050 -19.493 -54.291 1.00 0.00 H
+ATOM 5286 1HB ASN L 137 -27.933 -19.105 -51.686 1.00 0.00 H
+ATOM 5287 2HB ASN L 137 -27.734 -20.851 -51.614 1.00 0.00 H
+ATOM 5288 1HD2 ASN L 137 -24.298 -20.341 -51.907 1.00 0.00 H
+ATOM 5289 2HD2 ASN L 137 -25.622 -20.921 -50.954 1.00 0.00 H
+ATOM 5290 N ASN L 138 -27.770 -21.782 -55.129 1.00 95.94 N
+ATOM 5291 CA ASN L 138 -27.381 -23.099 -55.642 1.00 96.89 C
+ATOM 5292 C ASN L 138 -28.581 -24.044 -55.745 1.00 95.95 C
+ATOM 5293 O ASN L 138 -28.756 -24.969 -54.951 1.00111.46 O
+ATOM 5294 CB ASN L 138 -26.280 -23.706 -54.769 1.00102.25 C
+ATOM 5295 CG ASN L 138 -24.985 -22.929 -54.850 1.00102.73 C
+ATOM 5296 OD1 ASN L 138 -24.714 -22.260 -55.847 1.00105.01 O
+ATOM 5297 ND2 ASN L 138 -24.179 -23.009 -53.799 1.00106.11 N
+ATOM 5298 H ASN L 138 -27.530 -20.957 -55.660 1.00 0.00 H
+ATOM 5299 HA ASN L 138 -26.996 -22.976 -56.656 1.00 0.00 H
+ATOM 5300 1HB ASN L 138 -26.612 -23.732 -53.730 1.00 0.00 H
+ATOM 5301 2HB ASN L 138 -26.095 -24.734 -55.080 1.00 0.00 H
+ATOM 5302 1HD2 ASN L 138 -23.309 -22.516 -53.797 1.00 0.00 H
+ATOM 5303 2HD2 ASN L 138 -24.441 -23.562 -53.009 1.00 0.00 H
+ATOM 5304 N PHE L 139 -29.396 -23.796 -56.768 1.00 91.60 N
+ATOM 5305 CA PHE L 139 -30.592 -24.587 -57.010 1.00 98.35 C
+ATOM 5306 C PHE L 139 -30.677 -24.974 -58.481 1.00108.13 C
+ATOM 5307 O PHE L 139 -29.960 -24.443 -59.335 1.00108.15 O
+ATOM 5308 CB PHE L 139 -31.862 -23.834 -56.588 1.00 96.84 C
+ATOM 5309 CG PHE L 139 -32.047 -22.510 -57.278 1.00 89.69 C
+ATOM 5310 CD1 PHE L 139 -32.798 -22.418 -58.439 1.00 87.71 C
+ATOM 5311 CD2 PHE L 139 -31.482 -21.357 -56.760 1.00 85.99 C
+ATOM 5312 CE1 PHE L 139 -32.976 -21.207 -59.075 1.00 85.74 C
+ATOM 5313 CE2 PHE L 139 -31.656 -20.141 -57.393 1.00 84.80 C
+ATOM 5314 CZ PHE L 139 -32.404 -20.066 -58.553 1.00 90.57 C
+ATOM 5315 H PHE L 139 -29.175 -23.035 -57.394 1.00 0.00 H
+ATOM 5316 HA PHE L 139 -30.528 -25.501 -56.419 1.00 0.00 H
+ATOM 5317 1HB PHE L 139 -32.736 -24.449 -56.798 1.00 0.00 H
+ATOM 5318 2HB PHE L 139 -31.838 -23.655 -55.514 1.00 0.00 H
+ATOM 5319 HD1 PHE L 139 -33.253 -23.319 -58.851 1.00 0.00 H
+ATOM 5320 HD2 PHE L 139 -30.891 -21.415 -55.845 1.00 0.00 H
+ATOM 5321 HE1 PHE L 139 -33.568 -21.154 -59.988 1.00 0.00 H
+ATOM 5322 HE2 PHE L 139 -31.203 -19.241 -56.978 1.00 0.00 H
+ATOM 5323 HZ PHE L 139 -32.540 -19.109 -59.054 1.00 0.00 H
+ATOM 5324 N TYR L 140 -31.574 -25.916 -58.763 1.00 93.93 N
+ATOM 5325 CA TYR L 140 -31.854 -26.372 -60.121 1.00 95.92 C
+ATOM 5326 C TYR L 140 -33.187 -27.121 -60.154 1.00124.04 C
+ATOM 5327 O TYR L 140 -33.447 -27.961 -59.292 1.00127.44 O
+ATOM 5328 CB TYR L 140 -30.730 -27.274 -60.646 1.00 96.14 C
+ATOM 5329 CG TYR L 140 -30.976 -27.777 -62.052 1.00108.89 C
+ATOM 5330 CD1 TYR L 140 -30.633 -27.006 -63.155 1.00115.37 C
+ATOM 5331 CD2 TYR L 140 -31.568 -29.013 -62.278 1.00103.85 C
+ATOM 5332 CE1 TYR L 140 -30.865 -27.454 -64.440 1.00 98.90 C
+ATOM 5333 CE2 TYR L 140 -31.801 -29.470 -63.561 1.00106.52 C
+ATOM 5334 CZ TYR L 140 -31.447 -28.686 -64.638 1.00103.95 C
+ATOM 5335 OH TYR L 140 -31.679 -29.132 -65.918 1.00107.04 O
+ATOM 5336 H TYR L 140 -32.079 -26.328 -57.992 1.00 0.00 H
+ATOM 5337 HA TYR L 140 -31.925 -25.500 -60.771 1.00 0.00 H
+ATOM 5338 1HB TYR L 140 -29.787 -26.725 -60.635 1.00 0.00 H
+ATOM 5339 2HB TYR L 140 -30.616 -28.134 -59.987 1.00 0.00 H
+ATOM 5340 HD1 TYR L 140 -30.172 -26.028 -63.014 1.00 0.00 H
+ATOM 5341 HD2 TYR L 140 -31.858 -29.640 -61.435 1.00 0.00 H
+ATOM 5342 HE1 TYR L 140 -30.588 -26.833 -65.292 1.00 0.00 H
+ATOM 5343 HE2 TYR L 140 -32.263 -30.445 -63.717 1.00 0.00 H
+ATOM 5344 HH TYR L 140 -32.089 -29.999 -65.884 1.00 0.00 H
+ATOM 5345 N PRO L 141 -34.036 -26.827 -61.152 1.00102.89 N
+ATOM 5346 CA PRO L 141 -33.820 -25.852 -62.223 1.00100.08 C
+ATOM 5347 C PRO L 141 -34.163 -24.430 -61.801 1.00115.76 C
+ATOM 5348 O PRO L 141 -34.287 -24.154 -60.609 1.00128.92 O
+ATOM 5349 CB PRO L 141 -34.767 -26.335 -63.315 1.00106.57 C
+ATOM 5350 CG PRO L 141 -35.913 -26.903 -62.552 1.00109.12 C
+ATOM 5351 CD PRO L 141 -35.317 -27.537 -61.318 1.00108.70 C
+ATOM 5352 HA PRO L 141 -32.773 -25.906 -62.555 1.00 0.00 H
+ATOM 5353 1HB PRO L 141 -35.053 -25.494 -63.964 1.00 0.00 H
+ATOM 5354 2HB PRO L 141 -34.261 -27.075 -63.952 1.00 0.00 H
+ATOM 5355 1HG PRO L 141 -36.631 -26.109 -62.299 1.00 0.00 H
+ATOM 5356 2HG PRO L 141 -36.454 -27.636 -63.169 1.00 0.00 H
+ATOM 5357 1HD PRO L 141 -35.985 -27.370 -60.460 1.00 0.00 H
+ATOM 5358 2HD PRO L 141 -35.171 -28.613 -61.492 1.00 0.00 H
+ATOM 5359 N ARG L 142 -34.318 -23.536 -62.777 1.00107.21 N
+ATOM 5360 CA ARG L 142 -34.646 -22.143 -62.509 1.00120.63 C
+ATOM 5361 C ARG L 142 -36.147 -21.918 -62.360 1.00139.76 C
+ATOM 5362 O ARG L 142 -36.651 -20.838 -62.696 1.00136.97 O
+ATOM 5363 CB ARG L 142 -34.071 -21.251 -63.609 1.00127.90 C
+ATOM 5364 CG ARG L 142 -33.837 -19.809 -63.184 1.00137.81 C
+ATOM 5365 CD ARG L 142 -33.796 -18.880 -64.385 1.00142.44 C
+ATOM 5366 NE ARG L 142 -32.784 -19.280 -65.354 1.00138.55 N
+ATOM 5367 CZ ARG L 142 -32.457 -18.568 -66.427 1.00138.02 C
+ATOM 5368 NH1 ARG L 142 -33.069 -17.417 -66.674 1.00136.28 N
+ATOM 5369 NH2 ARG L 142 -31.518 -19.007 -67.254 1.00139.23 N
+ATOM 5370 H ARG L 142 -34.203 -23.839 -63.734 1.00 0.00 H
+ATOM 5371 HA ARG L 142 -34.200 -21.860 -61.555 1.00 0.00 H
+ATOM 5372 1HB ARG L 142 -33.120 -21.660 -63.949 1.00 0.00 H
+ATOM 5373 2HB ARG L 142 -34.748 -21.244 -64.463 1.00 0.00 H
+ATOM 5374 1HG ARG L 142 -34.644 -19.488 -62.525 1.00 0.00 H
+ATOM 5375 2HG ARG L 142 -32.886 -19.735 -62.656 1.00 0.00 H
+ATOM 5376 1HD ARG L 142 -34.765 -18.888 -64.884 1.00 0.00 H
+ATOM 5377 2HD ARG L 142 -33.567 -17.868 -64.054 1.00 0.00 H
+ATOM 5378 HE ARG L 142 -32.302 -20.155 -65.197 1.00 0.00 H
+ATOM 5379 1HH1 ARG L 142 -33.785 -17.081 -66.046 1.00 0.00 H
+ATOM 5380 2HH1 ARG L 142 -32.819 -16.877 -67.490 1.00 0.00 H
+ATOM 5381 1HH2 ARG L 142 -31.051 -19.884 -67.068 1.00 0.00 H
+ATOM 5382 2HH2 ARG L 142 -31.270 -18.466 -68.069 1.00 0.00 H
+ATOM 5383 N GLU L 143 -36.881 -22.910 -61.862 1.00157.86 N
+ATOM 5384 CA GLU L 143 -38.317 -22.755 -61.671 1.00159.58 C
+ATOM 5385 C GLU L 143 -38.600 -22.014 -60.371 1.00155.06 C
+ATOM 5386 O GLU L 143 -39.408 -22.469 -59.554 1.00167.87 O
+ATOM 5387 CB GLU L 143 -39.010 -24.119 -61.660 1.00165.06 C
+ATOM 5388 CG GLU L 143 -38.907 -24.887 -62.970 1.00 0.00 C
+ATOM 5389 CD GLU L 143 -39.638 -24.217 -64.100 1.00 0.00 C
+ATOM 5390 OE1 GLU L 143 -40.787 -23.890 -63.929 1.00 0.00 O
+ATOM 5391 OE2 GLU L 143 -39.044 -24.031 -65.137 1.00 0.00 O
+ATOM 5392 H GLU L 143 -36.443 -23.785 -61.611 1.00 0.00 H
+ATOM 5393 HA GLU L 143 -38.713 -22.160 -62.495 1.00 0.00 H
+ATOM 5394 1HB GLU L 143 -38.580 -24.740 -60.874 1.00 0.00 H
+ATOM 5395 2HB GLU L 143 -40.068 -23.988 -61.431 1.00 0.00 H
+ATOM 5396 1HG GLU L 143 -37.856 -24.986 -63.240 1.00 0.00 H
+ATOM 5397 2HG GLU L 143 -39.312 -25.888 -62.825 1.00 0.00 H
+ATOM 5398 N ALA L 144 -37.948 -20.872 -60.173 1.00128.65 N
+ATOM 5399 CA ALA L 144 -38.067 -20.121 -58.934 1.00115.52 C
+ATOM 5400 C ALA L 144 -39.221 -19.131 -59.012 1.00120.92 C
+ATOM 5401 O ALA L 144 -39.446 -18.500 -60.049 1.00121.38 O
+ATOM 5402 CB ALA L 144 -36.765 -19.381 -58.626 1.00101.00 C
+ATOM 5403 H ALA L 144 -37.352 -20.518 -60.908 1.00 0.00 H
+ATOM 5404 HA ALA L 144 -38.269 -20.827 -58.128 1.00 0.00 H
+ATOM 5405 1HB ALA L 144 -36.874 -18.825 -57.695 1.00 0.00 H
+ATOM 5406 2HB ALA L 144 -35.952 -20.101 -58.526 1.00 0.00 H
+ATOM 5407 3HB ALA L 144 -36.539 -18.690 -59.437 1.00 0.00 H
+ATOM 5408 N LYS L 145 -39.953 -19.004 -57.906 1.00122.18 N
+ATOM 5409 CA LYS L 145 -41.045 -18.038 -57.777 1.00119.82 C
+ATOM 5410 C LYS L 145 -40.894 -17.342 -56.427 1.00120.74 C
+ATOM 5411 O LYS L 145 -41.209 -17.922 -55.384 1.00126.47 O
+ATOM 5412 CB LYS L 145 -42.411 -18.717 -57.892 1.00113.99 C
+ATOM 5413 CG LYS L 145 -43.595 -17.761 -57.836 1.00 0.00 C
+ATOM 5414 CD LYS L 145 -44.913 -18.502 -58.005 1.00 0.00 C
+ATOM 5415 CE LYS L 145 -46.099 -17.553 -57.913 1.00 0.00 C
+ATOM 5416 NZ LYS L 145 -47.395 -18.266 -58.076 1.00 0.00 N
+ATOM 5417 H LYS L 145 -39.736 -19.608 -57.126 1.00 0.00 H
+ATOM 5418 HA LYS L 145 -40.954 -17.304 -58.578 1.00 0.00 H
+ATOM 5419 1HB LYS L 145 -42.467 -19.264 -58.834 1.00 0.00 H
+ATOM 5420 2HB LYS L 145 -42.527 -19.441 -57.085 1.00 0.00 H
+ATOM 5421 1HG LYS L 145 -43.600 -17.243 -56.876 1.00 0.00 H
+ATOM 5422 2HG LYS L 145 -43.501 -17.019 -58.629 1.00 0.00 H
+ATOM 5423 1HD LYS L 145 -44.929 -18.999 -58.976 1.00 0.00 H
+ATOM 5424 2HD LYS L 145 -45.005 -19.260 -57.227 1.00 0.00 H
+ATOM 5425 1HE LYS L 145 -46.091 -17.055 -56.945 1.00 0.00 H
+ATOM 5426 2HE LYS L 145 -46.017 -16.793 -58.689 1.00 0.00 H
+ATOM 5427 1HZ LYS L 145 -48.154 -17.603 -58.010 1.00 0.00 H
+ATOM 5428 2HZ LYS L 145 -47.420 -18.717 -58.980 1.00 0.00 H
+ATOM 5429 3HZ LYS L 145 -47.491 -18.961 -57.351 1.00 0.00 H
+ATOM 5430 N VAL L 146 -40.418 -16.099 -56.447 1.00116.60 N
+ATOM 5431 CA VAL L 146 -40.149 -15.325 -55.239 1.00107.22 C
+ATOM 5432 C VAL L 146 -41.157 -14.189 -55.150 1.00106.44 C
+ATOM 5433 O VAL L 146 -41.300 -13.403 -56.095 1.00109.65 O
+ATOM 5434 CB VAL L 146 -38.713 -14.774 -55.232 1.00 93.62 C
+ATOM 5435 CG1 VAL L 146 -38.472 -13.946 -53.987 1.00 93.58 C
+ATOM 5436 CG2 VAL L 146 -37.710 -15.907 -55.324 1.00 86.41 C
+ATOM 5437 H VAL L 146 -40.238 -15.682 -57.349 1.00 0.00 H
+ATOM 5438 HA VAL L 146 -40.266 -15.980 -54.375 1.00 0.00 H
+ATOM 5439 HB VAL L 146 -38.584 -14.110 -56.087 1.00 0.00 H
+ATOM 5440 1HG1 VAL L 146 -37.451 -13.563 -53.997 1.00 0.00 H
+ATOM 5441 2HG1 VAL L 146 -39.172 -13.111 -53.964 1.00 0.00 H
+ATOM 5442 3HG1 VAL L 146 -38.617 -14.567 -53.103 1.00 0.00 H
+ATOM 5443 1HG2 VAL L 146 -36.699 -15.500 -55.319 1.00 0.00 H
+ATOM 5444 2HG2 VAL L 146 -37.837 -16.575 -54.472 1.00 0.00 H
+ATOM 5445 3HG2 VAL L 146 -37.872 -16.462 -56.248 1.00 0.00 H
+ATOM 5446 N GLN L 147 -41.846 -14.093 -54.016 1.00107.73 N
+ATOM 5447 CA GLN L 147 -42.786 -13.002 -53.804 1.00115.57 C
+ATOM 5448 C GLN L 147 -42.601 -12.422 -52.411 1.00119.67 C
+ATOM 5449 O GLN L 147 -42.422 -13.158 -51.434 1.00117.43 O
+ATOM 5450 CB GLN L 147 -44.237 -13.456 -54.008 1.00119.30 C
+ATOM 5451 CG GLN L 147 -44.601 -14.757 -53.327 1.00125.12 C
+ATOM 5452 CD GLN L 147 -45.880 -15.347 -53.885 1.00130.66 C
+ATOM 5453 OE1 GLN L 147 -46.429 -14.845 -54.866 1.00124.01 O
+ATOM 5454 NE2 GLN L 147 -46.359 -16.420 -53.268 1.00140.45 N
+ATOM 5455 H GLN L 147 -41.720 -14.782 -53.289 1.00 0.00 H
+ATOM 5456 HA GLN L 147 -42.573 -12.216 -54.529 1.00 0.00 H
+ATOM 5457 1HB GLN L 147 -44.914 -12.688 -53.634 1.00 0.00 H
+ATOM 5458 2HB GLN L 147 -44.434 -13.576 -55.073 1.00 0.00 H
+ATOM 5459 1HG GLN L 147 -43.793 -15.473 -53.479 1.00 0.00 H
+ATOM 5460 2HG GLN L 147 -44.740 -14.571 -52.262 1.00 0.00 H
+ATOM 5461 1HE2 GLN L 147 -47.201 -16.851 -53.594 1.00 0.00 H
+ATOM 5462 2HE2 GLN L 147 -45.879 -16.799 -52.477 1.00 0.00 H
+ATOM 5463 N TRP L 148 -42.643 -11.094 -52.337 1.00119.52 N
+ATOM 5464 CA TRP L 148 -42.422 -10.364 -51.099 1.00114.53 C
+ATOM 5465 C TRP L 148 -43.733 -10.163 -50.355 1.00112.71 C
+ATOM 5466 O TRP L 148 -44.779 -9.923 -50.964 1.00113.48 O
+ATOM 5467 CB TRP L 148 -41.781 -9.007 -51.389 1.00113.00 C
+ATOM 5468 CG TRP L 148 -40.375 -9.101 -51.873 1.00109.39 C
+ATOM 5469 CD1 TRP L 148 -39.949 -9.076 -53.168 1.00107.11 C
+ATOM 5470 CD2 TRP L 148 -39.200 -9.221 -51.066 1.00105.18 C
+ATOM 5471 NE1 TRP L 148 -38.581 -9.180 -53.219 1.00 97.83 N
+ATOM 5472 CE2 TRP L 148 -38.097 -9.270 -51.941 1.00105.07 C
+ATOM 5473 CE3 TRP L 148 -38.974 -9.296 -49.689 1.00100.07 C
+ATOM 5474 CZ2 TRP L 148 -36.787 -9.387 -51.483 1.00108.72 C
+ATOM 5475 CZ3 TRP L 148 -37.674 -9.413 -49.236 1.00104.64 C
+ATOM 5476 CH2 TRP L 148 -36.597 -9.457 -50.130 1.00106.97 C
+ATOM 5477 H TRP L 148 -42.838 -10.579 -53.184 1.00 0.00 H
+ATOM 5478 HA TRP L 148 -41.745 -10.944 -50.472 1.00 0.00 H
+ATOM 5479 1HB TRP L 148 -42.367 -8.481 -52.143 1.00 0.00 H
+ATOM 5480 2HB TRP L 148 -41.791 -8.399 -50.484 1.00 0.00 H
+ATOM 5481 HD1 TRP L 148 -40.600 -8.987 -54.036 1.00 0.00 H
+ATOM 5482 HE1 TRP L 148 -38.023 -9.189 -54.060 1.00 0.00 H
+ATOM 5483 HE3 TRP L 148 -39.807 -9.260 -48.987 1.00 0.00 H
+ATOM 5484 HZ2 TRP L 148 -35.936 -9.421 -52.164 1.00 0.00 H
+ATOM 5485 HZ3 TRP L 148 -37.508 -9.471 -48.160 1.00 0.00 H
+ATOM 5486 HH2 TRP L 148 -35.585 -9.550 -49.736 1.00 0.00 H
+ATOM 5487 N LYS L 149 -43.666 -10.257 -49.029 1.00109.99 N
+ATOM 5488 CA LYS L 149 -44.821 -10.041 -48.169 1.00110.06 C
+ATOM 5489 C LYS L 149 -44.412 -9.151 -47.007 1.00117.07 C
+ATOM 5490 O LYS L 149 -43.436 -9.448 -46.314 1.00117.85 O
+ATOM 5491 CB LYS L 149 -45.386 -11.368 -47.659 1.00102.72 C
+ATOM 5492 CG LYS L 149 -45.941 -12.275 -48.749 1.00104.95 C
+ATOM 5493 CD LYS L 149 -46.534 -13.547 -48.161 1.00 0.00 C
+ATOM 5494 CE LYS L 149 -47.077 -14.460 -49.250 1.00 0.00 C
+ATOM 5495 NZ LYS L 149 -47.658 -15.711 -48.689 1.00 0.00 N
+ATOM 5496 H LYS L 149 -42.777 -10.487 -48.610 1.00 0.00 H
+ATOM 5497 HA LYS L 149 -45.598 -9.546 -48.752 1.00 0.00 H
+ATOM 5498 1HB LYS L 149 -44.605 -11.917 -47.132 1.00 0.00 H
+ATOM 5499 2HB LYS L 149 -46.187 -11.173 -46.946 1.00 0.00 H
+ATOM 5500 1HG LYS L 149 -46.717 -11.746 -49.304 1.00 0.00 H
+ATOM 5501 2HG LYS L 149 -45.143 -12.543 -49.441 1.00 0.00 H
+ATOM 5502 1HD LYS L 149 -45.766 -14.081 -47.600 1.00 0.00 H
+ATOM 5503 2HD LYS L 149 -47.344 -13.289 -47.479 1.00 0.00 H
+ATOM 5504 1HE LYS L 149 -47.849 -13.937 -49.812 1.00 0.00 H
+ATOM 5505 2HE LYS L 149 -46.274 -14.725 -49.937 1.00 0.00 H
+ATOM 5506 1HZ LYS L 149 -48.006 -16.288 -49.441 1.00 0.00 H
+ATOM 5507 2HZ LYS L 149 -46.945 -16.215 -48.180 1.00 0.00 H
+ATOM 5508 3HZ LYS L 149 -48.417 -15.479 -48.064 1.00 0.00 H
+ATOM 5509 N VAL L 150 -45.145 -8.060 -46.800 1.00133.58 N
+ATOM 5510 CA VAL L 150 -44.941 -7.184 -45.650 1.00140.59 C
+ATOM 5511 C VAL L 150 -46.190 -7.249 -44.778 1.00149.60 C
+ATOM 5512 O VAL L 150 -47.313 -7.070 -45.268 1.00155.14 O
+ATOM 5513 CB VAL L 150 -44.602 -5.741 -46.074 1.00139.87 C
+ATOM 5514 CG1 VAL L 150 -43.396 -5.740 -46.998 1.00135.63 C
+ATOM 5515 CG2 VAL L 150 -45.780 -5.049 -46.755 1.00143.19 C
+ATOM 5516 H VAL L 150 -45.869 -7.835 -47.468 1.00 0.00 H
+ATOM 5517 HA VAL L 150 -44.103 -7.567 -45.067 1.00 0.00 H
+ATOM 5518 HB VAL L 150 -44.331 -5.166 -45.188 1.00 0.00 H
+ATOM 5519 1HG1 VAL L 150 -43.164 -4.716 -47.292 1.00 0.00 H
+ATOM 5520 2HG1 VAL L 150 -42.540 -6.171 -46.479 1.00 0.00 H
+ATOM 5521 3HG1 VAL L 150 -43.618 -6.330 -47.887 1.00 0.00 H
+ATOM 5522 1HG2 VAL L 150 -45.494 -4.036 -47.035 1.00 0.00 H
+ATOM 5523 2HG2 VAL L 150 -46.063 -5.607 -47.648 1.00 0.00 H
+ATOM 5524 3HG2 VAL L 150 -46.626 -5.011 -46.068 1.00 0.00 H
+ATOM 5525 N ASP L 151 -45.992 -7.547 -43.492 1.00149.05 N
+ATOM 5526 CA ASP L 151 -47.092 -7.754 -42.549 1.00153.42 C
+ATOM 5527 C ASP L 151 -48.120 -8.736 -43.110 1.00150.31 C
+ATOM 5528 O ASP L 151 -49.330 -8.534 -42.995 1.00154.67 O
+ATOM 5529 CB ASP L 151 -47.751 -6.426 -42.172 1.00164.62 C
+ATOM 5530 CG ASP L 151 -46.788 -5.467 -41.491 1.00170.43 C
+ATOM 5531 OD1 ASP L 151 -45.871 -5.937 -40.785 1.00172.55 O
+ATOM 5532 OD2 ASP L 151 -46.954 -4.240 -41.658 1.00171.61 O
+ATOM 5533 H ASP L 151 -45.040 -7.631 -43.164 1.00 0.00 H
+ATOM 5534 HA ASP L 151 -46.690 -8.207 -41.642 1.00 0.00 H
+ATOM 5535 1HB ASP L 151 -48.147 -5.949 -43.069 1.00 0.00 H
+ATOM 5536 2HB ASP L 151 -48.591 -6.614 -41.503 1.00 0.00 H
+ATOM 5537 N ASN L 152 -47.622 -9.806 -43.737 1.00144.10 N
+ATOM 5538 CA ASN L 152 -48.459 -10.843 -44.346 1.00152.24 C
+ATOM 5539 C ASN L 152 -49.360 -10.261 -45.439 1.00152.28 C
+ATOM 5540 O ASN L 152 -50.575 -10.472 -45.456 1.00154.37 O
+ATOM 5541 CB ASN L 152 -49.282 -11.579 -43.284 1.00162.88 C
+ATOM 5542 CG ASN L 152 -49.556 -13.025 -43.652 1.00164.88 C
+ATOM 5543 OD1 ASN L 152 -49.622 -13.379 -44.829 1.00161.52 O
+ATOM 5544 ND2 ASN L 152 -49.719 -13.872 -42.640 1.00167.98 N
+ATOM 5545 H ASN L 152 -46.617 -9.893 -43.787 1.00 0.00 H
+ATOM 5546 HA ASN L 152 -47.809 -11.567 -44.840 1.00 0.00 H
+ATOM 5547 1HB ASN L 152 -48.752 -11.554 -42.331 1.00 0.00 H
+ATOM 5548 2HB ASN L 152 -50.234 -11.067 -43.142 1.00 0.00 H
+ATOM 5549 1HD2 ASN L 152 -49.902 -14.839 -42.821 1.00 0.00 H
+ATOM 5550 2HD2 ASN L 152 -49.658 -13.543 -41.698 1.00 0.00 H
+ATOM 5551 N ALA L 153 -48.746 -9.525 -46.366 1.00150.57 N
+ATOM 5552 CA ALA L 153 -49.468 -8.926 -47.483 1.00149.87 C
+ATOM 5553 C ALA L 153 -48.539 -8.841 -48.685 1.00145.38 C
+ATOM 5554 O ALA L 153 -47.425 -8.323 -48.573 1.00139.90 O
+ATOM 5555 CB ALA L 153 -50.002 -7.536 -47.119 1.00149.10 C
+ATOM 5556 H ALA L 153 -47.749 -9.379 -46.290 1.00 0.00 H
+ATOM 5557 HA ALA L 153 -50.315 -9.569 -47.723 1.00 0.00 H
+ATOM 5558 1HB ALA L 153 -50.535 -7.116 -47.972 1.00 0.00 H
+ATOM 5559 2HB ALA L 153 -50.682 -7.618 -46.271 1.00 0.00 H
+ATOM 5560 3HB ALA L 153 -49.170 -6.885 -46.855 1.00 0.00 H
+ATOM 5561 N LEU L 154 -49.009 -9.332 -49.831 1.00146.11 N
+ATOM 5562 CA LEU L 154 -48.173 -9.465 -51.017 1.00139.83 C
+ATOM 5563 C LEU L 154 -47.709 -8.097 -51.523 1.00146.50 C
+ATOM 5564 O LEU L 154 -48.269 -7.051 -51.184 1.00151.69 O
+ATOM 5565 CB LEU L 154 -48.942 -10.196 -52.125 1.00127.80 C
+ATOM 5566 CG LEU L 154 -48.915 -11.728 -52.053 1.00110.29 C
+ATOM 5567 CD1 LEU L 154 -49.609 -12.190 -50.779 1.00 0.00 C
+ATOM 5568 CD2 LEU L 154 -49.594 -12.307 -53.286 1.00 0.00 C
+ATOM 5569 H LEU L 154 -49.976 -9.620 -49.876 1.00 0.00 H
+ATOM 5570 HA LEU L 154 -47.287 -10.040 -50.752 1.00 0.00 H
+ATOM 5571 1HB LEU L 154 -49.984 -9.882 -52.090 1.00 0.00 H
+ATOM 5572 2HB LEU L 154 -48.527 -9.902 -53.088 1.00 0.00 H
+ATOM 5573 HG LEU L 154 -47.881 -12.073 -52.013 1.00 0.00 H
+ATOM 5574 1HD1 LEU L 154 -49.589 -13.279 -50.728 1.00 0.00 H
+ATOM 5575 2HD1 LEU L 154 -49.091 -11.778 -49.913 1.00 0.00 H
+ATOM 5576 3HD1 LEU L 154 -50.642 -11.846 -50.782 1.00 0.00 H
+ATOM 5577 1HD2 LEU L 154 -49.573 -13.396 -53.235 1.00 0.00 H
+ATOM 5578 2HD2 LEU L 154 -50.628 -11.964 -53.326 1.00 0.00 H
+ATOM 5579 3HD2 LEU L 154 -49.067 -11.975 -54.181 1.00 0.00 H
+ATOM 5580 N GLN L 155 -46.660 -8.120 -52.347 1.00144.81 N
+ATOM 5581 CA GLN L 155 -46.068 -6.919 -52.920 1.00146.64 C
+ATOM 5582 C GLN L 155 -46.001 -7.046 -54.435 1.00143.70 C
+ATOM 5583 O GLN L 155 -45.934 -8.152 -54.978 1.00142.27 O
+ATOM 5584 CB GLN L 155 -44.659 -6.668 -52.362 1.00144.39 C
+ATOM 5585 CG GLN L 155 -44.431 -5.256 -51.858 1.00139.63 C
+ATOM 5586 CD GLN L 155 -45.176 -4.981 -50.572 1.00137.89 C
+ATOM 5587 OE1 GLN L 155 -45.472 -5.900 -49.810 1.00132.77 O
+ATOM 5588 NE2 GLN L 155 -45.478 -3.713 -50.318 1.00140.53 N
+ATOM 5589 H GLN L 155 -46.266 -9.021 -52.577 1.00 0.00 H
+ATOM 5590 HA GLN L 155 -46.694 -6.066 -52.659 1.00 0.00 H
+ATOM 5591 1HB GLN L 155 -44.467 -7.354 -51.537 1.00 0.00 H
+ATOM 5592 2HB GLN L 155 -43.919 -6.872 -53.136 1.00 0.00 H
+ATOM 5593 1HG GLN L 155 -43.366 -5.114 -51.675 1.00 0.00 H
+ATOM 5594 2HG GLN L 155 -44.778 -4.551 -52.614 1.00 0.00 H
+ATOM 5595 1HE2 GLN L 155 -45.971 -3.474 -49.480 1.00 0.00 H
+ATOM 5596 2HE2 GLN L 155 -45.213 -2.996 -50.963 1.00 0.00 H
+ATOM 5597 N SER L 156 -46.014 -5.900 -55.113 1.00142.04 N
+ATOM 5598 CA SER L 156 -45.938 -5.879 -56.568 1.00142.99 C
+ATOM 5599 C SER L 156 -45.458 -4.512 -57.028 1.00144.05 C
+ATOM 5600 O SER L 156 -45.807 -3.491 -56.430 1.00147.98 O
+ATOM 5601 CB SER L 156 -47.295 -6.202 -57.204 1.00142.34 C
+ATOM 5602 OG SER L 156 -47.674 -7.542 -56.947 1.00139.97 O
+ATOM 5603 H SER L 156 -46.078 -5.026 -54.611 1.00 0.00 H
+ATOM 5604 HA SER L 156 -45.223 -6.638 -56.888 1.00 0.00 H
+ATOM 5605 1HB SER L 156 -48.052 -5.526 -56.808 1.00 0.00 H
+ATOM 5606 2HB SER L 156 -47.241 -6.038 -58.279 1.00 0.00 H
+ATOM 5607 HG SER L 156 -46.964 -7.922 -56.424 1.00 0.00 H
+ATOM 5608 N GLY L 157 -44.662 -4.503 -58.097 1.00139.30 N
+ATOM 5609 CA GLY L 157 -44.195 -3.269 -58.692 1.00134.23 C
+ATOM 5610 C GLY L 157 -42.949 -2.681 -58.072 1.00131.14 C
+ATOM 5611 O GLY L 157 -42.553 -1.573 -58.450 1.00134.97 O
+ATOM 5612 H GLY L 157 -44.377 -5.383 -58.502 1.00 0.00 H
+ATOM 5613 1HA GLY L 157 -43.989 -3.430 -59.750 1.00 0.00 H
+ATOM 5614 2HA GLY L 157 -44.979 -2.515 -58.629 1.00 0.00 H
+ATOM 5615 N ASN L 158 -42.315 -3.384 -57.136 1.00125.02 N
+ATOM 5616 CA ASN L 158 -41.124 -2.869 -56.478 1.00122.79 C
+ATOM 5617 C ASN L 158 -40.005 -3.892 -56.363 1.00119.85 C
+ATOM 5618 O ASN L 158 -38.942 -3.557 -55.833 1.00114.06 O
+ATOM 5619 CB ASN L 158 -41.475 -2.342 -55.078 1.00122.34 C
+ATOM 5620 CG ASN L 158 -42.482 -3.220 -54.363 1.00122.88 C
+ATOM 5621 OD1 ASN L 158 -42.585 -4.416 -54.637 1.00128.74 O
+ATOM 5622 ND2 ASN L 158 -43.232 -2.629 -53.440 1.00112.76 N
+ATOM 5623 H ASN L 158 -42.666 -4.294 -56.875 1.00 0.00 H
+ATOM 5624 HA ASN L 158 -40.728 -2.045 -57.074 1.00 0.00 H
+ATOM 5625 1HB ASN L 158 -40.569 -2.281 -54.474 1.00 0.00 H
+ATOM 5626 2HB ASN L 158 -41.882 -1.334 -55.160 1.00 0.00 H
+ATOM 5627 1HD2 ASN L 158 -43.914 -3.159 -52.935 1.00 0.00 H
+ATOM 5628 2HD2 ASN L 158 -43.115 -1.655 -53.250 1.00 0.00 H
+ATOM 5629 N SER L 159 -40.205 -5.117 -56.835 1.00123.83 N
+ATOM 5630 CA SER L 159 -39.188 -6.154 -56.782 1.00115.22 C
+ATOM 5631 C SER L 159 -38.475 -6.240 -58.123 1.00108.22 C
+ATOM 5632 O SER L 159 -39.111 -6.191 -59.180 1.00113.04 O
+ATOM 5633 CB SER L 159 -39.809 -7.509 -56.436 1.00114.99 C
+ATOM 5634 OG SER L 159 -40.869 -7.363 -55.507 1.00114.04 O
+ATOM 5635 H SER L 159 -41.103 -5.329 -57.246 1.00 0.00 H
+ATOM 5636 HA SER L 159 -38.469 -5.895 -56.003 1.00 0.00 H
+ATOM 5637 1HB SER L 159 -40.182 -7.981 -57.345 1.00 0.00 H
+ATOM 5638 2HB SER L 159 -39.045 -8.163 -56.018 1.00 0.00 H
+ATOM 5639 HG SER L 159 -40.932 -6.423 -55.323 1.00 0.00 H
+ATOM 5640 N GLN L 160 -37.151 -6.364 -58.078 1.00 99.28 N
+ATOM 5641 CA GLN L 160 -36.356 -6.595 -59.276 1.00100.61 C
+ATOM 5642 C GLN L 160 -35.449 -7.791 -59.036 1.00103.12 C
+ATOM 5643 O GLN L 160 -34.737 -7.844 -58.027 1.00101.88 O
+ATOM 5644 CB GLN L 160 -35.539 -5.359 -59.658 1.00 93.87 C
+ATOM 5645 CG GLN L 160 -36.391 -4.215 -60.182 1.00109.10 C
+ATOM 5646 CD GLN L 160 -35.574 -3.009 -60.599 1.00117.54 C
+ATOM 5647 OE1 GLN L 160 -34.401 -2.885 -60.245 1.00116.71 O
+ATOM 5648 NE2 GLN L 160 -36.196 -2.103 -61.345 1.00123.21 N
+ATOM 5649 H GLN L 160 -36.685 -6.295 -57.184 1.00 0.00 H
+ATOM 5650 HA GLN L 160 -37.031 -6.822 -60.101 1.00 0.00 H
+ATOM 5651 1HB GLN L 160 -34.984 -5.006 -58.788 1.00 0.00 H
+ATOM 5652 2HB GLN L 160 -34.811 -5.626 -60.424 1.00 0.00 H
+ATOM 5653 1HG GLN L 160 -36.949 -4.560 -61.052 1.00 0.00 H
+ATOM 5654 2HG GLN L 160 -37.080 -3.900 -59.398 1.00 0.00 H
+ATOM 5655 1HE2 GLN L 160 -35.707 -1.285 -61.651 1.00 0.00 H
+ATOM 5656 2HE2 GLN L 160 -37.153 -2.238 -61.602 1.00 0.00 H
+ATOM 5657 N GLU L 161 -35.483 -8.747 -59.958 1.00102.48 N
+ATOM 5658 CA GLU L 161 -34.774 -10.010 -59.819 1.00 95.37 C
+ATOM 5659 C GLU L 161 -33.534 -10.036 -60.702 1.00 88.25 C
+ATOM 5660 O GLU L 161 -33.358 -9.214 -61.605 1.00 94.24 O
+ATOM 5661 CB GLU L 161 -35.692 -11.187 -60.166 1.00104.11 C
+ATOM 5662 CG GLU L 161 -36.176 -11.969 -58.962 1.00124.61 C
+ATOM 5663 CD GLU L 161 -37.364 -12.853 -59.282 1.00142.68 C
+ATOM 5664 OE1 GLU L 161 -37.321 -13.571 -60.304 1.00144.12 O
+ATOM 5665 OE2 GLU L 161 -38.345 -12.827 -58.509 1.00154.38 O
+ATOM 5666 H GLU L 161 -36.030 -8.579 -60.790 1.00 0.00 H
+ATOM 5667 HA GLU L 161 -34.453 -10.114 -58.782 1.00 0.00 H
+ATOM 5668 1HB GLU L 161 -36.566 -10.820 -60.704 1.00 0.00 H
+ATOM 5669 2HB GLU L 161 -35.166 -11.876 -60.827 1.00 0.00 H
+ATOM 5670 1HG GLU L 161 -35.360 -12.591 -58.594 1.00 0.00 H
+ATOM 5671 2HG GLU L 161 -36.448 -11.269 -58.173 1.00 0.00 H
+ATOM 5672 N SER L 162 -32.668 -11.007 -60.422 1.00 85.50 N
+ATOM 5673 CA SER L 162 -31.440 -11.198 -61.182 1.00 87.30 C
+ATOM 5674 C SER L 162 -30.952 -12.617 -60.939 1.00 92.15 C
+ATOM 5675 O SER L 162 -30.924 -13.074 -59.793 1.00 92.71 O
+ATOM 5676 CB SER L 162 -30.370 -10.179 -60.776 1.00 90.08 C
+ATOM 5677 OG SER L 162 -29.337 -10.111 -61.744 1.00 96.66 O
+ATOM 5678 H SER L 162 -32.874 -11.631 -59.655 1.00 0.00 H
+ATOM 5679 HA SER L 162 -31.662 -11.056 -62.241 1.00 0.00 H
+ATOM 5680 1HB SER L 162 -30.828 -9.197 -60.661 1.00 0.00 H
+ATOM 5681 2HB SER L 162 -29.949 -10.459 -59.811 1.00 0.00 H
+ATOM 5682 HG SER L 162 -29.575 -10.739 -62.430 1.00 0.00 H
+ATOM 5683 N VAL L 163 -30.578 -13.308 -62.014 1.00 91.56 N
+ATOM 5684 CA VAL L 163 -30.159 -14.703 -61.960 1.00 81.38 C
+ATOM 5685 C VAL L 163 -28.740 -14.807 -62.500 1.00 79.54 C
+ATOM 5686 O VAL L 163 -28.371 -14.095 -63.440 1.00 78.58 O
+ATOM 5687 CB VAL L 163 -31.119 -15.607 -62.763 1.00 84.89 C
+ATOM 5688 CG1 VAL L 163 -30.781 -17.076 -62.562 1.00 76.45 C
+ATOM 5689 CG2 VAL L 163 -32.562 -15.332 -62.365 1.00 94.22 C
+ATOM 5690 H VAL L 163 -30.589 -12.832 -62.905 1.00 0.00 H
+ATOM 5691 HA VAL L 163 -30.173 -15.029 -60.919 1.00 0.00 H
+ATOM 5692 HB VAL L 163 -30.993 -15.401 -63.826 1.00 0.00 H
+ATOM 5693 1HG1 VAL L 163 -31.472 -17.691 -63.139 1.00 0.00 H
+ATOM 5694 2HG1 VAL L 163 -29.762 -17.264 -62.898 1.00 0.00 H
+ATOM 5695 3HG1 VAL L 163 -30.868 -17.328 -61.505 1.00 0.00 H
+ATOM 5696 1HG2 VAL L 163 -33.227 -15.976 -62.940 1.00 0.00 H
+ATOM 5697 2HG2 VAL L 163 -32.691 -15.534 -61.301 1.00 0.00 H
+ATOM 5698 3HG2 VAL L 163 -32.803 -14.288 -62.568 1.00 0.00 H
+ATOM 5699 N THR L 164 -27.942 -15.685 -61.896 1.00 81.66 N
+ATOM 5700 CA THR L 164 -26.608 -15.962 -62.405 1.00 84.17 C
+ATOM 5701 C THR L 164 -26.677 -16.978 -63.542 1.00 85.08 C
+ATOM 5702 O THR L 164 -27.712 -17.598 -63.800 1.00 97.46 O
+ATOM 5703 CB THR L 164 -25.695 -16.497 -61.300 1.00 81.79 C
+ATOM 5704 OG1 THR L 164 -26.237 -17.718 -60.775 1.00 73.60 O
+ATOM 5705 CG2 THR L 164 -25.554 -15.484 -60.179 1.00 79.97 C
+ATOM 5706 H THR L 164 -28.264 -16.169 -61.070 1.00 0.00 H
+ATOM 5707 HA THR L 164 -26.181 -15.032 -62.781 1.00 0.00 H
+ATOM 5708 HB THR L 164 -24.709 -16.709 -61.713 1.00 0.00 H
+ATOM 5709 HG1 THR L 164 -27.054 -17.929 -61.234 1.00 0.00 H
+ATOM 5710 1HG2 THR L 164 -24.900 -15.886 -59.405 1.00 0.00 H
+ATOM 5711 2HG2 THR L 164 -25.126 -14.562 -60.573 1.00 0.00 H
+ATOM 5712 3HG2 THR L 164 -26.534 -15.275 -59.752 1.00 0.00 H
+ATOM 5713 N GLU L 165 -25.550 -17.154 -64.222 1.00 77.05 N
+ATOM 5714 CA GLU L 165 -25.455 -18.213 -65.210 1.00 81.03 C
+ATOM 5715 C GLU L 165 -25.306 -19.565 -64.515 1.00 88.69 C
+ATOM 5716 O GLU L 165 -25.033 -19.653 -63.315 1.00110.79 O
+ATOM 5717 CB GLU L 165 -24.273 -17.966 -66.151 1.00 81.27 C
+ATOM 5718 CG GLU L 165 -24.403 -16.716 -67.008 1.00 0.00 C
+ATOM 5719 CD GLU L 165 -25.519 -16.807 -68.011 1.00 0.00 C
+ATOM 5720 OE1 GLU L 165 -25.577 -17.783 -68.721 1.00 0.00 O
+ATOM 5721 OE2 GLU L 165 -26.316 -15.900 -68.068 1.00 0.00 O
+ATOM 5722 H GLU L 165 -24.751 -16.558 -64.062 1.00 0.00 H
+ATOM 5723 HA GLU L 165 -26.377 -18.227 -65.792 1.00 0.00 H
+ATOM 5724 1HB GLU L 165 -23.356 -17.879 -65.568 1.00 0.00 H
+ATOM 5725 2HB GLU L 165 -24.156 -18.820 -66.819 1.00 0.00 H
+ATOM 5726 1HG GLU L 165 -24.583 -15.859 -66.359 1.00 0.00 H
+ATOM 5727 2HG GLU L 165 -23.463 -16.548 -67.532 1.00 0.00 H
+ATOM 5728 N GLN L 166 -25.498 -20.631 -65.286 1.00 79.64 N
+ATOM 5729 CA GLN L 166 -25.327 -21.975 -64.751 1.00 81.28 C
+ATOM 5730 C GLN L 166 -23.871 -22.190 -64.358 1.00 86.76 C
+ATOM 5731 O GLN L 166 -22.957 -21.906 -65.138 1.00 95.82 O
+ATOM 5732 CB GLN L 166 -25.768 -23.011 -65.786 1.00 80.67 C
+ATOM 5733 CG GLN L 166 -26.057 -24.390 -65.222 1.00 90.33 C
+ATOM 5734 CD GLN L 166 -26.715 -25.309 -66.236 1.00 96.48 C
+ATOM 5735 OE1 GLN L 166 -27.063 -24.887 -67.336 1.00102.10 O
+ATOM 5736 NE2 GLN L 166 -26.891 -26.570 -65.866 1.00105.06 N
+ATOM 5737 H GLN L 166 -25.765 -20.517 -66.253 1.00 0.00 H
+ATOM 5738 HA GLN L 166 -25.951 -22.076 -63.863 1.00 0.00 H
+ATOM 5739 1HB GLN L 166 -26.671 -22.663 -66.288 1.00 0.00 H
+ATOM 5740 2HB GLN L 166 -24.993 -23.120 -66.545 1.00 0.00 H
+ATOM 5741 1HG GLN L 166 -25.119 -24.847 -64.907 1.00 0.00 H
+ATOM 5742 2HG GLN L 166 -26.728 -24.289 -64.369 1.00 0.00 H
+ATOM 5743 1HE2 GLN L 166 -27.320 -27.221 -66.494 1.00 0.00 H
+ATOM 5744 2HE2 GLN L 166 -26.595 -26.872 -64.959 1.00 0.00 H
+ATOM 5745 N ASP L 167 -23.655 -22.676 -63.137 1.00 82.67 N
+ATOM 5746 CA ASP L 167 -22.301 -22.795 -62.614 1.00 92.11 C
+ATOM 5747 C ASP L 167 -21.516 -23.847 -63.389 1.00 91.45 C
+ATOM 5748 O ASP L 167 -22.038 -24.910 -63.733 1.00 85.93 O
+ATOM 5749 CB ASP L 167 -22.333 -23.144 -61.126 1.00101.02 C
+ATOM 5750 CG ASP L 167 -20.960 -23.078 -60.479 1.00120.73 C
+ATOM 5751 OD1 ASP L 167 -20.003 -22.627 -61.143 1.00132.54 O
+ATOM 5752 OD2 ASP L 167 -20.834 -23.474 -59.301 1.00132.43 O
+ATOM 5753 H ASP L 167 -24.432 -22.967 -62.561 1.00 0.00 H
+ATOM 5754 HA ASP L 167 -21.797 -21.836 -62.737 1.00 0.00 H
+ATOM 5755 1HB ASP L 167 -23.000 -22.456 -60.605 1.00 0.00 H
+ATOM 5756 2HB ASP L 167 -22.734 -24.150 -60.997 1.00 0.00 H
+ATOM 5757 N SER L 168 -20.245 -23.541 -63.661 1.00 95.46 N
+ATOM 5758 CA SER L 168 -19.413 -24.429 -64.463 1.00104.07 C
+ATOM 5759 C SER L 168 -19.086 -25.735 -63.748 1.00110.76 C
+ATOM 5760 O SER L 168 -18.730 -26.716 -64.410 1.00112.62 O
+ATOM 5761 CB SER L 168 -18.119 -23.715 -64.857 1.00115.14 C
+ATOM 5762 OG SER L 168 -17.280 -24.558 -65.626 1.00128.70 O
+ATOM 5763 H SER L 168 -19.849 -22.682 -63.308 1.00 0.00 H
+ATOM 5764 HA SER L 168 -19.961 -24.693 -65.368 1.00 0.00 H
+ATOM 5765 1HB SER L 168 -18.358 -22.819 -65.430 1.00 0.00 H
+ATOM 5766 2HB SER L 168 -17.591 -23.398 -63.959 1.00 0.00 H
+ATOM 5767 HG SER L 168 -17.748 -25.392 -65.710 1.00 0.00 H
+ATOM 5768 N LYS L 169 -19.203 -25.775 -62.420 1.00108.30 N
+ATOM 5769 CA LYS L 169 -18.835 -26.953 -61.642 1.00103.63 C
+ATOM 5770 C LYS L 169 -20.037 -27.845 -61.341 1.00103.21 C
+ATOM 5771 O LYS L 169 -20.072 -29.005 -61.762 1.00 96.52 O
+ATOM 5772 CB LYS L 169 -18.159 -26.532 -60.336 1.00104.53 C
+ATOM 5773 CG LYS L 169 -17.692 -27.693 -59.467 1.00 0.00 C
+ATOM 5774 CD LYS L 169 -16.957 -27.197 -58.231 1.00 0.00 C
+ATOM 5775 CE LYS L 169 -16.506 -28.354 -57.353 1.00 0.00 C
+ATOM 5776 NZ LYS L 169 -15.786 -27.883 -56.138 1.00 0.00 N
+ATOM 5777 H LYS L 169 -19.559 -24.960 -61.941 1.00 0.00 H
+ATOM 5778 HA LYS L 169 -18.141 -27.554 -62.231 1.00 0.00 H
+ATOM 5779 1HB LYS L 169 -17.292 -25.911 -60.559 1.00 0.00 H
+ATOM 5780 2HB LYS L 169 -18.850 -25.930 -59.746 1.00 0.00 H
+ATOM 5781 1HG LYS L 169 -18.553 -28.284 -59.155 1.00 0.00 H
+ATOM 5782 2HG LYS L 169 -17.024 -28.332 -60.044 1.00 0.00 H
+ATOM 5783 1HD LYS L 169 -16.083 -26.618 -58.534 1.00 0.00 H
+ATOM 5784 2HD LYS L 169 -17.616 -26.549 -57.652 1.00 0.00 H
+ATOM 5785 1HE LYS L 169 -17.373 -28.935 -57.043 1.00 0.00 H
+ATOM 5786 2HE LYS L 169 -15.843 -29.006 -57.922 1.00 0.00 H
+ATOM 5787 1HZ LYS L 169 -15.503 -28.679 -55.584 1.00 0.00 H
+ATOM 5788 2HZ LYS L 169 -14.968 -27.358 -56.414 1.00 0.00 H
+ATOM 5789 3HZ LYS L 169 -16.396 -27.293 -55.592 1.00 0.00 H
+ATOM 5790 N ASP L 170 -21.028 -27.324 -60.619 1.00 98.10 N
+ATOM 5791 CA ASP L 170 -22.167 -28.122 -60.185 1.00106.26 C
+ATOM 5792 C ASP L 170 -23.443 -27.844 -60.969 1.00 96.30 C
+ATOM 5793 O ASP L 170 -24.484 -28.423 -60.643 1.00 93.99 O
+ATOM 5794 CB ASP L 170 -22.417 -27.915 -58.683 1.00125.41 C
+ATOM 5795 CG ASP L 170 -22.737 -26.475 -58.332 1.00133.98 C
+ATOM 5796 OD1 ASP L 170 -22.656 -25.608 -59.224 1.00134.77 O
+ATOM 5797 OD2 ASP L 170 -23.062 -26.208 -57.155 1.00141.62 O
+ATOM 5798 H ASP L 170 -20.987 -26.347 -60.366 1.00 0.00 H
+ATOM 5799 HA ASP L 170 -21.940 -29.174 -60.362 1.00 0.00 H
+ATOM 5800 1HB ASP L 170 -23.247 -28.545 -58.362 1.00 0.00 H
+ATOM 5801 2HB ASP L 170 -21.535 -28.224 -58.121 1.00 0.00 H
+ATOM 5802 N SER L 171 -23.395 -26.973 -61.980 1.00100.47 N
+ATOM 5803 CA SER L 171 -24.507 -26.767 -62.916 1.00 94.21 C
+ATOM 5804 C SER L 171 -25.775 -26.285 -62.212 1.00 91.48 C
+ATOM 5805 O SER L 171 -26.885 -26.724 -62.522 1.00 84.91 O
+ATOM 5806 CB SER L 171 -24.789 -28.037 -63.721 1.00 92.09 C
+ATOM 5807 OG SER L 171 -23.627 -28.475 -64.402 1.00 94.32 O
+ATOM 5808 H SER L 171 -22.548 -26.436 -62.097 1.00 0.00 H
+ATOM 5809 HA SER L 171 -24.232 -25.973 -63.611 1.00 0.00 H
+ATOM 5810 1HB SER L 171 -25.139 -28.822 -63.051 1.00 0.00 H
+ATOM 5811 2HB SER L 171 -25.584 -27.843 -64.440 1.00 0.00 H
+ATOM 5812 HG SER L 171 -22.937 -27.846 -64.179 1.00 0.00 H
+ATOM 5813 N THR L 172 -25.617 -25.360 -61.273 1.00 92.80 N
+ATOM 5814 CA THR L 172 -26.721 -24.834 -60.484 1.00 87.57 C
+ATOM 5815 C THR L 172 -26.921 -23.353 -60.788 1.00 88.69 C
+ATOM 5816 O THR L 172 -26.181 -22.747 -61.569 1.00 88.94 O
+ATOM 5817 CB THR L 172 -26.467 -25.060 -58.995 1.00 88.91 C
+ATOM 5818 OG1 THR L 172 -25.292 -24.341 -58.603 1.00 93.86 O
+ATOM 5819 CG2 THR L 172 -26.265 -26.540 -58.721 1.00 85.71 C
+ATOM 5820 H THR L 172 -24.684 -25.012 -61.106 1.00 0.00 H
+ATOM 5821 HA THR L 172 -27.631 -25.363 -60.767 1.00 0.00 H
+ATOM 5822 HB THR L 172 -27.320 -24.698 -58.421 1.00 0.00 H
+ATOM 5823 HG1 THR L 172 -24.931 -23.880 -59.364 1.00 0.00 H
+ATOM 5824 1HG2 THR L 172 -26.085 -26.692 -57.657 1.00 0.00 H
+ATOM 5825 2HG2 THR L 172 -27.157 -27.090 -59.021 1.00 0.00 H
+ATOM 5826 3HG2 THR L 172 -25.408 -26.901 -59.289 1.00 0.00 H
+ATOM 5827 N TYR L 173 -27.932 -22.767 -60.154 1.00 86.52 N
+ATOM 5828 CA TYR L 173 -28.287 -21.367 -60.351 1.00 83.07 C
+ATOM 5829 C TYR L 173 -28.241 -20.620 -59.021 1.00 91.04 C
+ATOM 5830 O TYR L 173 -27.948 -21.190 -57.967 1.00 91.31 O
+ATOM 5831 CB TYR L 173 -29.670 -21.238 -60.997 1.00 76.90 C
+ATOM 5832 CG TYR L 173 -29.708 -21.692 -62.439 1.00 90.34 C
+ATOM 5833 CD1 TYR L 173 -29.063 -20.965 -63.431 1.00 91.66 C
+ATOM 5834 CD2 TYR L 173 -30.388 -22.846 -62.810 1.00 95.74 C
+ATOM 5835 CE1 TYR L 173 -29.090 -21.374 -64.745 1.00 78.59 C
+ATOM 5836 CE2 TYR L 173 -30.420 -23.263 -64.127 1.00 84.95 C
+ATOM 5837 CZ TYR L 173 -29.768 -22.522 -65.089 1.00 84.78 C
+ATOM 5838 OH TYR L 173 -29.793 -22.926 -66.405 1.00 93.78 O
+ATOM 5839 H TYR L 173 -28.472 -23.325 -59.509 1.00 0.00 H
+ATOM 5840 HA TYR L 173 -27.552 -20.914 -61.017 1.00 0.00 H
+ATOM 5841 1HB TYR L 173 -30.392 -21.829 -60.432 1.00 0.00 H
+ATOM 5842 2HB TYR L 173 -29.995 -20.199 -60.957 1.00 0.00 H
+ATOM 5843 HD1 TYR L 173 -28.523 -20.053 -63.175 1.00 0.00 H
+ATOM 5844 HD2 TYR L 173 -30.908 -23.438 -62.057 1.00 0.00 H
+ATOM 5845 HE1 TYR L 173 -28.577 -20.789 -65.508 1.00 0.00 H
+ATOM 5846 HE2 TYR L 173 -30.959 -24.171 -64.398 1.00 0.00 H
+ATOM 5847 HH TYR L 173 -30.303 -23.736 -66.480 1.00 0.00 H
+ATOM 5848 N SER L 174 -28.530 -19.322 -59.092 1.00 93.12 N
+ATOM 5849 CA SER L 174 -28.611 -18.454 -57.925 1.00 81.81 C
+ATOM 5850 C SER L 174 -29.374 -17.201 -58.326 1.00 85.92 C
+ATOM 5851 O SER L 174 -29.155 -16.660 -59.412 1.00 89.60 O
+ATOM 5852 CB SER L 174 -27.223 -18.088 -57.388 1.00 73.66 C
+ATOM 5853 OG SER L 174 -26.607 -19.203 -56.771 1.00 75.03 O
+ATOM 5854 H SER L 174 -28.700 -18.932 -60.008 1.00 0.00 H
+ATOM 5855 HA SER L 174 -29.148 -18.983 -57.137 1.00 0.00 H
+ATOM 5856 1HB SER L 174 -26.599 -17.731 -58.207 1.00 0.00 H
+ATOM 5857 2HB SER L 174 -27.314 -17.276 -56.668 1.00 0.00 H
+ATOM 5858 HG SER L 174 -27.233 -19.927 -56.847 1.00 0.00 H
+ATOM 5859 N LEU L 175 -30.266 -16.750 -57.449 1.00 85.70 N
+ATOM 5860 CA LEU L 175 -31.159 -15.637 -57.740 1.00 84.85 C
+ATOM 5861 C LEU L 175 -31.133 -14.646 -56.586 1.00 82.05 C
+ATOM 5862 O LEU L 175 -31.095 -15.046 -55.421 1.00 82.04 O
+ATOM 5863 CB LEU L 175 -32.592 -16.138 -57.982 1.00 80.15 C
+ATOM 5864 CG LEU L 175 -33.684 -15.138 -58.365 1.00 81.12 C
+ATOM 5865 CD1 LEU L 175 -34.654 -15.796 -59.315 1.00 87.70 C
+ATOM 5866 CD2 LEU L 175 -34.423 -14.635 -57.135 1.00 91.20 C
+ATOM 5867 H LEU L 175 -30.321 -17.202 -56.547 1.00 0.00 H
+ATOM 5868 HA LEU L 175 -30.809 -15.140 -58.644 1.00 0.00 H
+ATOM 5869 1HB LEU L 175 -32.572 -16.874 -58.784 1.00 0.00 H
+ATOM 5870 2HB LEU L 175 -32.946 -16.629 -57.076 1.00 0.00 H
+ATOM 5871 HG LEU L 175 -33.234 -14.285 -58.874 1.00 0.00 H
+ATOM 5872 1HD1 LEU L 175 -35.433 -15.085 -59.590 1.00 0.00 H
+ATOM 5873 2HD1 LEU L 175 -34.124 -16.117 -60.212 1.00 0.00 H
+ATOM 5874 3HD1 LEU L 175 -35.106 -16.661 -58.831 1.00 0.00 H
+ATOM 5875 1HD2 LEU L 175 -35.193 -13.925 -57.438 1.00 0.00 H
+ATOM 5876 2HD2 LEU L 175 -34.888 -15.476 -56.620 1.00 0.00 H
+ATOM 5877 3HD2 LEU L 175 -33.719 -14.143 -56.464 1.00 0.00 H
+ATOM 5878 N SER L 176 -31.164 -13.354 -56.913 1.00 89.83 N
+ATOM 5879 CA SER L 176 -31.159 -12.291 -55.910 1.00 93.19 C
+ATOM 5880 C SER L 176 -32.254 -11.293 -56.256 1.00100.03 C
+ATOM 5881 O SER L 176 -32.184 -10.624 -57.292 1.00100.58 O
+ATOM 5882 CB SER L 176 -29.797 -11.597 -55.839 1.00 91.72 C
+ATOM 5883 OG SER L 176 -29.647 -10.656 -56.889 1.00108.54 O
+ATOM 5884 H SER L 176 -31.192 -13.107 -57.892 1.00 0.00 H
+ATOM 5885 HA SER L 176 -31.367 -12.734 -54.935 1.00 0.00 H
+ATOM 5886 1HB SER L 176 -29.696 -11.092 -54.879 1.00 0.00 H
+ATOM 5887 2HB SER L 176 -29.005 -12.343 -55.901 1.00 0.00 H
+ATOM 5888 HG SER L 176 -30.462 -10.692 -57.395 1.00 0.00 H
+ATOM 5889 N SER L 177 -33.260 -11.192 -55.392 1.00102.04 N
+ATOM 5890 CA SER L 177 -34.337 -10.228 -55.559 1.00105.23 C
+ATOM 5891 C SER L 177 -34.108 -9.039 -54.635 1.00 99.48 C
+ATOM 5892 O SER L 177 -33.751 -9.210 -53.466 1.00 99.44 O
+ATOM 5893 CB SER L 177 -35.696 -10.865 -55.265 1.00106.53 C
+ATOM 5894 OG SER L 177 -36.745 -9.930 -55.451 1.00114.23 O
+ATOM 5895 H SER L 177 -33.272 -11.809 -54.593 1.00 0.00 H
+ATOM 5896 HA SER L 177 -34.336 -9.884 -56.594 1.00 0.00 H
+ATOM 5897 1HB SER L 177 -35.846 -11.721 -55.923 1.00 0.00 H
+ATOM 5898 2HB SER L 177 -35.711 -11.234 -54.240 1.00 0.00 H
+ATOM 5899 HG SER L 177 -36.324 -9.111 -55.722 1.00 0.00 H
+ATOM 5900 N THR L 178 -34.311 -7.834 -55.165 1.00 99.96 N
+ATOM 5901 CA THR L 178 -34.096 -6.600 -54.415 1.00 96.18 C
+ATOM 5902 C THR L 178 -35.416 -5.848 -54.314 1.00 95.10 C
+ATOM 5903 O THR L 178 -35.895 -5.282 -55.304 1.00 91.03 O
+ATOM 5904 CB THR L 178 -33.022 -5.731 -55.069 1.00 98.91 C
+ATOM 5905 OG1 THR L 178 -31.821 -6.494 -55.245 1.00103.13 O
+ATOM 5906 CG2 THR L 178 -32.720 -4.523 -54.195 1.00 86.30 C
+ATOM 5907 H THR L 178 -34.626 -7.779 -56.123 1.00 0.00 H
+ATOM 5908 HA THR L 178 -33.760 -6.860 -53.411 1.00 0.00 H
+ATOM 5909 HB THR L 178 -33.372 -5.392 -56.044 1.00 0.00 H
+ATOM 5910 HG1 THR L 178 -31.957 -7.385 -54.912 1.00 0.00 H
+ATOM 5911 1HG2 THR L 178 -31.954 -3.912 -54.672 1.00 0.00 H
+ATOM 5912 2HG2 THR L 178 -33.627 -3.933 -54.064 1.00 0.00 H
+ATOM 5913 3HG2 THR L 178 -32.363 -4.858 -53.222 1.00 0.00 H
+ATOM 5914 N LEU L 179 -36.001 -5.851 -53.120 1.00 93.67 N
+ATOM 5915 CA LEU L 179 -37.199 -5.076 -52.817 1.00 99.91 C
+ATOM 5916 C LEU L 179 -36.767 -3.704 -52.312 1.00104.41 C
+ATOM 5917 O LEU L 179 -36.177 -3.591 -51.233 1.00110.37 O
+ATOM 5918 CB LEU L 179 -38.053 -5.801 -51.780 1.00 99.81 C
+ATOM 5919 CG LEU L 179 -39.276 -5.063 -51.238 1.00101.59 C
+ATOM 5920 CD1 LEU L 179 -40.308 -4.869 -52.331 1.00109.58 C
+ATOM 5921 CD2 LEU L 179 -39.873 -5.816 -50.063 1.00 95.99 C
+ATOM 5922 H LEU L 179 -35.587 -6.421 -52.396 1.00 0.00 H
+ATOM 5923 HA LEU L 179 -37.780 -4.965 -53.732 1.00 0.00 H
+ATOM 5924 1HB LEU L 179 -38.414 -6.731 -52.216 1.00 0.00 H
+ATOM 5925 2HB LEU L 179 -37.426 -6.045 -50.923 1.00 0.00 H
+ATOM 5926 HG LEU L 179 -38.983 -4.066 -50.908 1.00 0.00 H
+ATOM 5927 1HD1 LEU L 179 -41.172 -4.341 -51.926 1.00 0.00 H
+ATOM 5928 2HD1 LEU L 179 -39.874 -4.284 -53.142 1.00 0.00 H
+ATOM 5929 3HD1 LEU L 179 -40.622 -5.840 -52.711 1.00 0.00 H
+ATOM 5930 1HD2 LEU L 179 -40.743 -5.276 -49.689 1.00 0.00 H
+ATOM 5931 2HD2 LEU L 179 -40.176 -6.813 -50.385 1.00 0.00 H
+ATOM 5932 3HD2 LEU L 179 -39.130 -5.901 -49.270 1.00 0.00 H
+ATOM 5933 N THR L 180 -37.056 -2.664 -53.088 1.00102.22 N
+ATOM 5934 CA THR L 180 -36.635 -1.305 -52.774 1.00109.42 C
+ATOM 5935 C THR L 180 -37.833 -0.476 -52.329 1.00124.31 C
+ATOM 5936 O THR L 180 -38.843 -0.402 -53.038 1.00132.17 O
+ATOM 5937 CB THR L 180 -35.952 -0.652 -53.980 1.00106.44 C
+ATOM 5938 OG1 THR L 180 -34.667 -1.253 -54.187 1.00101.80 O
+ATOM 5939 CG2 THR L 180 -35.776 0.843 -53.760 1.00109.50 C
+ATOM 5940 H THR L 180 -37.590 -2.832 -53.929 1.00 0.00 H
+ATOM 5941 HA THR L 180 -35.919 -1.346 -51.953 1.00 0.00 H
+ATOM 5942 HB THR L 180 -36.559 -0.810 -54.871 1.00 0.00 H
+ATOM 5943 HG1 THR L 180 -34.521 -1.931 -53.523 1.00 0.00 H
+ATOM 5944 1HG2 THR L 180 -35.289 1.284 -54.630 1.00 0.00 H
+ATOM 5945 2HG2 THR L 180 -36.752 1.307 -53.616 1.00 0.00 H
+ATOM 5946 3HG2 THR L 180 -35.161 1.011 -52.877 1.00 0.00 H
+ATOM 5947 N LEU L 181 -37.715 0.141 -51.152 1.00121.06 N
+ATOM 5948 CA LEU L 181 -38.735 1.021 -50.598 1.00118.77 C
+ATOM 5949 C LEU L 181 -38.082 2.300 -50.093 1.00130.29 C
+ATOM 5950 O LEU L 181 -36.861 2.379 -49.926 1.00134.82 O
+ATOM 5951 CB LEU L 181 -39.503 0.349 -49.452 1.00117.10 C
+ATOM 5952 CG LEU L 181 -40.341 -0.889 -49.772 1.00131.68 C
+ATOM 5953 CD1 LEU L 181 -40.944 -1.458 -48.496 1.00126.57 C
+ATOM 5954 CD2 LEU L 181 -41.426 -0.557 -50.785 1.00149.47 C
+ATOM 5955 H LEU L 181 -36.867 -0.020 -50.628 1.00 0.00 H
+ATOM 5956 HA LEU L 181 -39.448 1.263 -51.386 1.00 0.00 H
+ATOM 5957 1HB LEU L 181 -38.790 0.048 -48.686 1.00 0.00 H
+ATOM 5958 2HB LEU L 181 -40.186 1.078 -49.017 1.00 0.00 H
+ATOM 5959 HG LEU L 181 -39.698 -1.666 -50.186 1.00 0.00 H
+ATOM 5960 1HD1 LEU L 181 -41.539 -2.340 -48.736 1.00 0.00 H
+ATOM 5961 2HD1 LEU L 181 -40.145 -1.737 -47.809 1.00 0.00 H
+ATOM 5962 3HD1 LEU L 181 -41.581 -0.708 -48.029 1.00 0.00 H
+ATOM 5963 1HD2 LEU L 181 -42.010 -1.452 -50.999 1.00 0.00 H
+ATOM 5964 2HD2 LEU L 181 -42.080 0.214 -50.378 1.00 0.00 H
+ATOM 5965 3HD2 LEU L 181 -40.967 -0.195 -51.705 1.00 0.00 H
+ATOM 5966 N SER L 182 -38.912 3.309 -49.846 1.00127.37 N
+ATOM 5967 CA SER L 182 -38.436 4.525 -49.208 1.00126.74 C
+ATOM 5968 C SER L 182 -38.428 4.346 -47.693 1.00116.88 C
+ATOM 5969 O SER L 182 -39.134 3.498 -47.139 1.00115.65 O
+ATOM 5970 CB SER L 182 -39.311 5.718 -49.594 1.00116.45 C
+ATOM 5971 OG SER L 182 -40.640 5.550 -49.130 1.00119.59 O
+ATOM 5972 H SER L 182 -39.886 3.237 -50.102 1.00 0.00 H
+ATOM 5973 HA SER L 182 -37.418 4.718 -49.548 1.00 0.00 H
+ATOM 5974 1HB SER L 182 -38.890 6.630 -49.172 1.00 0.00 H
+ATOM 5975 2HB SER L 182 -39.315 5.831 -50.677 1.00 0.00 H
+ATOM 5976 HG SER L 182 -40.657 4.704 -48.676 1.00 0.00 H
+ATOM 5977 N LYS L 183 -37.607 5.156 -47.018 1.00117.67 N
+ATOM 5978 CA LYS L 183 -37.535 5.069 -45.562 1.00115.52 C
+ATOM 5979 C LYS L 183 -38.888 5.344 -44.920 1.00120.31 C
+ATOM 5980 O LYS L 183 -39.197 4.783 -43.864 1.00123.82 O
+ATOM 5981 CB LYS L 183 -36.490 6.045 -45.019 1.00117.00 C
+ATOM 5982 CG LYS L 183 -36.338 6.025 -43.504 1.00 0.00 C
+ATOM 5983 CD LYS L 183 -37.159 7.128 -42.851 1.00 0.00 C
+ATOM 5984 CE LYS L 183 -36.559 8.499 -43.121 1.00 0.00 C
+ATOM 5985 NZ LYS L 183 -37.378 9.592 -42.529 1.00 0.00 N
+ATOM 5986 H LYS L 183 -37.031 5.832 -47.500 1.00 0.00 H
+ATOM 5987 HA LYS L 183 -37.246 4.053 -45.290 1.00 0.00 H
+ATOM 5988 1HB LYS L 183 -35.517 5.817 -45.455 1.00 0.00 H
+ATOM 5989 2HB LYS L 183 -36.752 7.061 -45.315 1.00 0.00 H
+ATOM 5990 1HG LYS L 183 -36.669 5.060 -43.117 1.00 0.00 H
+ATOM 5991 2HG LYS L 183 -35.290 6.161 -43.241 1.00 0.00 H
+ATOM 5992 1HD LYS L 183 -38.178 7.103 -43.242 1.00 0.00 H
+ATOM 5993 2HD LYS L 183 -37.198 6.964 -41.774 1.00 0.00 H
+ATOM 5994 1HE LYS L 183 -35.555 8.546 -42.701 1.00 0.00 H
+ATOM 5995 2HE LYS L 183 -36.486 8.660 -44.197 1.00 0.00 H
+ATOM 5996 1HZ LYS L 183 -36.947 10.483 -42.730 1.00 0.00 H
+ATOM 5997 2HZ LYS L 183 -38.306 9.570 -42.926 1.00 0.00 H
+ATOM 5998 3HZ LYS L 183 -37.437 9.465 -41.529 1.00 0.00 H
+ATOM 5999 N ALA L 184 -39.708 6.189 -45.549 1.00127.11 N
+ATOM 6000 CA ALA L 184 -41.028 6.497 -45.008 1.00131.57 C
+ATOM 6001 C ALA L 184 -41.917 5.259 -44.994 1.00133.72 C
+ATOM 6002 O ALA L 184 -42.434 4.858 -43.945 1.00132.07 O
+ATOM 6003 CB ALA L 184 -41.671 7.625 -45.817 1.00130.51 C
+ATOM 6004 H ALA L 184 -39.416 6.625 -46.412 1.00 0.00 H
+ATOM 6005 HA ALA L 184 -40.903 6.824 -43.976 1.00 0.00 H
+ATOM 6006 1HB ALA L 184 -42.656 7.850 -45.408 1.00 0.00 H
+ATOM 6007 2HB ALA L 184 -41.044 8.515 -45.763 1.00 0.00 H
+ATOM 6008 3HB ALA L 184 -41.772 7.315 -46.856 1.00 0.00 H
+ATOM 6009 N ASP L 185 -42.100 4.633 -46.159 1.00139.18 N
+ATOM 6010 CA ASP L 185 -42.907 3.423 -46.244 1.00142.30 C
+ATOM 6011 C ASP L 185 -42.262 2.232 -45.546 1.00137.16 C
+ATOM 6012 O ASP L 185 -42.949 1.235 -45.298 1.00144.59 O
+ATOM 6013 CB ASP L 185 -43.169 3.070 -47.710 1.00145.43 C
+ATOM 6014 CG ASP L 185 -44.136 4.032 -48.388 1.00 0.00 C
+ATOM 6015 OD1 ASP L 185 -44.796 4.768 -47.693 1.00 0.00 O
+ATOM 6016 OD2 ASP L 185 -44.205 4.022 -49.593 1.00 0.00 O
+ATOM 6017 H ASP L 185 -41.674 5.000 -46.998 1.00 0.00 H
+ATOM 6018 HA ASP L 185 -43.858 3.606 -45.743 1.00 0.00 H
+ATOM 6019 1HB ASP L 185 -42.228 3.076 -48.260 1.00 0.00 H
+ATOM 6020 2HB ASP L 185 -43.579 2.061 -47.774 1.00 0.00 H
+ATOM 6021 N TYR L 186 -40.971 2.308 -45.217 1.00124.37 N
+ATOM 6022 CA TYR L 186 -40.308 1.187 -44.559 1.00117.68 C
+ATOM 6023 C TYR L 186 -40.565 1.183 -43.057 1.00125.99 C
+ATOM 6024 O TYR L 186 -40.855 0.129 -42.479 1.00130.00 O
+ATOM 6025 CB TYR L 186 -38.805 1.224 -44.840 1.00106.36 C
+ATOM 6026 CG TYR L 186 -38.029 0.112 -44.168 1.00112.98 C
+ATOM 6027 CD1 TYR L 186 -38.146 -1.204 -44.600 1.00108.09 C
+ATOM 6028 CD2 TYR L 186 -37.180 0.378 -43.099 1.00103.54 C
+ATOM 6029 CE1 TYR L 186 -37.440 -2.224 -43.987 1.00106.36 C
+ATOM 6030 CE2 TYR L 186 -36.469 -0.636 -42.480 1.00101.61 C
+ATOM 6031 CZ TYR L 186 -36.604 -1.934 -42.929 1.00112.24 C
+ATOM 6032 OH TYR L 186 -35.901 -2.948 -42.320 1.00110.05 O
+ATOM 6033 H TYR L 186 -40.440 3.143 -45.421 1.00 0.00 H
+ATOM 6034 HA TYR L 186 -40.717 0.259 -44.960 1.00 0.00 H
+ATOM 6035 1HB TYR L 186 -38.634 1.156 -45.915 1.00 0.00 H
+ATOM 6036 2HB TYR L 186 -38.395 2.176 -44.503 1.00 0.00 H
+ATOM 6037 HD1 TYR L 186 -38.803 -1.447 -45.436 1.00 0.00 H
+ATOM 6038 HD2 TYR L 186 -37.066 1.399 -42.734 1.00 0.00 H
+ATOM 6039 HE1 TYR L 186 -37.546 -3.249 -44.341 1.00 0.00 H
+ATOM 6040 HE2 TYR L 186 -35.809 -0.407 -41.643 1.00 0.00 H
+ATOM 6041 HH TYR L 186 -35.369 -2.584 -41.608 1.00 0.00 H
+ATOM 6042 N GLU L 187 -40.467 2.345 -42.412 1.00126.74 N
+ATOM 6043 CA GLU L 187 -40.630 2.459 -40.968 1.00127.62 C
+ATOM 6044 C GLU L 187 -42.088 2.398 -40.522 1.00139.48 C
+ATOM 6045 O GLU L 187 -42.383 2.747 -39.373 1.00148.24 O
+ATOM 6046 CB GLU L 187 -40.002 3.766 -40.477 1.00120.40 C
+ATOM 6047 CG GLU L 187 -38.490 3.834 -40.634 1.00 0.00 C
+ATOM 6048 CD GLU L 187 -37.911 5.139 -40.161 1.00 0.00 C
+ATOM 6049 OE1 GLU L 187 -38.669 6.003 -39.789 1.00 0.00 O
+ATOM 6050 OE2 GLU L 187 -36.710 5.271 -40.171 1.00 0.00 O
+ATOM 6051 H GLU L 187 -40.272 3.176 -42.952 1.00 0.00 H
+ATOM 6052 HA GLU L 187 -40.129 1.613 -40.495 1.00 0.00 H
+ATOM 6053 1HB GLU L 187 -40.434 4.604 -41.024 1.00 0.00 H
+ATOM 6054 2HB GLU L 187 -40.236 3.907 -39.422 1.00 0.00 H
+ATOM 6055 1HG GLU L 187 -38.039 3.022 -40.065 1.00 0.00 H
+ATOM 6056 2HG GLU L 187 -38.237 3.690 -41.684 1.00 0.00 H
+ATOM 6057 N LYS L 188 -43.002 1.969 -41.393 1.00139.09 N
+ATOM 6058 CA LYS L 188 -44.408 1.833 -41.044 1.00146.11 C
+ATOM 6059 C LYS L 188 -44.852 0.387 -40.880 1.00153.49 C
+ATOM 6060 O LYS L 188 -45.964 0.151 -40.397 1.00164.75 O
+ATOM 6061 CB LYS L 188 -45.274 2.518 -42.102 1.00139.83 C
+ATOM 6062 CG LYS L 188 -45.074 4.025 -42.199 1.00 0.00 C
+ATOM 6063 CD LYS L 188 -45.994 4.638 -43.245 1.00 0.00 C
+ATOM 6064 CE LYS L 188 -45.803 6.145 -43.335 1.00 0.00 C
+ATOM 6065 NZ LYS L 188 -46.674 6.755 -44.376 1.00 0.00 N
+ATOM 6066 H LYS L 188 -42.702 1.731 -42.328 1.00 0.00 H
+ATOM 6067 HA LYS L 188 -44.576 2.324 -40.085 1.00 0.00 H
+ATOM 6068 1HB LYS L 188 -45.061 2.089 -43.081 1.00 0.00 H
+ATOM 6069 2HB LYS L 188 -46.327 2.334 -41.885 1.00 0.00 H
+ATOM 6070 1HG LYS L 188 -45.282 4.483 -41.231 1.00 0.00 H
+ATOM 6071 2HG LYS L 188 -44.040 4.238 -42.467 1.00 0.00 H
+ATOM 6072 1HD LYS L 188 -45.784 4.195 -44.219 1.00 0.00 H
+ATOM 6073 2HD LYS L 188 -47.031 4.428 -42.985 1.00 0.00 H
+ATOM 6074 1HE LYS L 188 -46.035 6.599 -42.373 1.00 0.00 H
+ATOM 6075 2HE LYS L 188 -44.763 6.367 -43.574 1.00 0.00 H
+ATOM 6076 1HZ LYS L 188 -46.518 7.753 -44.405 1.00 0.00 H
+ATOM 6077 2HZ LYS L 188 -46.454 6.354 -45.277 1.00 0.00 H
+ATOM 6078 3HZ LYS L 188 -47.642 6.573 -44.155 1.00 0.00 H
+ATOM 6079 N HIS L 189 -44.020 -0.580 -41.261 1.00144.72 N
+ATOM 6080 CA HIS L 189 -44.374 -1.989 -41.216 1.00143.17 C
+ATOM 6081 C HIS L 189 -43.365 -2.752 -40.368 1.00138.89 C
+ATOM 6082 O HIS L 189 -42.197 -2.365 -40.267 1.00138.28 O
+ATOM 6083 CB HIS L 189 -44.435 -2.576 -42.627 1.00151.27 C
+ATOM 6084 CG HIS L 189 -45.412 -1.880 -43.520 1.00165.85 C
+ATOM 6085 ND1 HIS L 189 -46.735 -2.255 -43.612 1.00179.29 N
+ATOM 6086 CD2 HIS L 189 -45.262 -0.822 -44.352 1.00170.34 C
+ATOM 6087 CE1 HIS L 189 -47.356 -1.463 -44.468 1.00187.00 C
+ATOM 6088 NE2 HIS L 189 -46.485 -0.585 -44.931 1.00180.70 N
+ATOM 6089 H HIS L 189 -43.105 -0.313 -41.595 1.00 0.00 H
+ATOM 6090 HA HIS L 189 -45.357 -2.103 -40.761 1.00 0.00 H
+ATOM 6091 1HB HIS L 189 -43.448 -2.520 -43.088 1.00 0.00 H
+ATOM 6092 2HB HIS L 189 -44.711 -3.629 -42.571 1.00 0.00 H
+ATOM 6093 HD2 HIS L 189 -44.342 -0.265 -44.532 1.00 0.00 H
+ATOM 6094 HE1 HIS L 189 -48.408 -1.524 -44.745 1.00 0.00 H
+ATOM 6095 HE2 HIS L 189 -46.681 0.144 -45.602 1.00 0.00 H
+ATOM 6096 N LYS L 190 -43.826 -3.848 -39.764 1.00137.57 N
+ATOM 6097 CA LYS L 190 -43.028 -4.569 -38.776 1.00136.22 C
+ATOM 6098 C LYS L 190 -42.256 -5.733 -39.387 1.00134.25 C
+ATOM 6099 O LYS L 190 -41.020 -5.724 -39.399 1.00124.41 O
+ATOM 6100 CB LYS L 190 -43.924 -5.079 -37.646 1.00135.05 C
+ATOM 6101 CG LYS L 190 -43.180 -5.806 -36.533 1.00 0.00 C
+ATOM 6102 CD LYS L 190 -44.124 -6.209 -35.410 1.00 0.00 C
+ATOM 6103 CE LYS L 190 -43.386 -6.953 -34.306 1.00 0.00 C
+ATOM 6104 NZ LYS L 190 -44.297 -7.354 -33.200 1.00 0.00 N
+ATOM 6105 H LYS L 190 -44.749 -4.188 -39.994 1.00 0.00 H
+ATOM 6106 HA LYS L 190 -42.288 -3.883 -38.362 1.00 0.00 H
+ATOM 6107 1HB LYS L 190 -44.458 -4.240 -37.199 1.00 0.00 H
+ATOM 6108 2HB LYS L 190 -44.669 -5.763 -38.053 1.00 0.00 H
+ATOM 6109 1HG LYS L 190 -42.705 -6.701 -36.937 1.00 0.00 H
+ATOM 6110 2HG LYS L 190 -42.405 -5.156 -36.129 1.00 0.00 H
+ATOM 6111 1HD LYS L 190 -44.589 -5.318 -34.988 1.00 0.00 H
+ATOM 6112 2HD LYS L 190 -44.908 -6.854 -35.807 1.00 0.00 H
+ATOM 6113 1HE LYS L 190 -42.920 -7.846 -34.719 1.00 0.00 H
+ATOM 6114 2HE LYS L 190 -42.601 -6.315 -33.900 1.00 0.00 H
+ATOM 6115 1HZ LYS L 190 -43.770 -7.843 -32.490 1.00 0.00 H
+ATOM 6116 2HZ LYS L 190 -44.721 -6.530 -32.797 1.00 0.00 H
+ATOM 6117 3HZ LYS L 190 -45.018 -7.961 -33.561 1.00 0.00 H
+ATOM 6118 N VAL L 191 -42.970 -6.741 -39.888 1.00138.15 N
+ATOM 6119 CA VAL L 191 -42.362 -7.975 -40.378 1.00130.81 C
+ATOM 6120 C VAL L 191 -42.183 -7.894 -41.887 1.00128.39 C
+ATOM 6121 O VAL L 191 -43.067 -7.413 -42.608 1.00128.27 O
+ATOM 6122 CB VAL L 191 -43.236 -9.193 -40.024 1.00128.43 C
+ATOM 6123 CG1 VAL L 191 -42.650 -10.462 -40.625 1.00 0.00 C
+ATOM 6124 CG2 VAL L 191 -43.361 -9.319 -38.513 1.00 0.00 C
+ATOM 6125 H VAL L 191 -43.974 -6.638 -39.927 1.00 0.00 H
+ATOM 6126 HA VAL L 191 -41.378 -8.081 -39.921 1.00 0.00 H
+ATOM 6127 HB VAL L 191 -44.225 -9.058 -40.462 1.00 0.00 H
+ATOM 6128 1HG1 VAL L 191 -43.280 -11.312 -40.365 1.00 0.00 H
+ATOM 6129 2HG1 VAL L 191 -42.603 -10.363 -41.709 1.00 0.00 H
+ATOM 6130 3HG1 VAL L 191 -41.646 -10.621 -40.230 1.00 0.00 H
+ATOM 6131 1HG2 VAL L 191 -43.981 -10.181 -38.271 1.00 0.00 H
+ATOM 6132 2HG2 VAL L 191 -42.371 -9.448 -38.076 1.00 0.00 H
+ATOM 6133 3HG2 VAL L 191 -43.821 -8.416 -38.110 1.00 0.00 H
+ATOM 6134 N TYR L 192 -41.035 -8.373 -42.367 1.00124.78 N
+ATOM 6135 CA TYR L 192 -40.729 -8.430 -43.791 1.00113.16 C
+ATOM 6136 C TYR L 192 -40.342 -9.857 -44.148 1.00108.41 C
+ATOM 6137 O TYR L 192 -39.433 -10.428 -43.537 1.00113.82 O
+ATOM 6138 CB TYR L 192 -39.605 -7.452 -44.157 1.00107.27 C
+ATOM 6139 CG TYR L 192 -40.018 -5.997 -44.081 1.00112.72 C
+ATOM 6140 CD1 TYR L 192 -40.080 -5.336 -42.862 1.00121.07 C
+ATOM 6141 CD2 TYR L 192 -40.344 -5.285 -45.228 1.00111.92 C
+ATOM 6142 CE1 TYR L 192 -40.460 -4.009 -42.786 1.00125.92 C
+ATOM 6143 CE2 TYR L 192 -40.724 -3.956 -45.161 1.00118.27 C
+ATOM 6144 CZ TYR L 192 -40.781 -3.323 -43.938 1.00123.45 C
+ATOM 6145 OH TYR L 192 -41.158 -2.001 -43.863 1.00125.33 O
+ATOM 6146 H TYR L 192 -40.352 -8.710 -41.703 1.00 0.00 H
+ATOM 6147 HA TYR L 192 -41.623 -8.148 -44.348 1.00 0.00 H
+ATOM 6148 1HB TYR L 192 -38.758 -7.603 -43.486 1.00 0.00 H
+ATOM 6149 2HB TYR L 192 -39.260 -7.657 -45.170 1.00 0.00 H
+ATOM 6150 HD1 TYR L 192 -39.827 -5.864 -41.942 1.00 0.00 H
+ATOM 6151 HD2 TYR L 192 -40.304 -5.773 -46.202 1.00 0.00 H
+ATOM 6152 HE1 TYR L 192 -40.502 -3.509 -41.819 1.00 0.00 H
+ATOM 6153 HE2 TYR L 192 -40.977 -3.415 -46.073 1.00 0.00 H
+ATOM 6154 HH TYR L 192 -41.346 -1.672 -44.746 1.00 0.00 H
+ATOM 6155 N ALA L 193 -41.031 -10.429 -45.133 1.00102.07 N
+ATOM 6156 CA ALA L 193 -40.932 -11.847 -45.441 1.00121.12 C
+ATOM 6157 C ALA L 193 -40.743 -12.066 -46.934 1.00129.80 C
+ATOM 6158 O ALA L 193 -41.252 -11.309 -47.767 1.00132.48 O
+ATOM 6159 CB ALA L 193 -42.177 -12.611 -44.973 1.00107.00 C
+ATOM 6160 H ALA L 193 -41.646 -9.848 -45.685 1.00 0.00 H
+ATOM 6161 HA ALA L 193 -40.065 -12.248 -44.916 1.00 0.00 H
+ATOM 6162 1HB ALA L 193 -42.069 -13.667 -45.219 1.00 0.00 H
+ATOM 6163 2HB ALA L 193 -42.289 -12.499 -43.894 1.00 0.00 H
+ATOM 6164 3HB ALA L 193 -43.058 -12.211 -45.472 1.00 0.00 H
+ATOM 6165 N CYS L 194 -40.020 -13.135 -47.255 1.00133.23 N
+ATOM 6166 CA CYS L 194 -39.717 -13.529 -48.623 1.00135.27 C
+ATOM 6167 C CYS L 194 -40.188 -14.963 -48.817 1.00133.44 C
+ATOM 6168 O CYS L 194 -39.726 -15.869 -48.112 1.00130.28 O
+ATOM 6169 CB CYS L 194 -38.216 -13.396 -48.898 1.00141.07 C
+ATOM 6170 SG CYS L 194 -37.648 -14.069 -50.472 1.00150.31 S
+ATOM 6171 H CYS L 194 -39.668 -13.696 -46.492 1.00 0.00 H
+ATOM 6172 HA CYS L 194 -40.256 -12.867 -49.301 1.00 0.00 H
+ATOM 6173 1HB CYS L 194 -37.934 -12.343 -48.877 1.00 0.00 H
+ATOM 6174 2HB CYS L 194 -37.656 -13.900 -48.111 1.00 0.00 H
+ATOM 6175 N GLU L 195 -41.116 -15.165 -49.753 1.00134.89 N
+ATOM 6176 CA GLU L 195 -41.671 -16.485 -50.031 1.00138.22 C
+ATOM 6177 C GLU L 195 -41.078 -17.047 -51.319 1.00133.21 C
+ATOM 6178 O GLU L 195 -41.006 -16.346 -52.336 1.00135.04 O
+ATOM 6179 CB GLU L 195 -43.196 -16.436 -50.130 1.00145.35 C
+ATOM 6180 CG GLU L 195 -43.839 -17.818 -50.150 1.00154.14 C
+ATOM 6181 CD GLU L 195 -45.346 -17.772 -50.314 1.00162.00 C
+ATOM 6182 OE1 GLU L 195 -45.842 -16.875 -51.025 1.00165.49 O
+ATOM 6183 OE2 GLU L 195 -46.033 -18.644 -49.738 1.00163.82 O
+ATOM 6184 H GLU L 195 -41.443 -14.372 -50.286 1.00 0.00 H
+ATOM 6185 HA GLU L 195 -41.403 -17.153 -49.211 1.00 0.00 H
+ATOM 6186 1HB GLU L 195 -43.598 -15.879 -49.284 1.00 0.00 H
+ATOM 6187 2HB GLU L 195 -43.485 -15.906 -51.038 1.00 0.00 H
+ATOM 6188 1HG GLU L 195 -43.415 -18.393 -50.973 1.00 0.00 H
+ATOM 6189 2HG GLU L 195 -43.597 -18.333 -49.221 1.00 0.00 H
+ATOM 6190 N VAL L 196 -40.677 -18.318 -51.270 1.00125.10 N
+ATOM 6191 CA VAL L 196 -39.963 -18.988 -52.352 1.00114.45 C
+ATOM 6192 C VAL L 196 -40.690 -20.284 -52.691 1.00111.70 C
+ATOM 6193 O VAL L 196 -40.879 -21.143 -51.820 1.00106.97 O
+ATOM 6194 CB VAL L 196 -38.498 -19.277 -51.976 1.00105.75 C
+ATOM 6195 CG1 VAL L 196 -37.898 -20.316 -52.912 1.00108.54 C
+ATOM 6196 CG2 VAL L 196 -37.678 -17.997 -52.002 1.00 92.66 C
+ATOM 6197 H VAL L 196 -40.888 -18.833 -50.427 1.00 0.00 H
+ATOM 6198 HA VAL L 196 -39.965 -18.334 -53.225 1.00 0.00 H
+ATOM 6199 HB VAL L 196 -38.467 -19.702 -50.973 1.00 0.00 H
+ATOM 6200 1HG1 VAL L 196 -36.862 -20.506 -52.629 1.00 0.00 H
+ATOM 6201 2HG1 VAL L 196 -38.469 -21.242 -52.841 1.00 0.00 H
+ATOM 6202 3HG1 VAL L 196 -37.931 -19.945 -53.936 1.00 0.00 H
+ATOM 6203 1HG2 VAL L 196 -36.646 -18.221 -51.733 1.00 0.00 H
+ATOM 6204 2HG2 VAL L 196 -37.707 -17.566 -53.003 1.00 0.00 H
+ATOM 6205 3HG2 VAL L 196 -38.092 -17.285 -51.288 1.00 0.00 H
+ATOM 6206 N THR L 197 -41.089 -20.424 -53.954 1.00116.15 N
+ATOM 6207 CA THR L 197 -41.689 -21.642 -54.483 1.00120.51 C
+ATOM 6208 C THR L 197 -40.754 -22.227 -55.532 1.00108.57 C
+ATOM 6209 O THR L 197 -40.286 -21.507 -56.421 1.00106.54 O
+ATOM 6210 CB THR L 197 -43.068 -21.364 -55.093 1.00128.96 C
+ATOM 6211 OG1 THR L 197 -43.959 -20.888 -54.077 1.00135.94 O
+ATOM 6212 CG2 THR L 197 -43.646 -22.628 -55.710 1.00134.19 C
+ATOM 6213 H THR L 197 -40.962 -19.632 -54.567 1.00 0.00 H
+ATOM 6214 HA THR L 197 -41.815 -22.350 -53.663 1.00 0.00 H
+ATOM 6215 HB THR L 197 -42.977 -20.600 -55.865 1.00 0.00 H
+ATOM 6216 HG1 THR L 197 -43.494 -20.848 -53.238 1.00 0.00 H
+ATOM 6217 1HG2 THR L 197 -44.624 -22.410 -56.138 1.00 0.00 H
+ATOM 6218 2HG2 THR L 197 -42.979 -22.988 -56.493 1.00 0.00 H
+ATOM 6219 3HG2 THR L 197 -43.749 -23.393 -54.942 1.00 0.00 H
+ATOM 6220 N HIS L 198 -40.483 -23.527 -55.426 1.00103.17 N
+ATOM 6221 CA HIS L 198 -39.532 -24.184 -56.309 1.00100.90 C
+ATOM 6222 C HIS L 198 -39.905 -25.652 -56.448 1.00109.73 C
+ATOM 6223 O HIS L 198 -40.527 -26.236 -55.557 1.00109.30 O
+ATOM 6224 CB HIS L 198 -38.098 -24.041 -55.786 1.00102.06 C
+ATOM 6225 CG HIS L 198 -37.052 -24.502 -56.751 1.00100.05 C
+ATOM 6226 ND1 HIS L 198 -36.265 -25.609 -56.521 1.00 94.97 N
+ATOM 6227 CD2 HIS L 198 -36.665 -24.009 -57.952 1.00102.08 C
+ATOM 6228 CE1 HIS L 198 -35.437 -25.778 -57.537 1.00 93.38 C
+ATOM 6229 NE2 HIS L 198 -35.660 -24.820 -58.419 1.00 91.00 N
+ATOM 6230 H HIS L 198 -40.950 -24.070 -54.714 1.00 0.00 H
+ATOM 6231 HA HIS L 198 -39.573 -23.723 -57.296 1.00 0.00 H
+ATOM 6232 1HB HIS L 198 -37.901 -22.996 -55.546 1.00 0.00 H
+ATOM 6233 2HB HIS L 198 -37.987 -24.615 -54.866 1.00 0.00 H
+ATOM 6234 HD2 HIS L 198 -37.074 -23.132 -58.454 1.00 0.00 H
+ATOM 6235 HE1 HIS L 198 -34.697 -26.572 -57.631 1.00 0.00 H
+ATOM 6236 HE2 HIS L 198 -35.173 -24.699 -59.296 1.00 0.00 H
+ATOM 6237 N GLN L 199 -39.512 -26.246 -57.578 1.00124.78 N
+ATOM 6238 CA GLN L 199 -39.844 -27.639 -57.859 1.00141.45 C
+ATOM 6239 C GLN L 199 -39.088 -28.621 -56.974 1.00148.76 C
+ATOM 6240 O GLN L 199 -39.350 -29.826 -57.055 1.00159.44 O
+ATOM 6241 CB GLN L 199 -39.564 -27.958 -59.330 1.00137.45 C
+ATOM 6242 CG GLN L 199 -40.428 -27.182 -60.310 1.00 0.00 C
+ATOM 6243 CD GLN L 199 -41.901 -27.519 -60.176 1.00 0.00 C
+ATOM 6244 OE1 GLN L 199 -42.297 -28.684 -60.271 1.00 0.00 O
+ATOM 6245 NE2 GLN L 199 -42.722 -26.500 -59.953 1.00 0.00 N
+ATOM 6246 H GLN L 199 -38.974 -25.723 -58.254 1.00 0.00 H
+ATOM 6247 HA GLN L 199 -40.904 -27.789 -57.657 1.00 0.00 H
+ATOM 6248 1HB GLN L 199 -38.520 -27.741 -59.557 1.00 0.00 H
+ATOM 6249 2HB GLN L 199 -39.724 -29.021 -59.509 1.00 0.00 H
+ATOM 6250 1HG GLN L 199 -40.303 -26.116 -60.124 1.00 0.00 H
+ATOM 6251 2HG GLN L 199 -40.113 -27.424 -61.326 1.00 0.00 H
+ATOM 6252 1HE2 GLN L 199 -43.705 -26.661 -59.855 1.00 0.00 H
+ATOM 6253 2HE2 GLN L 199 -42.359 -25.571 -59.883 1.00 0.00 H
+ATOM 6254 N GLY L 200 -38.169 -28.144 -56.138 1.00133.61 N
+ATOM 6255 CA GLY L 200 -37.410 -29.013 -55.262 1.00123.38 C
+ATOM 6256 C GLY L 200 -37.700 -28.783 -53.793 1.00118.80 C
+ATOM 6257 O GLY L 200 -36.949 -29.239 -52.926 1.00110.35 O
+ATOM 6258 H GLY L 200 -37.997 -27.149 -56.114 1.00 0.00 H
+ATOM 6259 1HA GLY L 200 -37.630 -30.053 -55.502 1.00 0.00 H
+ATOM 6260 2HA GLY L 200 -36.345 -28.862 -55.434 1.00 0.00 H
+ATOM 6261 N LEU L 201 -38.787 -28.072 -53.500 1.00115.80 N
+ATOM 6262 CA LEU L 201 -39.217 -27.803 -52.135 1.00120.43 C
+ATOM 6263 C LEU L 201 -40.596 -28.411 -51.917 1.00129.97 C
+ATOM 6264 O LEU L 201 -41.491 -28.242 -52.751 1.00138.27 O
+ATOM 6265 CB LEU L 201 -39.253 -26.294 -51.864 1.00120.26 C
+ATOM 6266 CG LEU L 201 -37.915 -25.559 -52.012 1.00103.72 C
+ATOM 6267 CD1 LEU L 201 -38.135 -24.062 -51.835 1.00 0.00 C
+ATOM 6268 CD2 LEU L 201 -36.927 -26.092 -50.985 1.00 0.00 C
+ATOM 6269 H LEU L 201 -39.331 -27.707 -54.268 1.00 0.00 H
+ATOM 6270 HA LEU L 201 -38.506 -28.266 -51.451 1.00 0.00 H
+ATOM 6271 1HB LEU L 201 -39.961 -25.834 -52.551 1.00 0.00 H
+ATOM 6272 2HB LEU L 201 -39.609 -26.132 -50.846 1.00 0.00 H
+ATOM 6273 HG LEU L 201 -37.520 -25.721 -53.015 1.00 0.00 H
+ATOM 6274 1HD1 LEU L 201 -37.184 -23.540 -51.940 1.00 0.00 H
+ATOM 6275 2HD1 LEU L 201 -38.830 -23.704 -52.594 1.00 0.00 H
+ATOM 6276 3HD1 LEU L 201 -38.546 -23.870 -50.845 1.00 0.00 H
+ATOM 6277 1HD2 LEU L 201 -35.975 -25.570 -51.091 1.00 0.00 H
+ATOM 6278 2HD2 LEU L 201 -37.320 -25.928 -49.982 1.00 0.00 H
+ATOM 6279 3HD2 LEU L 201 -36.775 -27.159 -51.146 1.00 0.00 H
+ATOM 6280 N SER L 202 -40.763 -29.120 -50.798 1.00133.31 N
+ATOM 6281 CA SER L 202 -42.046 -29.752 -50.509 1.00142.25 C
+ATOM 6282 C SER L 202 -43.132 -28.724 -50.217 1.00148.53 C
+ATOM 6283 O SER L 202 -44.309 -28.969 -50.508 1.00149.71 O
+ATOM 6284 CB SER L 202 -41.899 -30.717 -49.333 1.00150.74 C
+ATOM 6285 OG SER L 202 -41.448 -30.037 -48.175 1.00155.95 O
+ATOM 6286 H SER L 202 -40.003 -29.226 -50.141 1.00 0.00 H
+ATOM 6287 HA SER L 202 -42.361 -30.314 -51.390 1.00 0.00 H
+ATOM 6288 1HB SER L 202 -42.859 -31.192 -49.130 1.00 0.00 H
+ATOM 6289 2HB SER L 202 -41.193 -31.504 -49.595 1.00 0.00 H
+ATOM 6290 HG SER L 202 -41.347 -29.117 -48.431 1.00 0.00 H
+ATOM 6291 N SER L 203 -42.763 -27.580 -49.647 1.00151.61 N
+ATOM 6292 CA SER L 203 -43.690 -26.507 -49.322 1.00153.78 C
+ATOM 6293 C SER L 203 -43.004 -25.172 -49.565 1.00152.85 C
+ATOM 6294 O SER L 203 -41.775 -25.078 -49.463 1.00153.01 O
+ATOM 6295 CB SER L 203 -44.149 -26.611 -47.881 1.00154.43 C
+ATOM 6296 OG SER L 203 -43.078 -26.418 -46.998 1.00 0.00 O
+ATOM 6297 H SER L 203 -41.782 -27.464 -49.434 1.00 0.00 H
+ATOM 6298 HA SER L 203 -44.565 -26.599 -49.966 1.00 0.00 H
+ATOM 6299 1HB SER L 203 -44.920 -25.865 -47.690 1.00 0.00 H
+ATOM 6300 2HB SER L 203 -44.592 -27.591 -47.710 1.00 0.00 H
+ATOM 6301 HG SER L 203 -42.306 -26.266 -47.547 1.00 0.00 H
+ATOM 6302 N PRO L 204 -43.766 -24.131 -49.903 1.00153.24 N
+ATOM 6303 CA PRO L 204 -43.161 -22.806 -50.126 1.00147.32 C
+ATOM 6304 C PRO L 204 -42.406 -22.321 -48.898 1.00141.74 C
+ATOM 6305 O PRO L 204 -42.982 -22.134 -47.823 1.00140.44 O
+ATOM 6306 CB PRO L 204 -44.371 -21.918 -50.438 1.00152.01 C
+ATOM 6307 CG PRO L 204 -45.385 -22.858 -50.999 1.00158.36 C
+ATOM 6308 CD PRO L 204 -45.199 -24.148 -50.247 1.00160.15 C
+ATOM 6309 HA PRO L 204 -42.481 -22.860 -50.989 1.00 0.00 H
+ATOM 6310 1HB PRO L 204 -44.716 -21.417 -49.522 1.00 0.00 H
+ATOM 6311 2HB PRO L 204 -44.085 -21.128 -51.148 1.00 0.00 H
+ATOM 6312 1HG PRO L 204 -46.397 -22.446 -50.870 1.00 0.00 H
+ATOM 6313 2HG PRO L 204 -45.229 -22.984 -52.081 1.00 0.00 H
+ATOM 6314 1HD PRO L 204 -45.833 -24.144 -49.348 1.00 0.00 H
+ATOM 6315 2HD PRO L 204 -45.458 -24.994 -50.900 1.00 0.00 H
+ATOM 6316 N VAL L 205 -41.104 -22.112 -49.068 1.00137.80 N
+ATOM 6317 CA VAL L 205 -40.219 -21.745 -47.967 1.00134.43 C
+ATOM 6318 C VAL L 205 -40.264 -20.234 -47.781 1.00133.46 C
+ATOM 6319 O VAL L 205 -39.981 -19.477 -48.715 1.00131.06 O
+ATOM 6320 CB VAL L 205 -38.783 -22.223 -48.226 1.00128.81 C
+ATOM 6321 CG1 VAL L 205 -37.840 -21.671 -47.169 1.00119.49 C
+ATOM 6322 CG2 VAL L 205 -38.728 -23.743 -48.253 1.00137.45 C
+ATOM 6323 H VAL L 205 -40.719 -22.213 -49.996 1.00 0.00 H
+ATOM 6324 HA VAL L 205 -40.581 -22.225 -47.057 1.00 0.00 H
+ATOM 6325 HB VAL L 205 -38.448 -21.833 -49.187 1.00 0.00 H
+ATOM 6326 1HG1 VAL L 205 -36.826 -22.019 -47.368 1.00 0.00 H
+ATOM 6327 2HG1 VAL L 205 -37.861 -20.582 -47.196 1.00 0.00 H
+ATOM 6328 3HG1 VAL L 205 -38.155 -22.016 -46.185 1.00 0.00 H
+ATOM 6329 1HG2 VAL L 205 -37.704 -24.067 -48.438 1.00 0.00 H
+ATOM 6330 2HG2 VAL L 205 -39.066 -24.136 -47.294 1.00 0.00 H
+ATOM 6331 3HG2 VAL L 205 -39.376 -24.117 -49.047 1.00 0.00 H
+ATOM 6332 N THR L 206 -40.608 -19.796 -46.573 1.00134.92 N
+ATOM 6333 CA THR L 206 -40.707 -18.381 -46.239 1.00124.66 C
+ATOM 6334 C THR L 206 -39.619 -18.018 -45.238 1.00114.66 C
+ATOM 6335 O THR L 206 -39.414 -18.735 -44.253 1.00121.03 O
+ATOM 6336 CB THR L 206 -42.087 -18.052 -45.663 1.00125.87 C
+ATOM 6337 OG1 THR L 206 -43.107 -18.563 -46.531 1.00129.46 O
+ATOM 6338 CG2 THR L 206 -42.261 -16.548 -45.521 1.00122.11 C
+ATOM 6339 H THR L 206 -40.808 -20.485 -45.862 1.00 0.00 H
+ATOM 6340 HA THR L 206 -40.566 -17.800 -47.150 1.00 0.00 H
+ATOM 6341 HB THR L 206 -42.193 -18.518 -44.684 1.00 0.00 H
+ATOM 6342 HG1 THR L 206 -42.698 -18.999 -47.282 1.00 0.00 H
+ATOM 6343 1HG2 THR L 206 -43.247 -16.333 -45.110 1.00 0.00 H
+ATOM 6344 2HG2 THR L 206 -41.495 -16.155 -44.853 1.00 0.00 H
+ATOM 6345 3HG2 THR L 206 -42.165 -16.077 -46.499 1.00 0.00 H
+ATOM 6346 N LYS L 207 -38.920 -16.912 -45.493 1.00107.07 N
+ATOM 6347 CA LYS L 207 -37.896 -16.402 -44.586 1.00108.22 C
+ATOM 6348 C LYS L 207 -38.218 -14.952 -44.257 1.00115.45 C
+ATOM 6349 O LYS L 207 -38.274 -14.108 -45.157 1.00117.18 O
+ATOM 6350 CB LYS L 207 -36.495 -16.520 -45.195 1.00102.43 C
+ATOM 6351 CG LYS L 207 -35.965 -17.944 -45.272 1.00102.50 C
+ATOM 6352 CD LYS L 207 -35.925 -18.597 -43.897 1.00107.89 C
+ATOM 6353 CE LYS L 207 -35.476 -20.052 -43.978 1.00108.53 C
+ATOM 6354 NZ LYS L 207 -34.078 -20.182 -44.476 1.00 98.77 N
+ATOM 6355 H LYS L 207 -39.112 -16.412 -46.349 1.00 0.00 H
+ATOM 6356 HA LYS L 207 -37.919 -16.994 -43.670 1.00 0.00 H
+ATOM 6357 1HB LYS L 207 -36.501 -16.109 -46.205 1.00 0.00 H
+ATOM 6358 2HB LYS L 207 -35.791 -15.931 -44.606 1.00 0.00 H
+ATOM 6359 1HG LYS L 207 -36.606 -18.536 -45.927 1.00 0.00 H
+ATOM 6360 2HG LYS L 207 -34.959 -17.935 -45.689 1.00 0.00 H
+ATOM 6361 1HD LYS L 207 -35.234 -18.050 -43.254 1.00 0.00 H
+ATOM 6362 2HD LYS L 207 -36.917 -18.561 -43.448 1.00 0.00 H
+ATOM 6363 1HE LYS L 207 -35.539 -20.507 -42.991 1.00 0.00 H
+ATOM 6364 2HE LYS L 207 -36.137 -20.600 -44.649 1.00 0.00 H
+ATOM 6365 1HZ LYS L 207 -33.823 -21.159 -44.514 1.00 0.00 H
+ATOM 6366 2HZ LYS L 207 -34.011 -19.780 -45.401 1.00 0.00 H
+ATOM 6367 3HZ LYS L 207 -33.451 -19.695 -43.852 1.00 0.00 H
+ATOM 6368 N SER L 208 -38.420 -14.664 -42.972 1.00122.01 N
+ATOM 6369 CA SER L 208 -38.892 -13.362 -42.525 1.00113.97 C
+ATOM 6370 C SER L 208 -37.991 -12.818 -41.426 1.00109.68 C
+ATOM 6371 O SER L 208 -37.216 -13.549 -40.805 1.00109.11 O
+ATOM 6372 CB SER L 208 -40.320 -13.463 -42.024 1.00113.69 C
+ATOM 6373 OG SER L 208 -40.396 -14.276 -40.885 1.00 0.00 O
+ATOM 6374 H SER L 208 -38.236 -15.383 -42.286 1.00 0.00 H
+ATOM 6375 HA SER L 208 -38.868 -12.675 -43.372 1.00 0.00 H
+ATOM 6376 1HB SER L 208 -40.694 -12.467 -41.789 1.00 0.00 H
+ATOM 6377 2HB SER L 208 -40.953 -13.873 -42.810 1.00 0.00 H
+ATOM 6378 HG SER L 208 -40.118 -13.726 -40.149 1.00 0.00 H
+ATOM 6379 N PHE L 209 -38.111 -11.512 -41.194 1.00116.05 N
+ATOM 6380 CA PHE L 209 -37.411 -10.852 -40.103 1.00127.68 C
+ATOM 6381 C PHE L 209 -38.261 -9.692 -39.608 1.00138.04 C
+ATOM 6382 O PHE L 209 -39.119 -9.174 -40.328 1.00141.99 O
+ATOM 6383 CB PHE L 209 -36.015 -10.364 -40.526 1.00119.40 C
+ATOM 6384 CG PHE L 209 -36.030 -9.164 -41.440 1.00113.49 C
+ATOM 6385 CD1 PHE L 209 -35.969 -7.878 -40.925 1.00111.14 C
+ATOM 6386 CD2 PHE L 209 -36.077 -9.323 -42.815 1.00113.94 C
+ATOM 6387 CE1 PHE L 209 -35.978 -6.778 -41.761 1.00108.38 C
+ATOM 6388 CE2 PHE L 209 -36.082 -8.224 -43.657 1.00104.86 C
+ATOM 6389 CZ PHE L 209 -36.033 -6.951 -43.129 1.00101.55 C
+ATOM 6390 H PHE L 209 -38.708 -10.965 -41.797 1.00 0.00 H
+ATOM 6391 HA PHE L 209 -37.284 -11.568 -39.290 1.00 0.00 H
+ATOM 6392 1HB PHE L 209 -35.437 -10.105 -39.640 1.00 0.00 H
+ATOM 6393 2HB PHE L 209 -35.488 -11.169 -41.037 1.00 0.00 H
+ATOM 6394 HD1 PHE L 209 -35.913 -7.739 -39.845 1.00 0.00 H
+ATOM 6395 HD2 PHE L 209 -36.116 -10.330 -43.233 1.00 0.00 H
+ATOM 6396 HE1 PHE L 209 -35.941 -5.774 -41.340 1.00 0.00 H
+ATOM 6397 HE2 PHE L 209 -36.125 -8.364 -44.737 1.00 0.00 H
+ATOM 6398 HZ PHE L 209 -36.039 -6.085 -43.789 1.00 0.00 H
+ATOM 6399 N ASN L 210 -38.016 -9.292 -38.364 1.00136.62 N
+ATOM 6400 CA ASN L 210 -38.659 -8.125 -37.779 1.00136.15 C
+ATOM 6401 C ASN L 210 -37.763 -6.905 -37.948 1.00126.38 C
+ATOM 6402 O ASN L 210 -36.535 -7.014 -37.967 1.00124.87 O
+ATOM 6403 CB ASN L 210 -38.971 -8.353 -36.300 1.00146.87 C
+ATOM 6404 CG ASN L 210 -39.886 -9.540 -36.075 1.00151.86 C
+ATOM 6405 OD1 ASN L 210 -40.644 -9.933 -36.963 1.00145.90 O
+ATOM 6406 ND2 ASN L 210 -39.825 -10.116 -34.879 1.00157.37 N
+ATOM 6407 H ASN L 210 -37.359 -9.821 -37.809 1.00 0.00 H
+ATOM 6408 HA ASN L 210 -39.598 -7.947 -38.305 1.00 0.00 H
+ATOM 6409 1HB ASN L 210 -38.042 -8.516 -35.753 1.00 0.00 H
+ATOM 6410 2HB ASN L 210 -39.443 -7.462 -35.886 1.00 0.00 H
+ATOM 6411 1HD2 ASN L 210 -40.406 -10.904 -34.673 1.00 0.00 H
+ATOM 6412 2HD2 ASN L 210 -39.199 -9.762 -34.185 1.00 0.00 H
+ATOM 6413 N ARG L 211 -38.397 -5.732 -38.057 1.00123.36 N
+ATOM 6414 CA ARG L 211 -37.672 -4.529 -38.458 1.00131.39 C
+ATOM 6415 C ARG L 211 -36.588 -4.146 -37.456 1.00140.21 C
+ATOM 6416 O ARG L 211 -35.528 -3.646 -37.852 1.00143.53 O
+ATOM 6417 CB ARG L 211 -38.647 -3.367 -38.651 1.00133.39 C
+ATOM 6418 CG ARG L 211 -37.990 -2.096 -39.163 1.00133.36 C
+ATOM 6419 CD ARG L 211 -38.980 -1.221 -39.913 1.00134.96 C
+ATOM 6420 NE ARG L 211 -40.093 -0.801 -39.070 1.00143.24 N
+ATOM 6421 CZ ARG L 211 -40.078 0.293 -38.317 1.00146.53 C
+ATOM 6422 NH1 ARG L 211 -39.009 1.080 -38.318 1.00141.01 N
+ATOM 6423 NH2 ARG L 211 -41.131 0.609 -37.576 1.00155.83 N
+ATOM 6424 H ARG L 211 -39.386 -5.668 -37.862 1.00 0.00 H
+ATOM 6425 HA ARG L 211 -37.169 -4.727 -39.405 1.00 0.00 H
+ATOM 6426 1HB ARG L 211 -39.423 -3.657 -39.357 1.00 0.00 H
+ATOM 6427 2HB ARG L 211 -39.135 -3.140 -37.703 1.00 0.00 H
+ATOM 6428 1HG ARG L 211 -37.595 -1.526 -38.322 1.00 0.00 H
+ATOM 6429 2HG ARG L 211 -37.176 -2.355 -39.841 1.00 0.00 H
+ATOM 6430 1HD ARG L 211 -38.474 -0.327 -40.275 1.00 0.00 H
+ATOM 6431 2HD ARG L 211 -39.387 -1.774 -40.759 1.00 0.00 H
+ATOM 6432 HE ARG L 211 -40.922 -1.381 -39.062 1.00 0.00 H
+ATOM 6433 1HH1 ARG L 211 -38.210 0.846 -38.890 1.00 0.00 H
+ATOM 6434 2HH1 ARG L 211 -38.994 1.912 -37.747 1.00 0.00 H
+ATOM 6435 1HH2 ARG L 211 -41.950 0.016 -37.583 1.00 0.00 H
+ATOM 6436 2HH2 ARG L 211 -41.115 1.441 -37.005 1.00 0.00 H
+ATOM 6437 N GLY L 212 -36.821 -4.375 -36.166 1.00140.72 N
+ATOM 6438 CA GLY L 212 -35.850 -3.981 -35.163 1.00145.23 C
+ATOM 6439 C GLY L 212 -35.274 -5.117 -34.341 1.00150.81 C
+ATOM 6440 O GLY L 212 -34.236 -4.951 -33.693 1.00148.76 O
+ATOM 6441 H GLY L 212 -37.676 -4.825 -35.873 1.00 0.00 H
+ATOM 6442 1HA GLY L 212 -35.018 -3.467 -35.644 1.00 0.00 H
+ATOM 6443 2HA GLY L 212 -36.307 -3.274 -34.472 1.00 0.00 H
+ATOM 6444 N GLU L 213 -35.933 -6.272 -34.356 1.00156.37 N
+ATOM 6445 CA GLU L 213 -35.519 -7.405 -33.534 1.00158.88 C
+ATOM 6446 C GLU L 213 -34.137 -7.926 -33.924 1.00155.54 C
+ATOM 6447 O GLU L 213 -33.670 -7.709 -35.042 1.00153.74 O
+ATOM 6448 OXT GLU L 213 -33.489 -8.557 -33.135 1.00 0.00 O
+ATOM 6449 CB GLU L 213 -36.545 -8.536 -33.643 1.00159.74 C
+ATOM 6450 CG GLU L 213 -36.258 -9.733 -32.747 1.00 0.00 C
+ATOM 6451 CD GLU L 213 -37.303 -10.808 -32.856 1.00 0.00 C
+ATOM 6452 OE1 GLU L 213 -38.445 -10.531 -32.576 1.00 0.00 O
+ATOM 6453 OE2 GLU L 213 -36.959 -11.908 -33.219 1.00 0.00 O
+ATOM 6454 H GLU L 213 -36.742 -6.367 -34.953 1.00 0.00 H
+ATOM 6455 HA GLU L 213 -35.457 -7.075 -32.496 1.00 0.00 H
+ATOM 6456 1HB GLU L 213 -37.534 -8.156 -33.387 1.00 0.00 H
+ATOM 6457 2HB GLU L 213 -36.587 -8.891 -34.672 1.00 0.00 H
+ATOM 6458 1HG GLU L 213 -35.291 -10.154 -33.020 1.00 0.00 H
+ATOM 6459 2HG GLU L 213 -36.198 -9.394 -31.714 1.00 0.00 H
+TER
+HETATM 6461 O HOH L 301 -26.470 -14.621 -76.900 1.00 84.90 O
+HETATM 6462 H1 HOH L 301 -26.158 -14.443 -76.013 1.00 0.00 H
+HETATM 6463 H2 HOH L 301 -26.200 -15.523 -77.072 1.00 0.00 H
+HETATM 6464 O HOH L 302 -32.578 -26.252 -49.110 1.00 78.45 O
+HETATM 6465 H1 HOH L 302 -32.087 -25.862 -48.386 1.00 0.00 H
+HETATM 6466 H2 HOH L 302 -33.469 -26.345 -48.773 1.00 0.00 H
+HETATM 6467 O HOH L 303 -40.328 -23.055 -77.463 1.00 88.15 O
+HETATM 6468 H1 HOH L 303 -39.897 -22.810 -76.644 1.00 0.00 H
+HETATM 6469 H2 HOH L 303 -39.974 -22.446 -78.112 1.00 0.00 H
+HETATM 6470 O HOH L 304 -40.173 -27.752 -46.798 1.00 80.84 O
+HETATM 6471 H1 HOH L 304 -39.599 -27.359 -46.141 1.00 0.00 H
+HETATM 6472 H2 HOH L 304 -40.645 -28.438 -46.325 1.00 0.00 H
+HETATM 6473 O HOH L 305 -33.127 -22.770 -43.353 1.00 73.62 O
+HETATM 6474 H1 HOH L 305 -32.592 -22.405 -42.648 1.00 0.00 H
+HETATM 6475 H2 HOH L 305 -33.045 -22.138 -44.068 1.00 0.00 H
+HETATM 6476 O HOH L 306 -29.141 -7.846 -58.166 1.00 69.24 O
+HETATM 6477 H1 HOH L 306 -28.708 -7.731 -57.320 1.00 0.00 H
+HETATM 6478 H2 HOH L 306 -29.194 -6.963 -58.531 1.00 0.00 H
+HETATM 6479 O HOH L 307 -32.666 -16.326 -76.563 1.00 80.28 O
+HETATM 6480 H1 HOH L 307 -32.293 -16.136 -75.702 1.00 0.00 H
+HETATM 6481 H2 HOH L 307 -33.605 -16.417 -76.403 1.00 0.00 H
+HETATM 6482 O HOH L 308 -15.611 -14.878 -84.021 1.00 56.54 O
+HETATM 6483 H1 HOH L 308 -15.439 -14.712 -83.094 1.00 0.00 H
+HETATM 6484 H2 HOH L 308 -15.687 -14.007 -84.411 1.00 0.00 H
+HETATM 6485 O HOH L 309 -39.765 -18.235-102.020 1.00 81.97 O
+HETATM 6486 H1 HOH L 309 -39.423 -18.078-101.140 1.00 0.00 H
+HETATM 6487 H2 HOH L 309 -39.242 -17.667-102.586 1.00 0.00 H
+HETATM 6488 O HOH L 310 -17.465 -26.167 -79.936 1.00 51.79 O
+HETATM 6489 H1 HOH L 310 -17.270 -25.874 -79.046 1.00 0.00 H
+HETATM 6490 H2 HOH L 310 -16.611 -26.211 -80.366 1.00 0.00 H
+HETATM 6491 O HOH L 311 -19.067 -9.289 -75.113 1.00 63.58 O
+HETATM 6492 H1 HOH L 311 -18.829 -9.168 -74.194 1.00 0.00 H
+HETATM 6493 H2 HOH L 311 -19.811 -8.702 -75.247 1.00 0.00 H
+HETATM 6494 O HOH L 312 -12.672 -21.666 -79.707 1.00 70.83 O
+HETATM 6495 H1 HOH L 312 -12.522 -21.419 -78.794 1.00 0.00 H
+HETATM 6496 H2 HOH L 312 -13.452 -21.174 -79.964 1.00 0.00 H
+HETATM 6497 O HOH L 313 -25.011 -14.880 -74.770 1.00 73.09 O
+HETATM 6498 H1 HOH L 313 -24.714 -14.698 -73.878 1.00 0.00 H
+HETATM 6499 H2 HOH L 313 -24.210 -15.083 -75.253 1.00 0.00 H
+TER
+ATOM 6501 N LYS M 40 -39.784 -32.677-149.001 1.00154.19 N
+ATOM 6502 CA LYS M 40 -41.225 -32.821-148.827 1.00153.94 C
+ATOM 6503 C LYS M 40 -41.548 -34.024-147.946 1.00157.98 C
+ATOM 6504 O LYS M 40 -42.180 -34.981-148.395 1.00159.27 O
+ATOM 6505 CB LYS M 40 -41.919 -32.957-150.183 1.00147.27 C
+ATOM 6506 CG LYS M 40 -41.804 -31.728-151.075 1.00 0.00 C
+ATOM 6507 CD LYS M 40 -42.508 -31.943-152.406 1.00 0.00 C
+ATOM 6508 CE LYS M 40 -42.394 -30.716-153.298 1.00 0.00 C
+ATOM 6509 NZ LYS M 40 -43.061 -30.920-154.613 1.00 0.00 N
+ATOM 6510 1H LYS M 40 -39.595 -31.884-149.580 1.00 0.00 H
+ATOM 6511 2H LYS M 40 -39.351 -32.548-148.109 1.00 0.00 H
+ATOM 6512 3H LYS M 40 -39.416 -33.500-149.433 1.00 0.00 H
+ATOM 6513 HA LYS M 40 -41.605 -31.927-148.331 1.00 0.00 H
+ATOM 6514 1HB LYS M 40 -41.498 -33.804-150.724 1.00 0.00 H
+ATOM 6515 2HB LYS M 40 -42.979 -33.161-150.030 1.00 0.00 H
+ATOM 6516 1HG LYS M 40 -42.250 -30.870-150.572 1.00 0.00 H
+ATOM 6517 2HG LYS M 40 -40.752 -31.511-151.261 1.00 0.00 H
+ATOM 6518 1HD LYS M 40 -42.063 -32.797-152.919 1.00 0.00 H
+ATOM 6519 2HD LYS M 40 -43.562 -32.156-152.230 1.00 0.00 H
+ATOM 6520 1HE LYS M 40 -42.852 -29.862-152.801 1.00 0.00 H
+ATOM 6521 2HE LYS M 40 -41.343 -30.487-153.471 1.00 0.00 H
+ATOM 6522 1HZ LYS M 40 -42.963 -30.085-155.174 1.00 0.00 H
+ATOM 6523 2HZ LYS M 40 -42.631 -31.699-155.092 1.00 0.00 H
+ATOM 6524 3HZ LYS M 40 -44.041 -31.114-154.467 1.00 0.00 H
+ATOM 6525 N TYR M 41 -41.114 -33.967-146.687 1.00155.11 N
+ATOM 6526 CA TYR M 41 -41.270 -35.065-145.740 1.00146.53 C
+ATOM 6527 C TYR M 41 -42.037 -34.567-144.524 1.00152.32 C
+ATOM 6528 O TYR M 41 -41.602 -33.622-143.857 1.00155.84 O
+ATOM 6529 CB TYR M 41 -39.907 -35.627-145.325 1.00134.03 C
+ATOM 6530 CG TYR M 41 -39.202 -36.416-146.410 1.00134.87 C
+ATOM 6531 CD1 TYR M 41 -38.723 -35.790-147.556 1.00137.01 C
+ATOM 6532 CD2 TYR M 41 -39.012 -37.786-146.287 1.00134.42 C
+ATOM 6533 CE1 TYR M 41 -38.081 -36.507-148.550 1.00135.27 C
+ATOM 6534 CE2 TYR M 41 -38.369 -38.512-147.276 1.00131.51 C
+ATOM 6535 CZ TYR M 41 -37.907 -37.868-148.404 1.00129.85 C
+ATOM 6536 OH TYR M 41 -37.267 -38.588-149.387 1.00120.89 O
+ATOM 6537 H TYR M 41 -40.657 -33.118-146.385 1.00 0.00 H
+ATOM 6538 HA TYR M 41 -41.838 -35.860-146.223 1.00 0.00 H
+ATOM 6539 1HB TYR M 41 -39.251 -34.808-145.025 1.00 0.00 H
+ATOM 6540 2HB TYR M 41 -40.030 -36.280-144.462 1.00 0.00 H
+ATOM 6541 HD1 TYR M 41 -38.850 -34.715-147.684 1.00 0.00 H
+ATOM 6542 HD2 TYR M 41 -39.372 -38.309-145.401 1.00 0.00 H
+ATOM 6543 HE1 TYR M 41 -37.714 -35.996-149.440 1.00 0.00 H
+ATOM 6544 HE2 TYR M 41 -38.231 -39.587-147.161 1.00 0.00 H
+ATOM 6545 HH TYR M 41 -37.228 -39.513-149.131 1.00 0.00 H
+ATOM 6546 N GLN M 42 -43.173 -35.204-144.236 1.00150.74 N
+ATOM 6547 CA GLN M 42 -44.001 -34.855-143.081 1.00143.99 C
+ATOM 6548 C GLN M 42 -43.496 -35.637-141.871 1.00127.77 C
+ATOM 6549 O GLN M 42 -43.769 -36.831-141.723 1.00132.99 O
+ATOM 6550 CB GLN M 42 -45.475 -35.128-143.375 1.00151.99 C
+ATOM 6551 CG GLN M 42 -45.786 -36.523-143.922 1.00155.27 C
+ATOM 6552 CD GLN M 42 -46.503 -36.491-145.261 1.00157.28 C
+ATOM 6553 OE1 GLN M 42 -46.155 -35.714-146.150 1.00157.57 O
+ATOM 6554 NE2 GLN M 42 -47.512 -37.342-145.410 1.00156.53 N
+ATOM 6555 H GLN M 42 -43.467 -35.956-144.843 1.00 0.00 H
+ATOM 6556 HA GLN M 42 -43.879 -33.792-142.876 1.00 0.00 H
+ATOM 6557 1HB GLN M 42 -46.058 -34.999-142.463 1.00 0.00 H
+ATOM 6558 2HB GLN M 42 -45.841 -34.404-144.103 1.00 0.00 H
+ATOM 6559 1HG GLN M 42 -44.851 -37.067-144.054 1.00 0.00 H
+ATOM 6560 2HG GLN M 42 -46.425 -37.047-143.211 1.00 0.00 H
+ATOM 6561 1HE2 GLN M 42 -48.023 -37.367-146.270 1.00 0.00 H
+ATOM 6562 2HE2 GLN M 42 -47.762 -37.958-144.663 1.00 0.00 H
+ATOM 6563 N LEU M 43 -42.752 -34.962-140.999 1.00110.41 N
+ATOM 6564 CA LEU M 43 -42.116 -35.607-139.863 1.00 95.62 C
+ATOM 6565 C LEU M 43 -42.407 -34.848-138.578 1.00 91.94 C
+ATOM 6566 O LEU M 43 -42.557 -33.623-138.594 1.00 94.68 O
+ATOM 6567 CB LEU M 43 -40.597 -35.701-140.064 1.00 75.48 C
+ATOM 6568 CG LEU M 43 -40.123 -36.577-141.224 1.00 78.60 C
+ATOM 6569 CD1 LEU M 43 -38.603 -36.597-141.295 1.00 73.78 C
+ATOM 6570 CD2 LEU M 43 -40.678 -37.987-141.093 1.00 75.97 C
+ATOM 6571 H LEU M 43 -42.627 -33.969-141.134 1.00 0.00 H
+ATOM 6572 HA LEU M 43 -42.514 -36.617-139.772 1.00 0.00 H
+ATOM 6573 1HB LEU M 43 -40.206 -34.699-140.231 1.00 0.00 H
+ATOM 6574 2HB LEU M 43 -40.149 -36.096-139.152 1.00 0.00 H
+ATOM 6575 HG LEU M 43 -40.466 -36.149-142.167 1.00 0.00 H
+ATOM 6576 1HD1 LEU M 43 -38.286 -37.226-142.127 1.00 0.00 H
+ATOM 6577 2HD1 LEU M 43 -38.232 -35.583-141.446 1.00 0.00 H
+ATOM 6578 3HD1 LEU M 43 -38.201 -36.997-140.365 1.00 0.00 H
+ATOM 6579 1HD2 LEU M 43 -40.330 -38.594-141.929 1.00 0.00 H
+ATOM 6580 2HD2 LEU M 43 -40.335 -38.428-140.157 1.00 0.00 H
+ATOM 6581 3HD2 LEU M 43 -41.767 -37.951-141.100 1.00 0.00 H
+ATOM 6582 N PRO M 44 -42.498 -35.554-137.449 1.00 82.75 N
+ATOM 6583 CA PRO M 44 -42.702 -34.878-136.157 1.00 84.77 C
+ATOM 6584 C PRO M 44 -41.508 -33.996-135.820 1.00 92.10 C
+ATOM 6585 O PRO M 44 -40.380 -34.479-135.688 1.00 97.64 O
+ATOM 6586 CB PRO M 44 -42.843 -36.041-135.166 1.00 76.39 C
+ATOM 6587 CG PRO M 44 -43.206 -37.224-136.004 1.00 77.32 C
+ATOM 6588 CD PRO M 44 -42.499 -37.020-137.308 1.00 79.74 C
+ATOM 6589 HA PRO M 44 -43.629 -34.287-136.200 1.00 0.00 H
+ATOM 6590 1HB PRO M 44 -41.899 -36.187-134.621 1.00 0.00 H
+ATOM 6591 2HB PRO M 44 -43.613 -35.806-134.417 1.00 0.00 H
+ATOM 6592 1HG PRO M 44 -42.895 -38.153-135.504 1.00 0.00 H
+ATOM 6593 2HG PRO M 44 -44.297 -37.281-136.129 1.00 0.00 H
+ATOM 6594 1HD PRO M 44 -41.479 -37.426-137.240 1.00 0.00 H
+ATOM 6595 2HD PRO M 44 -43.062 -37.517-138.112 1.00 0.00 H
+ATOM 6596 N ASN M 45 -41.763 -32.696-135.675 1.00 94.75 N
+ATOM 6597 CA ASN M 45 -40.717 -31.709-135.450 1.00 92.19 C
+ATOM 6598 C ASN M 45 -41.159 -30.760-134.342 1.00102.61 C
+ATOM 6599 O ASN M 45 -42.299 -30.812-133.871 1.00107.54 O
+ATOM 6600 CB ASN M 45 -40.417 -30.926-136.734 1.00 90.20 C
+ATOM 6601 CG ASN M 45 -41.659 -30.306-137.310 1.00111.28 C
+ATOM 6602 OD1 ASN M 45 -42.162 -29.316-136.780 1.00104.49 O
+ATOM 6603 ND2 ASN M 45 -42.186 -30.886-138.382 1.00154.59 N
+ATOM 6604 H ASN M 45 -42.725 -32.391-135.725 1.00 0.00 H
+ATOM 6605 HA ASN M 45 -39.809 -32.231-135.144 1.00 0.00 H
+ATOM 6606 1HB ASN M 45 -39.689 -30.142-136.521 1.00 0.00 H
+ATOM 6607 2HB ASN M 45 -39.973 -31.594-137.472 1.00 0.00 H
+ATOM 6608 1HD2 ASN M 45 -43.013 -30.508-138.800 1.00 0.00 H
+ATOM 6609 2HD2 ASN M 45 -41.757 -31.700-138.772 1.00 0.00 H
+ATOM 6610 N PHE M 46 -40.246 -29.874-133.938 1.00104.32 N
+ATOM 6611 CA PHE M 46 -40.544 -28.848-132.942 1.00 93.85 C
+ATOM 6612 C PHE M 46 -39.518 -27.729-133.059 1.00 96.65 C
+ATOM 6613 O PHE M 46 -38.315 -27.997-133.152 1.00 91.51 O
+ATOM 6614 CB PHE M 46 -40.537 -29.434-131.524 1.00 91.00 C
+ATOM 6615 CG PHE M 46 -40.678 -28.401-130.436 1.00102.58 C
+ATOM 6616 CD1 PHE M 46 -41.927 -27.911-130.086 1.00103.69 C
+ATOM 6617 CD2 PHE M 46 -39.563 -27.916-129.768 1.00 97.93 C
+ATOM 6618 CE1 PHE M 46 -42.061 -26.962-129.088 1.00 92.10 C
+ATOM 6619 CE2 PHE M 46 -39.690 -26.966-128.774 1.00 92.04 C
+ATOM 6620 CZ PHE M 46 -40.942 -26.488-128.434 1.00 92.13 C
+ATOM 6621 H PHE M 46 -39.319 -29.918-134.337 1.00 0.00 H
+ATOM 6622 HA PHE M 46 -41.539 -28.449-133.143 1.00 0.00 H
+ATOM 6623 1HB PHE M 46 -41.353 -30.148-131.422 1.00 0.00 H
+ATOM 6624 2HB PHE M 46 -39.606 -29.975-131.359 1.00 0.00 H
+ATOM 6625 HD1 PHE M 46 -42.810 -28.283-130.607 1.00 0.00 H
+ATOM 6626 HD2 PHE M 46 -38.576 -28.294-130.038 1.00 0.00 H
+ATOM 6627 HE1 PHE M 46 -43.050 -26.590-128.820 1.00 0.00 H
+ATOM 6628 HE2 PHE M 46 -38.806 -26.592-128.258 1.00 0.00 H
+ATOM 6629 HZ PHE M 46 -41.044 -25.737-127.652 1.00 0.00 H
+ATOM 6630 N THR M 47 -39.993 -26.485-133.048 1.00102.51 N
+ATOM 6631 CA THR M 47 -39.149 -25.300-133.098 1.00107.10 C
+ATOM 6632 C THR M 47 -39.205 -24.585-131.752 1.00106.00 C
+ATOM 6633 O THR M 47 -40.196 -24.683-131.021 1.00122.85 O
+ATOM 6634 CB THR M 47 -39.582 -24.364-134.235 1.00111.32 C
+ATOM 6635 OG1 THR M 47 -39.826 -25.142-135.413 1.00102.18 O
+ATOM 6636 CG2 THR M 47 -38.500 -23.336-134.550 1.00121.83 C
+ATOM 6637 H THR M 47 -40.996 -26.373-133.002 1.00 0.00 H
+ATOM 6638 HA THR M 47 -38.122 -25.615-133.284 1.00 0.00 H
+ATOM 6639 HB THR M 47 -40.492 -23.838-133.947 1.00 0.00 H
+ATOM 6640 HG1 THR M 47 -39.663 -26.069-135.223 1.00 0.00 H
+ATOM 6641 1HG2 THR M 47 -38.838 -22.689-135.359 1.00 0.00 H
+ATOM 6642 2HG2 THR M 47 -38.300 -22.735-133.663 1.00 0.00 H
+ATOM 6643 3HG2 THR M 47 -37.588 -23.849-134.853 1.00 0.00 H
+ATOM 6644 N ALA M 48 -38.124 -23.877-131.417 1.00 90.68 N
+ATOM 6645 CA ALA M 48 -37.938 -23.377-130.064 1.00105.15 C
+ATOM 6646 C ALA M 48 -37.621 -21.894-129.956 1.00121.81 C
+ATOM 6647 O ALA M 48 -37.572 -21.383-128.835 1.00123.01 O
+ATOM 6648 CB ALA M 48 -36.823 -24.159-129.355 1.00103.61 C
+ATOM 6649 H ALA M 48 -37.420 -23.683-132.114 1.00 0.00 H
+ATOM 6650 HA ALA M 48 -38.871 -23.520-129.519 1.00 0.00 H
+ATOM 6651 1HB ALA M 48 -36.695 -23.774-128.343 1.00 0.00 H
+ATOM 6652 2HB ALA M 48 -37.091 -25.215-129.310 1.00 0.00 H
+ATOM 6653 3HB ALA M 48 -35.891 -24.045-129.907 1.00 0.00 H
+ATOM 6654 N GLU M 49 -37.369 -21.202-131.063 1.00128.25 N
+ATOM 6655 CA GLU M 49 -37.186 -19.756-131.043 1.00128.43 C
+ATOM 6656 C GLU M 49 -35.837 -19.410-130.425 1.00119.59 C
+ATOM 6657 O GLU M 49 -35.486 -18.233-130.327 1.00117.40 O
+ATOM 6658 CB GLU M 49 -38.314 -19.078-130.262 1.00116.09 C
+ATOM 6659 CG GLU M 49 -39.712 -19.398-130.771 1.00 0.00 C
+ATOM 6660 CD GLU M 49 -39.975 -18.844-132.144 1.00 0.00 C
+ATOM 6661 OE1 GLU M 49 -39.309 -17.913-132.526 1.00 0.00 O
+ATOM 6662 OE2 GLU M 49 -40.845 -19.354-132.811 1.00 0.00 O
+ATOM 6663 H GLU M 49 -37.303 -21.694-131.942 1.00 0.00 H
+ATOM 6664 HA GLU M 49 -37.180 -19.394-132.072 1.00 0.00 H
+ATOM 6665 1HB GLU M 49 -38.262 -19.378-129.215 1.00 0.00 H
+ATOM 6666 2HB GLU M 49 -38.183 -17.996-130.299 1.00 0.00 H
+ATOM 6667 1HG GLU M 49 -39.839 -20.480-130.797 1.00 0.00 H
+ATOM 6668 2HG GLU M 49 -40.443 -18.991-130.074 1.00 0.00 H
+ATOM 6669 N THR M 50 -35.069 -20.425-130.025 1.00104.91 N
+ATOM 6670 CA THR M 50 -33.676 -20.299-129.608 1.00 91.27 C
+ATOM 6671 C THR M 50 -32.947 -21.579-129.988 1.00 79.83 C
+ATOM 6672 O THR M 50 -33.573 -22.642-130.070 1.00 73.57 O
+ATOM 6673 CB THR M 50 -33.535 -20.049-128.096 1.00 98.76 C
+ATOM 6674 OG1 THR M 50 -34.401 -20.934-127.371 1.00106.45 O
+ATOM 6675 CG2 THR M 50 -33.853 -18.602-127.743 1.00 98.54 C
+ATOM 6676 H THR M 50 -35.504 -21.337-130.018 1.00 0.00 H
+ATOM 6677 HA THR M 50 -33.235 -19.447-130.127 1.00 0.00 H
+ATOM 6678 HB THR M 50 -32.514 -20.270-127.784 1.00 0.00 H
+ATOM 6679 HG1 THR M 50 -34.880 -21.490-127.990 1.00 0.00 H
+ATOM 6680 1HG2 THR M 50 -33.744 -18.457-126.668 1.00 0.00 H
+ATOM 6681 2HG2 THR M 50 -33.167 -17.940-128.270 1.00 0.00 H
+ATOM 6682 3HG2 THR M 50 -34.876 -18.372-128.038 1.00 0.00 H
+ATOM 6683 N PRO M 51 -31.637 -21.510-130.246 1.00 84.86 N
+ATOM 6684 CA PRO M 51 -30.897 -22.720-130.624 1.00 86.41 C
+ATOM 6685 C PRO M 51 -30.919 -23.765-129.520 1.00 85.83 C
+ATOM 6686 O PRO M 51 -30.931 -23.446-128.329 1.00 85.88 O
+ATOM 6687 CB PRO M 51 -29.475 -22.204-130.874 1.00 88.80 C
+ATOM 6688 CG PRO M 51 -29.643 -20.745-131.148 1.00 93.51 C
+ATOM 6689 CD PRO M 51 -30.786 -20.309-130.288 1.00 94.10 C
+ATOM 6690 HA PRO M 51 -31.329 -23.135-131.546 1.00 0.00 H
+ATOM 6691 1HB PRO M 51 -28.844 -22.398-129.994 1.00 0.00 H
+ATOM 6692 2HB PRO M 51 -29.022 -22.743-131.719 1.00 0.00 H
+ATOM 6693 1HG PRO M 51 -28.715 -20.205-130.910 1.00 0.00 H
+ATOM 6694 2HG PRO M 51 -29.842 -20.580-132.217 1.00 0.00 H
+ATOM 6695 1HD PRO M 51 -30.412 -20.037-129.290 1.00 0.00 H
+ATOM 6696 2HD PRO M 51 -31.294 -19.454-130.758 1.00 0.00 H
+ATOM 6697 N ILE M 52 -30.919 -25.030-129.934 1.00 77.18 N
+ATOM 6698 CA ILE M 52 -30.954 -26.168-129.022 1.00 74.01 C
+ATOM 6699 C ILE M 52 -29.545 -26.722-128.883 1.00 65.80 C
+ATOM 6700 O ILE M 52 -28.878 -26.999-129.888 1.00 78.52 O
+ATOM 6701 CB ILE M 52 -31.918 -27.256-129.522 1.00 70.56 C
+ATOM 6702 CG1 ILE M 52 -33.330 -26.693-129.681 1.00 76.23 C
+ATOM 6703 CG2 ILE M 52 -31.924 -28.438-128.574 1.00 67.49 C
+ATOM 6704 CD1 ILE M 52 -34.340 -27.727-130.106 1.00 71.38 C
+ATOM 6705 H ILE M 52 -30.893 -25.198-130.930 1.00 0.00 H
+ATOM 6706 HA ILE M 52 -31.305 -25.822-128.051 1.00 0.00 H
+ATOM 6707 HB ILE M 52 -31.603 -27.596-130.508 1.00 0.00 H
+ATOM 6708 1HG1 ILE M 52 -33.656 -26.258-128.737 1.00 0.00 H
+ATOM 6709 2HG1 ILE M 52 -33.322 -25.894-130.423 1.00 0.00 H
+ATOM 6710 1HG2 ILE M 52 -32.612 -29.197-128.944 1.00 0.00 H
+ATOM 6711 2HG2 ILE M 52 -30.921 -28.858-128.510 1.00 0.00 H
+ATOM 6712 3HG2 ILE M 52 -32.244 -28.110-127.585 1.00 0.00 H
+ATOM 6713 1HD1 ILE M 52 -35.321 -27.260-130.201 1.00 0.00 H
+ATOM 6714 2HD1 ILE M 52 -34.045 -28.150-131.067 1.00 0.00 H
+ATOM 6715 3HD1 ILE M 52 -34.386 -28.519-129.359 1.00 0.00 H
+ATOM 6716 N GLN M 53 -29.094 -26.893-127.640 1.00 64.89 N
+ATOM 6717 CA GLN M 53 -27.771 -27.451-127.395 1.00 69.74 C
+ATOM 6718 C GLN M 53 -27.849 -28.957-127.177 1.00 81.45 C
+ATOM 6719 O GLN M 53 -27.705 -29.731-128.129 1.00113.79 O
+ATOM 6720 CB GLN M 53 -27.109 -26.765-126.201 1.00 67.11 C
+ATOM 6721 CG GLN M 53 -26.625 -25.356-126.500 1.00 72.45 C
+ATOM 6722 CD GLN M 53 -27.752 -24.349-126.582 1.00 84.02 C
+ATOM 6723 OE1 GLN M 53 -28.408 -24.047-125.583 1.00 86.67 O
+ATOM 6724 NE2 GLN M 53 -27.991 -23.828-127.778 1.00 91.31 N
+ATOM 6725 H GLN M 53 -29.672 -26.634-126.853 1.00 0.00 H
+ATOM 6726 HA GLN M 53 -27.155 -27.281-128.278 1.00 0.00 H
+ATOM 6727 1HB GLN M 53 -27.815 -26.715-125.372 1.00 0.00 H
+ATOM 6728 2HB GLN M 53 -26.256 -27.356-125.869 1.00 0.00 H
+ATOM 6729 1HG GLN M 53 -25.948 -25.040-125.707 1.00 0.00 H
+ATOM 6730 2HG GLN M 53 -26.104 -25.357-127.457 1.00 0.00 H
+ATOM 6731 1HE2 GLN M 53 -28.724 -23.157-127.894 1.00 0.00 H
+ATOM 6732 2HE2 GLN M 53 -27.439 -24.106-128.564 1.00 0.00 H
+ATOM 6733 N ASN M 54 -28.074 -29.384-125.941 1.00 62.29 N
+ATOM 6734 CA ASN M 54 -28.174 -30.794-125.602 1.00 65.99 C
+ATOM 6735 C ASN M 54 -29.636 -31.225-125.534 1.00 68.41 C
+ATOM 6736 O ASN M 54 -30.551 -30.401-125.460 1.00 61.55 O
+ATOM 6737 CB ASN M 54 -27.481 -31.078-124.267 1.00 66.53 C
+ATOM 6738 CG ASN M 54 -26.043 -30.606-124.247 1.00 61.93 C
+ATOM 6739 OD1 ASN M 54 -25.147 -31.273-124.766 1.00 62.51 O
+ATOM 6740 ND2 ASN M 54 -25.812 -29.448-123.640 1.00 62.30 N
+ATOM 6741 H ASN M 54 -28.179 -28.694-125.211 1.00 0.00 H
+ATOM 6742 HA ASN M 54 -27.677 -31.374-126.382 1.00 0.00 H
+ATOM 6743 1HB ASN M 54 -28.025 -30.583-123.462 1.00 0.00 H
+ATOM 6744 2HB ASN M 54 -27.503 -32.149-124.066 1.00 0.00 H
+ATOM 6745 1HD2 ASN M 54 -24.881 -29.084-123.594 1.00 0.00 H
+ATOM 6746 2HD2 ASN M 54 -26.568 -28.940-123.229 1.00 0.00 H
+ATOM 6747 N VAL M 55 -29.845 -32.539-125.555 1.00 74.35 N
+ATOM 6748 CA VAL M 55 -31.186 -33.114-125.527 1.00 76.74 C
+ATOM 6749 C VAL M 55 -31.140 -34.410-124.726 1.00 76.14 C
+ATOM 6750 O VAL M 55 -30.166 -35.168-124.800 1.00 75.56 O
+ATOM 6751 CB VAL M 55 -31.720 -33.343-126.959 1.00 67.60 C
+ATOM 6752 CG1 VAL M 55 -30.717 -34.135-127.779 1.00 61.40 C
+ATOM 6753 CG2 VAL M 55 -33.068 -34.045-126.934 1.00 61.93 C
+ATOM 6754 H VAL M 55 -29.046 -33.156-125.592 1.00 0.00 H
+ATOM 6755 HA VAL M 55 -31.852 -32.415-125.019 1.00 0.00 H
+ATOM 6756 HB VAL M 55 -31.833 -32.378-127.453 1.00 0.00 H
+ATOM 6757 1HG1 VAL M 55 -31.109 -34.287-128.785 1.00 0.00 H
+ATOM 6758 2HG1 VAL M 55 -29.778 -33.585-127.835 1.00 0.00 H
+ATOM 6759 3HG1 VAL M 55 -30.545 -35.102-127.308 1.00 0.00 H
+ATOM 6760 1HG2 VAL M 55 -33.420 -34.193-127.954 1.00 0.00 H
+ATOM 6761 2HG2 VAL M 55 -32.966 -35.012-126.442 1.00 0.00 H
+ATOM 6762 3HG2 VAL M 55 -33.786 -33.434-126.387 1.00 0.00 H
+ATOM 6763 N ILE M 56 -32.197 -34.654-123.948 1.00 67.11 N
+ATOM 6764 CA ILE M 56 -32.322 -35.842-123.111 1.00 71.30 C
+ATOM 6765 C ILE M 56 -33.681 -36.484-123.365 1.00 71.12 C
+ATOM 6766 O ILE M 56 -34.675 -35.785-123.593 1.00 71.95 O
+ATOM 6767 CB ILE M 56 -32.150 -35.498-121.613 1.00 74.78 C
+ATOM 6768 CG1 ILE M 56 -30.738 -34.980-121.333 1.00 86.72 C
+ATOM 6769 CG2 ILE M 56 -32.433 -36.706-120.735 1.00 66.69 C
+ATOM 6770 CD1 ILE M 56 -29.649 -35.999-121.591 1.00 92.25 C
+ATOM 6771 H ILE M 56 -32.942 -33.972-123.949 1.00 0.00 H
+ATOM 6772 HA ILE M 56 -31.539 -36.546-123.390 1.00 0.00 H
+ATOM 6773 HB ILE M 56 -32.842 -34.702-121.341 1.00 0.00 H
+ATOM 6774 1HG1 ILE M 56 -30.541 -34.106-121.954 1.00 0.00 H
+ATOM 6775 2HG1 ILE M 56 -30.666 -34.663-120.292 1.00 0.00 H
+ATOM 6776 1HG2 ILE M 56 -32.303 -36.433-119.688 1.00 0.00 H
+ATOM 6777 2HG2 ILE M 56 -33.456 -37.042-120.898 1.00 0.00 H
+ATOM 6778 3HG2 ILE M 56 -31.742 -37.510-120.989 1.00 0.00 H
+ATOM 6779 1HD1 ILE M 56 -28.677 -35.557-121.369 1.00 0.00 H
+ATOM 6780 2HD1 ILE M 56 -29.806 -36.869-120.953 1.00 0.00 H
+ATOM 6781 3HD1 ILE M 56 -29.678 -36.305-122.636 1.00 0.00 H
+ATOM 6782 N LEU M 57 -33.719 -37.816-123.338 1.00 78.16 N
+ATOM 6783 CA LEU M 57 -34.958 -38.585-123.405 1.00 89.52 C
+ATOM 6784 C LEU M 57 -35.076 -39.422-122.139 1.00104.56 C
+ATOM 6785 O LEU M 57 -34.168 -40.196-121.819 1.00115.76 O
+ATOM 6786 CB LEU M 57 -34.986 -39.481-124.643 1.00 81.21 C
+ATOM 6787 CG LEU M 57 -36.112 -40.515-124.709 1.00 78.09 C
+ATOM 6788 CD1 LEU M 57 -37.469 -39.833-124.786 1.00 86.68 C
+ATOM 6789 CD2 LEU M 57 -35.908 -41.451-125.889 1.00 84.89 C
+ATOM 6790 H LEU M 57 -32.839 -38.306-123.267 1.00 0.00 H
+ATOM 6791 HA LEU M 57 -35.794 -37.889-123.468 1.00 0.00 H
+ATOM 6792 1HB LEU M 57 -35.072 -38.850-125.526 1.00 0.00 H
+ATOM 6793 2HB LEU M 57 -34.043 -40.024-124.701 1.00 0.00 H
+ATOM 6794 HG LEU M 57 -36.122 -41.102-123.790 1.00 0.00 H
+ATOM 6795 1HD1 LEU M 57 -38.254 -40.588-124.832 1.00 0.00 H
+ATOM 6796 2HD1 LEU M 57 -37.615 -39.212-123.902 1.00 0.00 H
+ATOM 6797 3HD1 LEU M 57 -37.513 -39.210-125.679 1.00 0.00 H
+ATOM 6798 1HD2 LEU M 57 -36.718 -42.180-125.919 1.00 0.00 H
+ATOM 6799 2HD2 LEU M 57 -35.904 -40.874-126.814 1.00 0.00 H
+ATOM 6800 3HD2 LEU M 57 -34.956 -41.971-125.781 1.00 0.00 H
+ATOM 6801 N HIS M 58 -36.193 -39.272-121.425 1.00102.35 N
+ATOM 6802 CA HIS M 58 -36.382 -39.966-120.156 1.00105.41 C
+ATOM 6803 C HIS M 58 -37.865 -40.021-119.822 1.00113.52 C
+ATOM 6804 O HIS M 58 -38.539 -38.986-119.833 1.00117.21 O
+ATOM 6805 CB HIS M 58 -35.611 -39.266-119.029 1.00106.28 C
+ATOM 6806 CG HIS M 58 -36.004 -39.715-117.655 1.00105.80 C
+ATOM 6807 ND1 HIS M 58 -37.032 -39.130-116.946 1.00103.41 N
+ATOM 6808 CD2 HIS M 58 -35.499 -40.683-116.853 1.00 95.40 C
+ATOM 6809 CE1 HIS M 58 -37.148 -39.724-115.771 1.00 96.03 C
+ATOM 6810 NE2 HIS M 58 -36.229 -40.669-115.690 1.00 85.74 N
+ATOM 6811 H HIS M 58 -36.925 -38.666-121.768 1.00 0.00 H
+ATOM 6812 HA HIS M 58 -36.004 -40.985-120.239 1.00 0.00 H
+ATOM 6813 1HB HIS M 58 -34.543 -39.446-119.152 1.00 0.00 H
+ATOM 6814 2HB HIS M 58 -35.771 -38.190-119.093 1.00 0.00 H
+ATOM 6815 HD2 HIS M 58 -34.669 -41.350-117.088 1.00 0.00 H
+ATOM 6816 HE1 HIS M 58 -37.878 -39.476-115.001 1.00 0.00 H
+ATOM 6817 HE2 HIS M 58 -36.082 -41.285-114.903 1.00 0.00 H
+ATOM 6818 N GLU M 59 -38.358 -41.222-119.519 1.00111.71 N
+ATOM 6819 CA GLU M 59 -39.725 -41.432-119.038 1.00117.61 C
+ATOM 6820 C GLU M 59 -40.756 -40.832-119.993 1.00114.11 C
+ATOM 6821 O GLU M 59 -41.663 -40.099-119.592 1.00124.77 O
+ATOM 6822 CB GLU M 59 -39.897 -40.824-117.644 1.00117.32 C
+ATOM 6823 CG GLU M 59 -39.003 -41.438-116.576 1.00 0.00 C
+ATOM 6824 CD GLU M 59 -39.384 -42.852-116.237 1.00 0.00 C
+ATOM 6825 OE1 GLU M 59 -40.268 -43.378-116.869 1.00 0.00 O
+ATOM 6826 OE2 GLU M 59 -38.789 -43.408-115.344 1.00 0.00 O
+ATOM 6827 H GLU M 59 -37.748 -42.019-119.631 1.00 0.00 H
+ATOM 6828 HA GLU M 59 -39.922 -42.504-119.012 1.00 0.00 H
+ATOM 6829 1HB GLU M 59 -39.685 -39.756-117.684 1.00 0.00 H
+ATOM 6830 2HB GLU M 59 -40.932 -40.940-117.322 1.00 0.00 H
+ATOM 6831 1HG GLU M 59 -37.972 -41.426-116.929 1.00 0.00 H
+ATOM 6832 2HG GLU M 59 -39.057 -40.826-115.676 1.00 0.00 H
+ATOM 6833 N HIS M 60 -40.598 -41.146-121.279 1.00104.33 N
+ATOM 6834 CA HIS M 60 -41.522 -40.739-122.336 1.00106.06 C
+ATOM 6835 C HIS M 60 -41.636 -39.222-122.466 1.00 95.90 C
+ATOM 6836 O HIS M 60 -42.618 -38.715-123.019 1.00 98.43 O
+ATOM 6837 CB HIS M 60 -42.908 -41.361-122.129 1.00121.63 C
+ATOM 6838 CG HIS M 60 -42.899 -42.858-122.115 1.00134.48 C
+ATOM 6839 ND1 HIS M 60 -42.191 -43.589-121.185 1.00134.32 N
+ATOM 6840 CD2 HIS M 60 -43.504 -43.762-122.922 1.00142.54 C
+ATOM 6841 CE1 HIS M 60 -42.362 -44.878-121.417 1.00138.87 C
+ATOM 6842 NE2 HIS M 60 -43.155 -45.010-122.466 1.00145.13 N
+ATOM 6843 H HIS M 60 -39.787 -41.698-121.520 1.00 0.00 H
+ATOM 6844 HA HIS M 60 -41.145 -41.079-123.300 1.00 0.00 H
+ATOM 6845 1HB HIS M 60 -43.326 -41.013-121.184 1.00 0.00 H
+ATOM 6846 2HB HIS M 60 -43.577 -41.031-122.923 1.00 0.00 H
+ATOM 6847 HD2 HIS M 60 -44.148 -43.541-123.773 1.00 0.00 H
+ATOM 6848 HE1 HIS M 60 -41.924 -45.693-120.841 1.00 0.00 H
+ATOM 6849 HE2 HIS M 60 -43.459 -45.884-122.871 1.00 0.00 H
+ATOM 6850 N HIS M 61 -40.647 -38.485-121.968 1.00 80.16 N
+ATOM 6851 CA HIS M 61 -40.573 -37.043-122.141 1.00 87.98 C
+ATOM 6852 C HIS M 61 -39.217 -36.678-122.728 1.00 88.58 C
+ATOM 6853 O HIS M 61 -38.206 -37.328-122.445 1.00 80.93 O
+ATOM 6854 CB HIS M 61 -40.798 -36.298-120.814 1.00102.16 C
+ATOM 6855 CG HIS M 61 -42.229 -36.267-120.372 1.00120.26 C
+ATOM 6856 ND1 HIS M 61 -42.860 -37.355-119.809 1.00127.17 N
+ATOM 6857 CD2 HIS M 61 -43.153 -35.277-120.415 1.00126.84 C
+ATOM 6858 CE1 HIS M 61 -44.111 -37.037-119.524 1.00134.28 C
+ATOM 6859 NE2 HIS M 61 -44.314 -35.782-119.882 1.00132.73 N
+ATOM 6860 H HIS M 61 -39.920 -38.956-121.448 1.00 0.00 H
+ATOM 6861 HA HIS M 61 -41.349 -36.720-122.834 1.00 0.00 H
+ATOM 6862 1HB HIS M 61 -40.209 -36.770-120.027 1.00 0.00 H
+ATOM 6863 2HB HIS M 61 -40.450 -35.270-120.910 1.00 0.00 H
+ATOM 6864 HD2 HIS M 61 -43.003 -34.268-120.801 1.00 0.00 H
+ATOM 6865 HE1 HIS M 61 -44.849 -37.698-119.070 1.00 0.00 H
+ATOM 6866 HE2 HIS M 61 -45.180 -35.272-119.782 1.00 0.00 H
+ATOM 6867 N ILE M 62 -39.203 -35.635-123.555 1.00 86.31 N
+ATOM 6868 CA ILE M 62 -37.995 -35.177-124.235 1.00 81.89 C
+ATOM 6869 C ILE M 62 -37.606 -33.823-123.656 1.00 81.72 C
+ATOM 6870 O ILE M 62 -38.376 -32.858-123.743 1.00 84.85 O
+ATOM 6871 CB ILE M 62 -38.198 -35.089-125.754 1.00 88.14 C
+ATOM 6872 CG1 ILE M 62 -38.615 -36.452-126.315 1.00 84.53 C
+ATOM 6873 CG2 ILE M 62 -36.928 -34.589-126.429 1.00 91.97 C
+ATOM 6874 CD1 ILE M 62 -38.973 -36.428-127.785 1.00 83.56 C
+ATOM 6875 H ILE M 62 -40.072 -35.145-123.713 1.00 0.00 H
+ATOM 6876 HA ILE M 62 -37.197 -35.893-124.042 1.00 0.00 H
+ATOM 6877 HB ILE M 62 -39.012 -34.399-125.973 1.00 0.00 H
+ATOM 6878 1HG1 ILE M 62 -37.805 -37.167-126.174 1.00 0.00 H
+ATOM 6879 2HG1 ILE M 62 -39.478 -36.824-125.762 1.00 0.00 H
+ATOM 6880 1HG2 ILE M 62 -37.086 -34.532-127.506 1.00 0.00 H
+ATOM 6881 2HG2 ILE M 62 -36.678 -33.600-126.047 1.00 0.00 H
+ATOM 6882 3HG2 ILE M 62 -36.109 -35.277-126.219 1.00 0.00 H
+ATOM 6883 1HD1 ILE M 62 -39.258 -37.430-128.107 1.00 0.00 H
+ATOM 6884 2HD1 ILE M 62 -39.808 -35.745-127.945 1.00 0.00 H
+ATOM 6885 3HD1 ILE M 62 -38.113 -36.093-128.363 1.00 0.00 H
+ATOM 6886 N PHE M 63 -36.410 -33.750-123.074 1.00 82.44 N
+ATOM 6887 CA PHE M 63 -35.921 -32.541-122.420 1.00 81.32 C
+ATOM 6888 C PHE M 63 -34.911 -31.847-123.325 1.00 80.71 C
+ATOM 6889 O PHE M 63 -33.877 -32.430-123.671 1.00 83.21 O
+ATOM 6890 CB PHE M 63 -35.289 -32.868-121.066 1.00 80.24 C
+ATOM 6891 CG PHE M 63 -36.254 -33.448-120.070 1.00 89.73 C
+ATOM 6892 CD1 PHE M 63 -36.254 -34.805-119.794 1.00 87.77 C
+ATOM 6893 CD2 PHE M 63 -37.167 -32.637-119.416 1.00101.69 C
+ATOM 6894 CE1 PHE M 63 -37.141 -35.343-118.879 1.00 94.89 C
+ATOM 6895 CE2 PHE M 63 -38.059 -33.169-118.501 1.00108.13 C
+ATOM 6896 CZ PHE M 63 -38.044 -34.524-118.233 1.00105.36 C
+ATOM 6897 H PHE M 63 -35.823 -34.572-123.091 1.00 0.00 H
+ATOM 6898 HA PHE M 63 -36.766 -31.872-122.253 1.00 0.00 H
+ATOM 6899 1HB PHE M 63 -34.477 -33.580-121.206 1.00 0.00 H
+ATOM 6900 2HB PHE M 63 -34.860 -31.963-120.637 1.00 0.00 H
+ATOM 6901 HD1 PHE M 63 -35.543 -35.453-120.307 1.00 0.00 H
+ATOM 6902 HD2 PHE M 63 -37.178 -31.567-119.629 1.00 0.00 H
+ATOM 6903 HE1 PHE M 63 -37.125 -36.412-118.670 1.00 0.00 H
+ATOM 6904 HE2 PHE M 63 -38.773 -32.521-117.993 1.00 0.00 H
+ATOM 6905 HZ PHE M 63 -38.745 -34.945-117.514 1.00 0.00 H
+ATOM 6906 N LEU M 64 -35.211 -30.606-123.699 1.00 69.87 N
+ATOM 6907 CA LEU M 64 -34.358 -29.805-124.565 1.00 73.07 C
+ATOM 6908 C LEU M 64 -33.669 -28.727-123.744 1.00 74.17 C
+ATOM 6909 O LEU M 64 -34.335 -27.949-123.050 1.00 83.10 O
+ATOM 6910 CB LEU M 64 -35.162 -29.156-125.696 1.00 73.68 C
+ATOM 6911 CG LEU M 64 -36.002 -30.051-126.607 1.00 78.69 C
+ATOM 6912 CD1 LEU M 64 -36.693 -29.216-127.677 1.00 86.85 C
+ATOM 6913 CD2 LEU M 64 -35.148 -31.135-127.236 1.00 64.27 C
+ATOM 6914 H LEU M 64 -36.076 -30.211-123.359 1.00 0.00 H
+ATOM 6915 HA LEU M 64 -33.608 -30.458-125.011 1.00 0.00 H
+ATOM 6916 1HB LEU M 64 -35.852 -28.434-125.262 1.00 0.00 H
+ATOM 6917 2HB LEU M 64 -34.473 -28.621-126.350 1.00 0.00 H
+ATOM 6918 HG LEU M 64 -36.794 -30.523-126.024 1.00 0.00 H
+ATOM 6919 1HD1 LEU M 64 -37.288 -29.866-128.318 1.00 0.00 H
+ATOM 6920 2HD1 LEU M 64 -37.344 -28.482-127.202 1.00 0.00 H
+ATOM 6921 3HD1 LEU M 64 -35.943 -28.702-128.277 1.00 0.00 H
+ATOM 6922 1HD2 LEU M 64 -35.768 -31.760-127.879 1.00 0.00 H
+ATOM 6923 2HD2 LEU M 64 -34.357 -30.676-127.829 1.00 0.00 H
+ATOM 6924 3HD2 LEU M 64 -34.704 -31.749-126.452 1.00 0.00 H
+ATOM 6925 N GLY M 65 -32.341 -28.683-123.829 1.00 65.07 N
+ATOM 6926 CA GLY M 65 -31.568 -27.618-123.223 1.00 63.07 C
+ATOM 6927 C GLY M 65 -31.188 -26.562-124.240 1.00 64.06 C
+ATOM 6928 O GLY M 65 -30.180 -26.699-124.939 1.00 69.69 O
+ATOM 6929 H GLY M 65 -31.860 -29.415-124.332 1.00 0.00 H
+ATOM 6930 1HA GLY M 65 -32.146 -27.160-122.420 1.00 0.00 H
+ATOM 6931 2HA GLY M 65 -30.667 -28.033-122.774 1.00 0.00 H
+ATOM 6932 N ALA M 66 -31.990 -25.507-124.336 1.00 65.56 N
+ATOM 6933 CA ALA M 66 -31.819 -24.479-125.350 1.00 73.74 C
+ATOM 6934 C ALA M 66 -31.368 -23.167-124.723 1.00 82.05 C
+ATOM 6935 O ALA M 66 -31.484 -22.954-123.511 1.00 78.31 O
+ATOM 6936 CB ALA M 66 -33.121 -24.259-126.128 1.00 75.06 C
+ATOM 6937 H ALA M 66 -32.747 -25.423-123.673 1.00 0.00 H
+ATOM 6938 HA ALA M 66 -31.049 -24.814-126.045 1.00 0.00 H
+ATOM 6939 1HB ALA M 66 -32.969 -23.486-126.881 1.00 0.00 H
+ATOM 6940 2HB ALA M 66 -33.414 -25.188-126.617 1.00 0.00 H
+ATOM 6941 3HB ALA M 66 -33.906 -23.947-125.441 1.00 0.00 H
+ATOM 6942 N THR M 67 -30.854 -22.279-125.577 1.00 86.19 N
+ATOM 6943 CA THR M 67 -30.423 -20.961-125.129 1.00 81.51 C
+ATOM 6944 C THR M 67 -31.541 -20.281-124.355 1.00 79.98 C
+ATOM 6945 O THR M 67 -32.593 -19.968-124.922 1.00 76.52 O
+ATOM 6946 CB THR M 67 -30.003 -20.080-126.305 1.00 86.65 C
+ATOM 6947 OG1 THR M 67 -28.914 -20.692-127.008 1.00 87.14 O
+ATOM 6948 CG2 THR M 67 -29.567 -18.711-125.799 1.00 76.10 C
+ATOM 6949 H THR M 67 -30.761 -22.522-126.553 1.00 0.00 H
+ATOM 6950 HA THR M 67 -29.562 -21.084-124.472 1.00 0.00 H
+ATOM 6951 HB THR M 67 -30.842 -19.963-126.990 1.00 0.00 H
+ATOM 6952 HG1 THR M 67 -28.687 -21.523-126.584 1.00 0.00 H
+ATOM 6953 1HG2 THR M 67 -29.270 -18.089-126.643 1.00 0.00 H
+ATOM 6954 2HG2 THR M 67 -30.395 -18.237-125.272 1.00 0.00 H
+ATOM 6955 3HG2 THR M 67 -28.724 -18.826-125.119 1.00 0.00 H
+ATOM 6956 N ASN M 68 -31.330 -20.093-123.053 1.00 89.74 N
+ATOM 6957 CA ASN M 68 -32.222 -19.379-122.146 1.00 84.92 C
+ATOM 6958 C ASN M 68 -33.504 -20.138-121.824 1.00 82.98 C
+ATOM 6959 O ASN M 68 -34.387 -19.576-121.164 1.00 82.15 O
+ATOM 6960 CB ASN M 68 -32.578 -17.988-122.686 1.00 84.31 C
+ATOM 6961 CG ASN M 68 -31.378 -17.066-122.751 1.00 87.92 C
+ATOM 6962 OD1 ASN M 68 -30.441 -17.191-121.959 1.00 80.08 O
+ATOM 6963 ND2 ASN M 68 -31.399 -16.131-123.695 1.00 95.65 N
+ATOM 6964 H ASN M 68 -30.474 -20.488-122.691 1.00 0.00 H
+ATOM 6965 HA ASN M 68 -31.713 -19.252-121.189 1.00 0.00 H
+ATOM 6966 1HB ASN M 68 -33.004 -18.084-123.686 1.00 0.00 H
+ATOM 6967 2HB ASN M 68 -33.337 -17.534-122.049 1.00 0.00 H
+ATOM 6968 1HD2 ASN M 68 -30.633 -15.494-123.785 1.00 0.00 H
+ATOM 6969 2HD2 ASN M 68 -32.180 -16.064-124.315 1.00 0.00 H
+ATOM 6970 N TYR M 69 -33.637 -21.396-122.244 1.00 82.94 N
+ATOM 6971 CA TYR M 69 -34.856 -22.135-121.935 1.00 81.03 C
+ATOM 6972 C TYR M 69 -34.558 -23.622-121.821 1.00 80.41 C
+ATOM 6973 O TYR M 69 -33.546 -24.117-122.323 1.00 77.74 O
+ATOM 6974 CB TYR M 69 -35.946 -21.900-122.989 1.00 81.58 C
+ATOM 6975 CG TYR M 69 -36.672 -20.580-122.856 1.00 88.37 C
+ATOM 6976 CD1 TYR M 69 -36.366 -19.508-123.685 1.00 89.22 C
+ATOM 6977 CD2 TYR M 69 -37.665 -20.406-121.900 1.00 94.18 C
+ATOM 6978 CE1 TYR M 69 -37.028 -18.299-123.566 1.00 98.63 C
+ATOM 6979 CE2 TYR M 69 -38.333 -19.200-121.774 1.00104.84 C
+ATOM 6980 CZ TYR M 69 -38.011 -18.150-122.609 1.00107.91 C
+ATOM 6981 OH TYR M 69 -38.675 -16.948-122.484 1.00114.01 O
+ATOM 6982 H TYR M 69 -32.907 -21.850-122.774 1.00 0.00 H
+ATOM 6983 HA TYR M 69 -35.236 -21.789-120.974 1.00 0.00 H
+ATOM 6984 1HB TYR M 69 -35.503 -21.939-123.985 1.00 0.00 H
+ATOM 6985 2HB TYR M 69 -36.688 -22.696-122.929 1.00 0.00 H
+ATOM 6986 HD1 TYR M 69 -35.592 -19.611-124.446 1.00 0.00 H
+ATOM 6987 HD2 TYR M 69 -37.929 -21.227-121.233 1.00 0.00 H
+ATOM 6988 HE1 TYR M 69 -36.773 -17.471-124.226 1.00 0.00 H
+ATOM 6989 HE2 TYR M 69 -39.109 -19.083-121.017 1.00 0.00 H
+ATOM 6990 HH TYR M 69 -39.321 -17.013-121.777 1.00 0.00 H
+ATOM 6991 N ILE M 70 -35.459 -24.330-121.144 1.00 79.10 N
+ATOM 6992 CA ILE M 70 -35.450 -25.788-121.081 1.00 81.62 C
+ATOM 6993 C ILE M 70 -36.862 -26.257-121.395 1.00 99.82 C
+ATOM 6994 O ILE M 70 -37.787 -26.026-120.607 1.00108.98 O
+ATOM 6995 CB ILE M 70 -34.990 -26.319-119.718 1.00 68.62 C
+ATOM 6996 CG1 ILE M 70 -33.530 -25.943-119.467 1.00 66.49 C
+ATOM 6997 CG2 ILE M 70 -35.178 -27.824-119.649 1.00 65.88 C
+ATOM 6998 CD1 ILE M 70 -32.995 -26.447-118.157 1.00 64.84 C
+ATOM 6999 H ILE M 70 -36.180 -23.821-120.653 1.00 0.00 H
+ATOM 7000 HA ILE M 70 -34.754 -26.162-121.831 1.00 0.00 H
+ATOM 7001 HB ILE M 70 -35.577 -25.851-118.928 1.00 0.00 H
+ATOM 7002 1HG1 ILE M 70 -32.909 -26.342-120.268 1.00 0.00 H
+ATOM 7003 2HG1 ILE M 70 -33.426 -24.858-119.484 1.00 0.00 H
+ATOM 7004 1HG2 ILE M 70 -34.847 -28.188-118.677 1.00 0.00 H
+ATOM 7005 2HG2 ILE M 70 -36.231 -28.066-119.787 1.00 0.00 H
+ATOM 7006 3HG2 ILE M 70 -34.590 -28.301-120.434 1.00 0.00 H
+ATOM 7007 1HD1 ILE M 70 -31.954 -26.142-118.047 1.00 0.00 H
+ATOM 7008 2HD1 ILE M 70 -33.583 -26.030-117.339 1.00 0.00 H
+ATOM 7009 3HD1 ILE M 70 -33.058 -27.534-118.133 1.00 0.00 H
+ATOM 7010 N TYR M 71 -37.034 -26.911-122.540 1.00101.00 N
+ATOM 7011 CA TYR M 71 -38.351 -27.329-122.995 1.00 94.30 C
+ATOM 7012 C TYR M 71 -38.584 -28.796-122.660 1.00100.45 C
+ATOM 7013 O TYR M 71 -37.644 -29.587-122.563 1.00107.50 O
+ATOM 7014 CB TYR M 71 -38.506 -27.115-124.501 1.00 89.99 C
+ATOM 7015 CG TYR M 71 -38.213 -25.706-124.959 1.00 91.50 C
+ATOM 7016 CD1 TYR M 71 -36.920 -25.321-125.288 1.00 83.10 C
+ATOM 7017 CD2 TYR M 71 -39.224 -24.759-125.060 1.00 99.27 C
+ATOM 7018 CE1 TYR M 71 -36.643 -24.039-125.712 1.00 79.97 C
+ATOM 7019 CE2 TYR M 71 -38.954 -23.470-125.480 1.00100.79 C
+ATOM 7020 CZ TYR M 71 -37.661 -23.118-125.804 1.00 89.96 C
+ATOM 7021 OH TYR M 71 -37.380 -21.838-126.222 1.00 93.24 O
+ATOM 7022 H TYR M 71 -36.227 -27.123-123.109 1.00 0.00 H
+ATOM 7023 HA TYR M 71 -39.101 -26.726-122.483 1.00 0.00 H
+ATOM 7024 1HB TYR M 71 -37.835 -27.789-125.036 1.00 0.00 H
+ATOM 7025 2HB TYR M 71 -39.524 -27.361-124.800 1.00 0.00 H
+ATOM 7026 HD1 TYR M 71 -36.102 -26.038-125.213 1.00 0.00 H
+ATOM 7027 HD2 TYR M 71 -40.249 -25.027-124.805 1.00 0.00 H
+ATOM 7028 HE1 TYR M 71 -35.621 -23.758-125.965 1.00 0.00 H
+ATOM 7029 HE2 TYR M 71 -39.761 -22.740-125.552 1.00 0.00 H
+ATOM 7030 HH TYR M 71 -38.189 -21.321-126.232 1.00 0.00 H
+ATOM 7031 N VAL M 72 -39.853 -29.153-122.476 1.00 92.70 N
+ATOM 7032 CA VAL M 72 -40.259 -30.526-122.195 1.00 87.98 C
+ATOM 7033 C VAL M 72 -41.361 -30.884-123.180 1.00 90.90 C
+ATOM 7034 O VAL M 72 -42.464 -30.323-123.115 1.00 92.56 O
+ATOM 7035 CB VAL M 72 -40.738 -30.718-120.750 1.00 88.10 C
+ATOM 7036 CG1 VAL M 72 -41.080 -32.181-120.498 1.00 85.15 C
+ATOM 7037 CG2 VAL M 72 -39.686 -30.234-119.765 1.00 91.89 C
+ATOM 7038 H VAL M 72 -40.559 -28.434-122.536 1.00 0.00 H
+ATOM 7039 HA VAL M 72 -39.399 -31.179-122.346 1.00 0.00 H
+ATOM 7040 HB VAL M 72 -41.655 -30.147-120.602 1.00 0.00 H
+ATOM 7041 1HG1 VAL M 72 -41.419 -32.304-119.469 1.00 0.00 H
+ATOM 7042 2HG1 VAL M 72 -41.871 -32.492-121.180 1.00 0.00 H
+ATOM 7043 3HG1 VAL M 72 -40.195 -32.795-120.663 1.00 0.00 H
+ATOM 7044 1HG2 VAL M 72 -40.047 -30.379-118.747 1.00 0.00 H
+ATOM 7045 2HG2 VAL M 72 -38.765 -30.800-119.908 1.00 0.00 H
+ATOM 7046 3HG2 VAL M 72 -39.490 -29.175-119.933 1.00 0.00 H
+ATOM 7047 N LEU M 73 -41.067 -31.818-124.082 1.00 91.46 N
+ATOM 7048 CA LEU M 73 -41.984 -32.249-125.125 1.00 89.66 C
+ATOM 7049 C LEU M 73 -42.477 -33.663-124.845 1.00 95.49 C
+ATOM 7050 O LEU M 73 -41.789 -34.465-124.204 1.00 83.39 O
+ATOM 7051 CB LEU M 73 -41.309 -32.218-126.499 1.00 94.09 C
+ATOM 7052 CG LEU M 73 -40.319 -31.091-126.796 1.00 98.59 C
+ATOM 7053 CD1 LEU M 73 -39.629 -31.338-128.127 1.00 92.40 C
+ATOM 7054 CD2 LEU M 73 -41.017 -29.744-126.799 1.00111.86 C
+ATOM 7055 H LEU M 73 -40.152 -32.242-124.026 1.00 0.00 H
+ATOM 7056 HA LEU M 73 -42.832 -31.565-125.144 1.00 0.00 H
+ATOM 7057 1HB LEU M 73 -40.763 -33.149-126.639 1.00 0.00 H
+ATOM 7058 2HB LEU M 73 -42.082 -32.156-127.265 1.00 0.00 H
+ATOM 7059 HG LEU M 73 -39.540 -31.080-126.033 1.00 0.00 H
+ATOM 7060 1HD1 LEU M 73 -38.926 -30.529-128.328 1.00 0.00 H
+ATOM 7061 2HD1 LEU M 73 -39.090 -32.285-128.087 1.00 0.00 H
+ATOM 7062 3HD1 LEU M 73 -40.374 -31.377-128.921 1.00 0.00 H
+ATOM 7063 1HD2 LEU M 73 -40.291 -28.958-127.012 1.00 0.00 H
+ATOM 7064 2HD2 LEU M 73 -41.793 -29.738-127.565 1.00 0.00 H
+ATOM 7065 3HD2 LEU M 73 -41.469 -29.566-125.823 1.00 0.00 H
+ATOM 7066 N ASN M 74 -43.676 -33.964-125.339 1.00107.39 N
+ATOM 7067 CA ASN M 74 -44.191 -35.325-125.299 1.00106.82 C
+ATOM 7068 C ASN M 74 -43.490 -36.154-126.368 1.00108.01 C
+ATOM 7069 O ASN M 74 -43.391 -35.731-127.523 1.00117.01 O
+ATOM 7070 CB ASN M 74 -45.697 -35.347-125.487 1.00 99.29 C
+ATOM 7071 CG ASN M 74 -46.282 -36.720-125.301 1.00 0.00 C
+ATOM 7072 OD1 ASN M 74 -45.614 -37.731-125.543 1.00 0.00 O
+ATOM 7073 ND2 ASN M 74 -47.518 -36.774-124.874 1.00 0.00 N
+ATOM 7074 H ASN M 74 -44.242 -33.236-125.750 1.00 0.00 H
+ATOM 7075 HA ASN M 74 -43.978 -35.747-124.315 1.00 0.00 H
+ATOM 7076 1HB ASN M 74 -46.163 -34.666-124.774 1.00 0.00 H
+ATOM 7077 2HB ASN M 74 -45.944 -34.993-126.488 1.00 0.00 H
+ATOM 7078 1HD2 ASN M 74 -47.960 -37.661-124.732 1.00 0.00 H
+ATOM 7079 2HD2 ASN M 74 -48.021 -35.930-124.691 1.00 0.00 H
+ATOM 7080 N GLU M 75 -42.995 -37.331-125.977 1.00 97.20 N
+ATOM 7081 CA GLU M 75 -42.221 -38.155-126.902 1.00 86.75 C
+ATOM 7082 C GLU M 75 -43.041 -38.562-128.121 1.00 94.37 C
+ATOM 7083 O GLU M 75 -42.516 -38.620-129.238 1.00 93.56 O
+ATOM 7084 CB GLU M 75 -41.698 -39.396-126.180 1.00 90.28 C
+ATOM 7085 CG GLU M 75 -40.984 -40.387-127.082 1.00 95.11 C
+ATOM 7086 CD GLU M 75 -40.882 -41.769-126.463 1.00111.93 C
+ATOM 7087 OE1 GLU M 75 -41.553 -42.011-125.437 1.00119.81 O
+ATOM 7088 OE2 GLU M 75 -40.139 -42.615-127.007 1.00112.19 O
+ATOM 7089 H GLU M 75 -43.152 -37.663-125.036 1.00 0.00 H
+ATOM 7090 HA GLU M 75 -41.373 -37.570-127.260 1.00 0.00 H
+ATOM 7091 1HB GLU M 75 -41.004 -39.095-125.395 1.00 0.00 H
+ATOM 7092 2HB GLU M 75 -42.528 -39.915-125.701 1.00 0.00 H
+ATOM 7093 1HG GLU M 75 -41.525 -40.460-128.025 1.00 0.00 H
+ATOM 7094 2HG GLU M 75 -39.984 -40.012-127.297 1.00 0.00 H
+ATOM 7095 N GLU M 76 -44.332 -38.839-127.928 1.00112.02 N
+ATOM 7096 CA GLU M 76 -45.141 -39.401-129.006 1.00103.65 C
+ATOM 7097 C GLU M 76 -45.271 -38.434-130.177 1.00103.24 C
+ATOM 7098 O GLU M 76 -45.137 -38.836-131.338 1.00110.74 O
+ATOM 7099 CB GLU M 76 -46.532 -39.772-128.487 1.00105.44 C
+ATOM 7100 CG GLU M 76 -46.551 -40.961-127.537 1.00 0.00 C
+ATOM 7101 CD GLU M 76 -47.920 -41.244-126.982 1.00 0.00 C
+ATOM 7102 OE1 GLU M 76 -48.818 -40.484-127.251 1.00 0.00 O
+ATOM 7103 OE2 GLU M 76 -48.067 -42.223-126.288 1.00 0.00 O
+ATOM 7104 H GLU M 76 -44.762 -38.662-127.031 1.00 0.00 H
+ATOM 7105 HA GLU M 76 -44.643 -40.295-129.383 1.00 0.00 H
+ATOM 7106 1HB GLU M 76 -46.965 -38.919-127.964 1.00 0.00 H
+ATOM 7107 2HB GLU M 76 -47.184 -40.006-129.328 1.00 0.00 H
+ATOM 7108 1HG GLU M 76 -46.198 -41.844-128.069 1.00 0.00 H
+ATOM 7109 2HG GLU M 76 -45.864 -40.767-126.714 1.00 0.00 H
+ATOM 7110 N ASP M 77 -45.525 -37.154-129.896 1.00108.72 N
+ATOM 7111 CA ASP M 77 -45.814 -36.190-130.948 1.00114.77 C
+ATOM 7112 C ASP M 77 -44.922 -34.956-130.929 1.00106.43 C
+ATOM 7113 O ASP M 77 -45.109 -34.073-131.774 1.00101.19 O
+ATOM 7114 CB ASP M 77 -47.276 -35.748-130.852 1.00127.23 C
+ATOM 7115 CG ASP M 77 -47.593 -35.025-129.550 1.00 0.00 C
+ATOM 7116 OD1 ASP M 77 -46.700 -34.860-128.753 1.00 0.00 O
+ATOM 7117 OD2 ASP M 77 -48.724 -34.645-129.365 1.00 0.00 O
+ATOM 7118 H ASP M 77 -45.517 -36.845-128.934 1.00 0.00 H
+ATOM 7119 HA ASP M 77 -45.644 -36.669-131.913 1.00 0.00 H
+ATOM 7120 1HB ASP M 77 -47.512 -35.085-131.685 1.00 0.00 H
+ATOM 7121 2HB ASP M 77 -47.926 -36.620-130.934 1.00 0.00 H
+ATOM 7122 N LEU M 78 -43.964 -34.868-130.005 1.00106.96 N
+ATOM 7123 CA LEU M 78 -43.091 -33.698-129.875 1.00104.30 C
+ATOM 7124 C LEU M 78 -43.900 -32.413-129.713 1.00111.19 C
+ATOM 7125 O LEU M 78 -43.574 -31.370-130.283 1.00113.78 O
+ATOM 7126 CB LEU M 78 -42.120 -33.590-131.053 1.00101.77 C
+ATOM 7127 CG LEU M 78 -40.798 -34.349-130.910 1.00 93.33 C
+ATOM 7128 CD1 LEU M 78 -41.000 -35.854-131.013 1.00 97.23 C
+ATOM 7129 CD2 LEU M 78 -39.783 -33.866-131.933 1.00 93.10 C
+ATOM 7130 H LEU M 78 -43.842 -35.646-129.372 1.00 0.00 H
+ATOM 7131 HA LEU M 78 -42.507 -33.803-128.962 1.00 0.00 H
+ATOM 7132 1HB LEU M 78 -42.616 -33.964-131.947 1.00 0.00 H
+ATOM 7133 2HB LEU M 78 -41.878 -32.539-131.209 1.00 0.00 H
+ATOM 7134 HG LEU M 78 -40.392 -34.188-129.911 1.00 0.00 H
+ATOM 7135 1HD1 LEU M 78 -40.039 -36.358-130.907 1.00 0.00 H
+ATOM 7136 2HD1 LEU M 78 -41.673 -36.186-130.222 1.00 0.00 H
+ATOM 7137 3HD1 LEU M 78 -41.432 -36.097-131.983 1.00 0.00 H
+ATOM 7138 1HD2 LEU M 78 -38.851 -34.420-131.811 1.00 0.00 H
+ATOM 7139 2HD2 LEU M 78 -40.173 -34.029-132.938 1.00 0.00 H
+ATOM 7140 3HD2 LEU M 78 -39.595 -32.802-131.785 1.00 0.00 H
+ATOM 7141 N GLN M 79 -44.973 -32.494-128.932 1.00118.16 N
+ATOM 7142 CA GLN M 79 -45.730 -31.315-128.539 1.00118.78 C
+ATOM 7143 C GLN M 79 -45.153 -30.761-127.243 1.00115.74 C
+ATOM 7144 O GLN M 79 -44.818 -31.520-126.329 1.00109.97 O
+ATOM 7145 CB GLN M 79 -47.215 -31.647-128.367 1.00111.81 C
+ATOM 7146 CG GLN M 79 -48.073 -30.463-127.955 1.00106.48 C
+ATOM 7147 CD GLN M 79 -48.202 -29.430-129.058 1.00 0.00 C
+ATOM 7148 OE1 GLN M 79 -48.596 -29.748-130.183 1.00 0.00 O
+ATOM 7149 NE2 GLN M 79 -47.869 -28.184-128.741 1.00 0.00 N
+ATOM 7150 H GLN M 79 -45.270 -33.402-128.603 1.00 0.00 H
+ATOM 7151 HA GLN M 79 -45.641 -30.568-129.328 1.00 0.00 H
+ATOM 7152 1HB GLN M 79 -47.611 -32.040-129.303 1.00 0.00 H
+ATOM 7153 2HB GLN M 79 -47.328 -32.424-127.611 1.00 0.00 H
+ATOM 7154 1HG GLN M 79 -49.072 -30.822-127.705 1.00 0.00 H
+ATOM 7155 2HG GLN M 79 -47.621 -29.983-127.088 1.00 0.00 H
+ATOM 7156 1HE2 GLN M 79 -47.933 -27.458-129.428 1.00 0.00 H
+ATOM 7157 2HE2 GLN M 79 -47.554 -27.969-127.817 1.00 0.00 H
+ATOM 7158 N LYS M 80 -45.031 -29.436-127.171 1.00112.44 N
+ATOM 7159 CA LYS M 80 -44.462 -28.801-125.987 1.00108.29 C
+ATOM 7160 C LYS M 80 -45.399 -28.975-124.797 1.00106.38 C
+ATOM 7161 O LYS M 80 -46.575 -28.600-124.858 1.00 93.78 O
+ATOM 7162 CB LYS M 80 -44.195 -27.317-126.242 1.00107.00 C
+ATOM 7163 CG LYS M 80 -43.511 -26.594-125.089 1.00100.55 C
+ATOM 7164 CD LYS M 80 -43.146 -25.167-125.471 1.00 95.25 C
+ATOM 7165 CE LYS M 80 -44.385 -24.291-125.590 1.00105.43 C
+ATOM 7166 NZ LYS M 80 -44.037 -22.869-125.858 1.00 0.00 N
+ATOM 7167 H LYS M 80 -45.334 -28.858-127.942 1.00 0.00 H
+ATOM 7168 HA LYS M 80 -43.516 -29.290-125.753 1.00 0.00 H
+ATOM 7169 1HB LYS M 80 -43.566 -27.207-127.126 1.00 0.00 H
+ATOM 7170 2HB LYS M 80 -45.137 -26.807-126.445 1.00 0.00 H
+ATOM 7171 1HG LYS M 80 -44.178 -26.571-124.227 1.00 0.00 H
+ATOM 7172 2HG LYS M 80 -42.604 -27.129-124.811 1.00 0.00 H
+ATOM 7173 1HD LYS M 80 -42.485 -24.745-124.713 1.00 0.00 H
+ATOM 7174 2HD LYS M 80 -42.621 -25.168-126.426 1.00 0.00 H
+ATOM 7175 1HE LYS M 80 -45.012 -24.658-126.401 1.00 0.00 H
+ATOM 7176 2HE LYS M 80 -44.958 -24.343-124.665 1.00 0.00 H
+ATOM 7177 1HZ LYS M 80 -44.884 -22.323-125.929 1.00 0.00 H
+ATOM 7178 2HZ LYS M 80 -43.470 -22.512-125.101 1.00 0.00 H
+ATOM 7179 3HZ LYS M 80 -43.522 -22.805-126.724 1.00 0.00 H
+ATOM 7180 N VAL M 81 -44.876 -29.544-123.716 1.00103.22 N
+ATOM 7181 CA VAL M 81 -45.641 -29.804-122.504 1.00109.47 C
+ATOM 7182 C VAL M 81 -45.241 -28.852-121.382 1.00115.33 C
+ATOM 7183 O VAL M 81 -46.098 -28.291-120.699 1.00123.76 O
+ATOM 7184 CB VAL M 81 -45.491 -31.277-122.062 1.00114.52 C
+ATOM 7185 CG1 VAL M 81 -46.149 -31.497-120.706 1.00127.01 C
+ATOM 7186 CG2 VAL M 81 -46.086 -32.208-123.108 1.00104.25 C
+ATOM 7187 H VAL M 81 -43.901 -29.804-123.748 1.00 0.00 H
+ATOM 7188 HA VAL M 81 -46.694 -29.612-122.712 1.00 0.00 H
+ATOM 7189 HB VAL M 81 -44.432 -31.504-121.939 1.00 0.00 H
+ATOM 7190 1HG1 VAL M 81 -46.033 -32.540-120.410 1.00 0.00 H
+ATOM 7191 2HG1 VAL M 81 -45.675 -30.855-119.963 1.00 0.00 H
+ATOM 7192 3HG1 VAL M 81 -47.210 -31.255-120.773 1.00 0.00 H
+ATOM 7193 1HG2 VAL M 81 -45.972 -33.241-122.782 1.00 0.00 H
+ATOM 7194 2HG2 VAL M 81 -47.145 -31.982-123.236 1.00 0.00 H
+ATOM 7195 3HG2 VAL M 81 -45.568 -32.068-124.057 1.00 0.00 H
+ATOM 7196 N ALA M 82 -43.941 -28.653-121.180 1.00114.72 N
+ATOM 7197 CA ALA M 82 -43.481 -27.807-120.090 1.00118.43 C
+ATOM 7198 C ALA M 82 -42.364 -26.893-120.573 1.00125.73 C
+ATOM 7199 O ALA M 82 -41.717 -27.149-121.589 1.00133.78 O
+ATOM 7200 CB ALA M 82 -43.005 -28.640-118.892 1.00119.37 C
+ATOM 7201 H ALA M 82 -43.260 -29.090-121.785 1.00 0.00 H
+ATOM 7202 HA ALA M 82 -44.317 -27.187-119.766 1.00 0.00 H
+ATOM 7203 1HB ALA M 82 -42.669 -27.975-118.097 1.00 0.00 H
+ATOM 7204 2HB ALA M 82 -43.827 -29.255-118.527 1.00 0.00 H
+ATOM 7205 3HB ALA M 82 -42.181 -29.282-119.200 1.00 0.00 H
+ATOM 7206 N GLU M 83 -42.154 -25.811-119.828 1.00123.00 N
+ATOM 7207 CA GLU M 83 -41.072 -24.876-120.089 1.00120.40 C
+ATOM 7208 C GLU M 83 -40.402 -24.514-118.772 1.00121.32 C
+ATOM 7209 O GLU M 83 -40.941 -24.755-117.690 1.00132.53 O
+ATOM 7210 CB GLU M 83 -41.565 -23.594-120.777 1.00127.83 C
+ATOM 7211 CG GLU M 83 -42.236 -23.798-122.120 1.00144.18 C
+ATOM 7212 CD GLU M 83 -42.720 -22.493-122.725 1.00162.11 C
+ATOM 7213 OE1 GLU M 83 -42.453 -21.426-122.134 1.00162.36 O
+ATOM 7214 OE2 GLU M 83 -43.370 -22.534-123.790 1.00172.40 O
+ATOM 7215 H GLU M 83 -42.776 -25.639-119.051 1.00 0.00 H
+ATOM 7216 HA GLU M 83 -40.353 -25.356-120.754 1.00 0.00 H
+ATOM 7217 1HB GLU M 83 -42.279 -23.085-120.129 1.00 0.00 H
+ATOM 7218 2HB GLU M 83 -40.724 -22.918-120.932 1.00 0.00 H
+ATOM 7219 1HG GLU M 83 -41.527 -24.267-122.801 1.00 0.00 H
+ATOM 7220 2HG GLU M 83 -43.079 -24.476-121.994 1.00 0.00 H
+ATOM 7221 N TYR M 84 -39.212 -23.931-118.879 1.00110.44 N
+ATOM 7222 CA TYR M 84 -38.551 -23.333-117.726 1.00103.55 C
+ATOM 7223 C TYR M 84 -37.553 -22.306-118.231 1.00 94.34 C
+ATOM 7224 O TYR M 84 -36.699 -22.626-119.064 1.00 86.49 O
+ATOM 7225 CB TYR M 84 -37.849 -24.378-116.858 1.00105.10 C
+ATOM 7226 CG TYR M 84 -37.064 -23.762-115.722 1.00114.36 C
+ATOM 7227 CD1 TYR M 84 -37.710 -23.195-114.633 1.00124.44 C
+ATOM 7228 CD2 TYR M 84 -35.678 -23.743-115.740 1.00117.01 C
+ATOM 7229 CE1 TYR M 84 -36.994 -22.627-113.592 1.00129.36 C
+ATOM 7230 CE2 TYR M 84 -34.955 -23.179-114.704 1.00111.88 C
+ATOM 7231 CZ TYR M 84 -35.616 -22.623-113.635 1.00118.25 C
+ATOM 7232 OH TYR M 84 -34.895 -22.062-112.608 1.00122.80 O
+ATOM 7233 H TYR M 84 -38.754 -23.901-119.779 1.00 0.00 H
+ATOM 7234 HA TYR M 84 -39.305 -22.841-117.112 1.00 0.00 H
+ATOM 7235 1HB TYR M 84 -38.589 -25.063-116.442 1.00 0.00 H
+ATOM 7236 2HB TYR M 84 -37.170 -24.966-117.475 1.00 0.00 H
+ATOM 7237 HD1 TYR M 84 -38.799 -23.191-114.587 1.00 0.00 H
+ATOM 7238 HD2 TYR M 84 -35.138 -24.177-116.582 1.00 0.00 H
+ATOM 7239 HE1 TYR M 84 -37.520 -22.187-112.745 1.00 0.00 H
+ATOM 7240 HE2 TYR M 84 -33.865 -23.176-114.738 1.00 0.00 H
+ATOM 7241 HH TYR M 84 -33.957 -22.143-112.795 1.00 0.00 H
+ATOM 7242 N LYS M 85 -37.663 -21.082-117.725 1.00 99.91 N
+ATOM 7243 CA LYS M 85 -36.873 -19.963-118.229 1.00 95.18 C
+ATOM 7244 C LYS M 85 -35.585 -19.866-117.421 1.00 94.68 C
+ATOM 7245 O LYS M 85 -35.580 -19.365-116.294 1.00 97.67 O
+ATOM 7246 CB LYS M 85 -37.659 -18.653-118.153 1.00 81.88 C
+ATOM 7247 CG LYS M 85 -36.946 -17.456-118.768 1.00 0.00 C
+ATOM 7248 CD LYS M 85 -37.813 -16.207-118.708 1.00 0.00 C
+ATOM 7249 CE LYS M 85 -37.127 -15.023-119.374 1.00 0.00 C
+ATOM 7250 NZ LYS M 85 -37.963 -13.794-119.324 1.00 0.00 N
+ATOM 7251 H LYS M 85 -38.314 -20.924-116.969 1.00 0.00 H
+ATOM 7252 HA LYS M 85 -36.615 -20.162-119.270 1.00 0.00 H
+ATOM 7253 1HB LYS M 85 -38.615 -18.772-118.663 1.00 0.00 H
+ATOM 7254 2HB LYS M 85 -37.871 -18.416-117.110 1.00 0.00 H
+ATOM 7255 1HG LYS M 85 -36.017 -17.268-118.229 1.00 0.00 H
+ATOM 7256 2HG LYS M 85 -36.705 -17.671-119.808 1.00 0.00 H
+ATOM 7257 1HD LYS M 85 -38.761 -16.397-119.213 1.00 0.00 H
+ATOM 7258 2HD LYS M 85 -38.019 -15.956-117.668 1.00 0.00 H
+ATOM 7259 1HE LYS M 85 -36.180 -14.824-118.875 1.00 0.00 H
+ATOM 7260 2HE LYS M 85 -36.919 -15.263-120.417 1.00 0.00 H
+ATOM 7261 1HZ LYS M 85 -37.474 -13.034-119.775 1.00 0.00 H
+ATOM 7262 2HZ LYS M 85 -38.838 -13.961-119.801 1.00 0.00 H
+ATOM 7263 3HZ LYS M 85 -38.147 -13.550-118.361 1.00 0.00 H
+ATOM 7264 N THR M 86 -34.493 -20.371-117.991 1.00 93.57 N
+ATOM 7265 CA THR M 86 -33.143 -20.005-117.566 1.00 91.82 C
+ATOM 7266 C THR M 86 -32.649 -18.802-118.343 1.00100.54 C
+ATOM 7267 O THR M 86 -31.474 -18.735-118.712 1.00107.98 O
+ATOM 7268 CB THR M 86 -32.188 -21.181-117.745 1.00 95.81 C
+ATOM 7269 OG1 THR M 86 -31.810 -21.283-119.122 1.00102.58 O
+ATOM 7270 CG2 THR M 86 -32.846 -22.476-117.326 1.00107.42 C
+ATOM 7271 H THR M 86 -34.609 -21.032-118.746 1.00 0.00 H
+ATOM 7272 HA THR M 86 -33.173 -19.739-116.509 1.00 0.00 H
+ATOM 7273 HB THR M 86 -31.297 -21.022-117.137 1.00 0.00 H
+ATOM 7274 HG1 THR M 86 -32.242 -20.588-119.624 1.00 0.00 H
+ATOM 7275 1HG2 THR M 86 -32.146 -23.300-117.462 1.00 0.00 H
+ATOM 7276 2HG2 THR M 86 -33.135 -22.414-116.277 1.00 0.00 H
+ATOM 7277 3HG2 THR M 86 -33.731 -22.648-117.937 1.00 0.00 H
+ATOM 7278 N GLY M 87 -33.548 -17.852-118.609 1.00 97.35 N
+ATOM 7279 CA GLY M 87 -33.348 -16.805-119.584 1.00 79.91 C
+ATOM 7280 C GLY M 87 -32.180 -15.881-119.312 1.00 94.18 C
+ATOM 7281 O GLY M 87 -31.324 -16.149-118.463 1.00118.42 O
+ATOM 7282 H GLY M 87 -34.413 -17.881-118.089 1.00 0.00 H
+ATOM 7283 1HA GLY M 87 -33.193 -17.249-120.568 1.00 0.00 H
+ATOM 7284 2HA GLY M 87 -34.245 -16.190-119.646 1.00 0.00 H
+ATOM 7285 N PRO M 88 -32.129 -14.763-120.034 1.00 83.28 N
+ATOM 7286 CA PRO M 88 -31.020 -13.820-119.849 1.00 90.68 C
+ATOM 7287 C PRO M 88 -30.959 -13.348-118.406 1.00 88.50 C
+ATOM 7288 O PRO M 88 -31.961 -12.924-117.828 1.00 94.75 O
+ATOM 7289 CB PRO M 88 -31.358 -12.676-120.811 1.00 96.87 C
+ATOM 7290 CG PRO M 88 -32.833 -12.767-121.001 1.00 89.52 C
+ATOM 7291 CD PRO M 88 -33.171 -14.229-120.925 1.00 85.94 C
+ATOM 7292 HA PRO M 88 -30.078 -14.308-120.140 1.00 0.00 H
+ATOM 7293 1HB PRO M 88 -31.046 -11.715-120.377 1.00 0.00 H
+ATOM 7294 2HB PRO M 88 -30.802 -12.799-121.752 1.00 0.00 H
+ATOM 7295 1HG PRO M 88 -33.353 -12.186-120.225 1.00 0.00 H
+ATOM 7296 2HG PRO M 88 -33.119 -12.331-121.969 1.00 0.00 H
+ATOM 7297 1HD PRO M 88 -34.176 -14.352-120.496 1.00 0.00 H
+ATOM 7298 2HD PRO M 88 -33.122 -14.670-121.932 1.00 0.00 H
+ATOM 7299 N VAL M 89 -29.776 -13.447-117.818 1.00 84.14 N
+ATOM 7300 CA VAL M 89 -29.615 -13.257-116.387 1.00 93.71 C
+ATOM 7301 C VAL M 89 -28.560 -12.185-116.158 1.00108.45 C
+ATOM 7302 O VAL M 89 -27.681 -11.959-116.997 1.00102.83 O
+ATOM 7303 CB VAL M 89 -29.235 -14.587-115.695 1.00 88.99 C
+ATOM 7304 CG1 VAL M 89 -27.925 -15.094-116.240 1.00 79.08 C
+ATOM 7305 CG2 VAL M 89 -29.210 -14.449-114.170 1.00116.50 C
+ATOM 7306 H VAL M 89 -28.965 -13.660-118.380 1.00 0.00 H
+ATOM 7307 HA VAL M 89 -30.564 -12.912-115.975 1.00 0.00 H
+ATOM 7308 HB VAL M 89 -29.969 -15.348-115.962 1.00 0.00 H
+ATOM 7309 1HG1 VAL M 89 -27.664 -16.031-115.748 1.00 0.00 H
+ATOM 7310 2HG1 VAL M 89 -28.018 -15.262-117.313 1.00 0.00 H
+ATOM 7311 3HG1 VAL M 89 -27.144 -14.358-116.053 1.00 0.00 H
+ATOM 7312 1HG2 VAL M 89 -28.940 -15.405-113.723 1.00 0.00 H
+ATOM 7313 2HG2 VAL M 89 -28.477 -13.694-113.885 1.00 0.00 H
+ATOM 7314 3HG2 VAL M 89 -30.196 -14.149-113.816 1.00 0.00 H
+ATOM 7315 N LEU M 90 -28.667 -11.509-115.017 1.00112.81 N
+ATOM 7316 CA LEU M 90 -27.762 -10.429-114.660 1.00107.71 C
+ATOM 7317 C LEU M 90 -26.641 -10.960-113.778 1.00 99.02 C
+ATOM 7318 O LEU M 90 -26.899 -11.606-112.757 1.00105.03 O
+ATOM 7319 CB LEU M 90 -28.531 -9.325-113.943 1.00113.77 C
+ATOM 7320 CG LEU M 90 -29.802 -8.916-114.686 1.00114.99 C
+ATOM 7321 CD1 LEU M 90 -30.755 -8.179-113.765 1.00114.62 C
+ATOM 7322 CD2 LEU M 90 -29.449 -8.064-115.894 1.00112.01 C
+ATOM 7323 H LEU M 90 -29.408 -11.761-114.379 1.00 0.00 H
+ATOM 7324 HA LEU M 90 -27.330 -10.023-115.574 1.00 0.00 H
+ATOM 7325 1HB LEU M 90 -28.794 -9.676-112.946 1.00 0.00 H
+ATOM 7326 2HB LEU M 90 -27.879 -8.458-113.840 1.00 0.00 H
+ATOM 7327 HG LEU M 90 -30.331 -9.809-115.020 1.00 0.00 H
+ATOM 7328 1HD1 LEU M 90 -31.652 -7.899-114.318 1.00 0.00 H
+ATOM 7329 2HD1 LEU M 90 -31.030 -8.827-112.933 1.00 0.00 H
+ATOM 7330 3HD1 LEU M 90 -30.270 -7.282-113.382 1.00 0.00 H
+ATOM 7331 1HD2 LEU M 90 -30.362 -7.778-116.417 1.00 0.00 H
+ATOM 7332 2HD2 LEU M 90 -28.923 -7.167-115.566 1.00 0.00 H
+ATOM 7333 3HD2 LEU M 90 -28.808 -8.634-116.567 1.00 0.00 H
+ATOM 7334 N GLU M 91 -25.402 -10.687-114.175 1.00 90.75 N
+ATOM 7335 CA GLU M 91 -24.227 -11.157-113.457 1.00 94.64 C
+ATOM 7336 C GLU M 91 -23.628 -10.031-112.624 1.00100.80 C
+ATOM 7337 O GLU M 91 -23.529 -8.888-113.080 1.00107.11 O
+ATOM 7338 CB GLU M 91 -23.176 -11.713-114.423 1.00 92.95 C
+ATOM 7339 CG GLU M 91 -23.554 -13.044-115.069 1.00103.85 C
+ATOM 7340 CD GLU M 91 -22.444 -13.608-115.944 1.00118.44 C
+ATOM 7341 OE1 GLU M 91 -21.464 -12.881-116.208 1.00129.80 O
+ATOM 7342 OE2 GLU M 91 -22.547 -14.783-116.359 1.00114.55 O
+ATOM 7343 H GLU M 91 -25.279 -10.131-115.009 1.00 0.00 H
+ATOM 7344 HA GLU M 91 -24.531 -11.958-112.783 1.00 0.00 H
+ATOM 7345 1HB GLU M 91 -22.998 -10.992-115.221 1.00 0.00 H
+ATOM 7346 2HB GLU M 91 -22.234 -11.854-113.894 1.00 0.00 H
+ATOM 7347 1HG GLU M 91 -23.786 -13.764-114.284 1.00 0.00 H
+ATOM 7348 2HG GLU M 91 -24.451 -12.902-115.671 1.00 0.00 H
+ATOM 7349 N HIS M 92 -23.233 -10.365-111.395 1.00 96.88 N
+ATOM 7350 CA HIS M 92 -22.609 -9.433-110.479 1.00 92.51 C
+ATOM 7351 C HIS M 92 -21.646 -10.237-109.620 1.00 97.30 C
+ATOM 7352 O HIS M 92 -21.974 -11.369-109.236 1.00104.39 O
+ATOM 7353 CB HIS M 92 -23.638 -8.715-109.599 1.00 97.58 C
+ATOM 7354 CG HIS M 92 -23.104 -7.500-108.907 1.00 97.60 C
+ATOM 7355 ND1 HIS M 92 -22.308 -7.572-107.785 1.00 97.55 N
+ATOM 7356 CD2 HIS M 92 -23.259 -6.181-109.173 1.00101.63 C
+ATOM 7357 CE1 HIS M 92 -21.990 -6.351-107.394 1.00101.29 C
+ATOM 7358 NE2 HIS M 92 -22.555 -5.489-108.219 1.00103.88 N
+ATOM 7359 H HIS M 92 -23.382 -11.319-111.100 1.00 0.00 H
+ATOM 7360 HA HIS M 92 -22.076 -8.669-111.044 1.00 0.00 H
+ATOM 7361 1HB HIS M 92 -24.489 -8.411-110.209 1.00 0.00 H
+ATOM 7362 2HB HIS M 92 -24.009 -9.402-108.839 1.00 0.00 H
+ATOM 7363 HD2 HIS M 92 -23.834 -5.749-109.993 1.00 0.00 H
+ATOM 7364 HE1 HIS M 92 -21.367 -6.098-106.536 1.00 0.00 H
+ATOM 7365 HE2 HIS M 92 -22.484 -4.483-108.162 1.00 0.00 H
+ATOM 7366 N PRO M 93 -20.458 -9.702-109.321 1.00 92.92 N
+ATOM 7367 CA PRO M 93 -19.507 -10.476-108.506 1.00101.88 C
+ATOM 7368 C PRO M 93 -20.003 -10.736-107.094 1.00113.18 C
+ATOM 7369 O PRO M 93 -19.745 -11.811-106.539 1.00121.55 O
+ATOM 7370 CB PRO M 93 -18.246 -9.600-108.517 1.00 95.20 C
+ATOM 7371 CG PRO M 93 -18.392 -8.734-109.713 1.00 97.61 C
+ATOM 7372 CD PRO M 93 -19.857 -8.462-109.834 1.00 96.90 C
+ATOM 7373 HA PRO M 93 -19.317 -11.444-108.993 1.00 0.00 H
+ATOM 7374 1HB PRO M 93 -18.182 -9.021-107.584 1.00 0.00 H
+ATOM 7375 2HB PRO M 93 -17.348 -10.234-108.564 1.00 0.00 H
+ATOM 7376 1HG PRO M 93 -17.809 -7.810-109.586 1.00 0.00 H
+ATOM 7377 2HG PRO M 93 -17.991 -9.243-110.602 1.00 0.00 H
+ATOM 7378 1HD PRO M 93 -20.121 -7.592-109.215 1.00 0.00 H
+ATOM 7379 2HD PRO M 93 -20.111 -8.280-110.889 1.00 0.00 H
+ATOM 7380 N ASP M 94 -20.710 -9.782-106.495 1.00108.93 N
+ATOM 7381 CA ASP M 94 -21.215 -9.948-105.139 1.00 91.75 C
+ATOM 7382 C ASP M 94 -22.473 -10.805-105.073 1.00 94.92 C
+ATOM 7383 O ASP M 94 -23.033 -10.963-103.984 1.00 88.88 O
+ATOM 7384 CB ASP M 94 -21.489 -8.577-104.512 1.00105.45 C
+ATOM 7385 CG ASP M 94 -20.277 -7.665-104.556 1.00116.48 C
+ATOM 7386 OD1 ASP M 94 -19.152 -8.188-104.711 1.00113.26 O
+ATOM 7387 OD2 ASP M 94 -20.447 -6.431-104.424 1.00117.92 O
+ATOM 7388 H ASP M 94 -20.902 -8.923-106.990 1.00 0.00 H
+ATOM 7389 HA ASP M 94 -20.456 -10.462-104.548 1.00 0.00 H
+ATOM 7390 1HB ASP M 94 -22.313 -8.094-105.038 1.00 0.00 H
+ATOM 7391 2HB ASP M 94 -21.795 -8.706-103.474 1.00 0.00 H
+ATOM 7392 N CYS M 95 -22.925 -11.363-106.195 1.00 89.77 N
+ATOM 7393 CA CYS M 95 -24.126 -12.186-106.240 1.00 85.32 C
+ATOM 7394 C CYS M 95 -23.755 -13.616-106.596 1.00 91.25 C
+ATOM 7395 O CYS M 95 -23.021 -13.853-107.562 1.00 99.16 O
+ATOM 7396 CB CYS M 95 -25.135 -11.634-107.243 1.00 86.38 C
+ATOM 7397 SG CYS M 95 -26.014 -10.183-106.648 1.00 96.30 S
+ATOM 7398 H CYS M 95 -22.406 -11.203-107.047 1.00 0.00 H
+ATOM 7399 HA CYS M 95 -24.587 -12.180-105.252 1.00 0.00 H
+ATOM 7400 1HB CYS M 95 -24.622 -11.370-108.168 1.00 0.00 H
+ATOM 7401 2HB CYS M 95 -25.867 -12.404-107.484 1.00 0.00 H
+ATOM 7402 N PHE M 96 -24.268 -14.560-105.815 1.00 80.46 N
+ATOM 7403 CA PHE M 96 -23.973 -15.981-105.943 1.00 77.86 C
+ATOM 7404 C PHE M 96 -25.264 -16.724-106.263 1.00 81.13 C
+ATOM 7405 O PHE M 96 -26.350 -16.147-106.121 1.00 89.01 O
+ATOM 7406 CB PHE M 96 -23.336 -16.507-104.655 1.00 90.94 C
+ATOM 7407 CG PHE M 96 -22.000 -15.903-104.350 1.00 87.80 C
+ATOM 7408 CD1 PHE M 96 -20.838 -16.516-104.781 1.00 78.75 C
+ATOM 7409 CD2 PHE M 96 -21.905 -14.723-103.631 1.00 81.60 C
+ATOM 7410 CE1 PHE M 96 -19.606 -15.967-104.504 1.00 80.70 C
+ATOM 7411 CE2 PHE M 96 -20.675 -14.168-103.354 1.00 83.39 C
+ATOM 7412 CZ PHE M 96 -19.523 -14.793-103.790 1.00 82.98 C
+ATOM 7413 H PHE M 96 -24.902 -14.252-105.091 1.00 0.00 H
+ATOM 7414 HA PHE M 96 -23.267 -16.115-106.764 1.00 0.00 H
+ATOM 7415 1HB PHE M 96 -23.999 -16.308-103.814 1.00 0.00 H
+ATOM 7416 2HB PHE M 96 -23.212 -17.587-104.725 1.00 0.00 H
+ATOM 7417 HD1 PHE M 96 -20.905 -17.445-105.347 1.00 0.00 H
+ATOM 7418 HD2 PHE M 96 -22.815 -14.230-103.287 1.00 0.00 H
+ATOM 7419 HE1 PHE M 96 -18.699 -16.462-104.850 1.00 0.00 H
+ATOM 7420 HE2 PHE M 96 -20.609 -13.237-102.791 1.00 0.00 H
+ATOM 7421 HZ PHE M 96 -18.550 -14.357-103.567 1.00 0.00 H
+ATOM 7422 N PRO M 97 -25.196 -17.985-106.703 1.00 74.24 N
+ATOM 7423 CA PRO M 97 -26.420 -18.706-107.078 1.00 73.13 C
+ATOM 7424 C PRO M 97 -27.481 -18.692-105.984 1.00 73.99 C
+ATOM 7425 O PRO M 97 -27.177 -18.623-104.792 1.00 84.93 O
+ATOM 7426 CB PRO M 97 -25.917 -20.127-107.347 1.00 71.06 C
+ATOM 7427 CG PRO M 97 -24.518 -19.932-107.819 1.00 71.20 C
+ATOM 7428 CD PRO M 97 -23.982 -18.736-107.081 1.00 73.17 C
+ATOM 7429 HA PRO M 97 -26.839 -18.258-107.991 1.00 0.00 H
+ATOM 7430 1HB PRO M 97 -25.979 -20.728-106.428 1.00 0.00 H
+ATOM 7431 2HB PRO M 97 -26.557 -20.617-108.095 1.00 0.00 H
+ATOM 7432 1HG PRO M 97 -23.920 -20.833-107.618 1.00 0.00 H
+ATOM 7433 2HG PRO M 97 -24.503 -19.777-108.908 1.00 0.00 H
+ATOM 7434 1HD PRO M 97 -23.425 -19.071-106.194 1.00 0.00 H
+ATOM 7435 2HD PRO M 97 -23.332 -18.153-107.750 1.00 0.00 H
+ATOM 7436 N CYS M 98 -28.740 -18.740-106.417 1.00 74.32 N
+ATOM 7437 CA CYS M 98 -29.938 -18.807-105.581 1.00 90.99 C
+ATOM 7438 C CYS M 98 -30.136 -17.585-104.690 1.00 86.50 C
+ATOM 7439 O CYS M 98 -31.022 -17.597-103.827 1.00 79.63 O
+ATOM 7440 CB CYS M 98 -29.954 -20.064-104.709 1.00108.40 C
+ATOM 7441 SG CYS M 98 -30.422 -21.609-105.516 1.00133.73 S
+ATOM 7442 H CYS M 98 -28.841 -18.727-107.422 1.00 0.00 H
+ATOM 7443 HA CYS M 98 -30.812 -18.837-106.231 1.00 0.00 H
+ATOM 7444 1HB CYS M 98 -28.963 -20.224-104.282 1.00 0.00 H
+ATOM 7445 2HB CYS M 98 -30.648 -19.923-103.881 1.00 0.00 H
+ATOM 7446 N GLN M 99 -29.357 -16.528-104.872 1.00 88.38 N
+ATOM 7447 CA GLN M 99 -29.484 -15.361-104.014 1.00 88.32 C
+ATOM 7448 C GLN M 99 -30.491 -14.364-104.581 1.00 91.28 C
+ATOM 7449 O GLN M 99 -30.852 -14.402-105.760 1.00106.07 O
+ATOM 7450 CB GLN M 99 -28.128 -14.684-103.819 1.00 84.92 C
+ATOM 7451 CG GLN M 99 -27.255 -15.345-102.771 1.00 81.08 C
+ATOM 7452 CD GLN M 99 -26.029 -14.524-102.435 1.00 82.28 C
+ATOM 7453 OE1 GLN M 99 -25.656 -13.615-103.173 1.00 93.42 O
+ATOM 7454 NE2 GLN M 99 -25.395 -14.842-101.316 1.00 82.23 N
+ATOM 7455 H GLN M 99 -28.667 -16.524-105.610 1.00 0.00 H
+ATOM 7456 HA GLN M 99 -29.852 -15.686-103.041 1.00 0.00 H
+ATOM 7457 1HB GLN M 99 -27.583 -14.683-104.763 1.00 0.00 H
+ATOM 7458 2HB GLN M 99 -28.279 -13.645-103.528 1.00 0.00 H
+ATOM 7459 1HG GLN M 99 -27.837 -15.477-101.859 1.00 0.00 H
+ATOM 7460 2HG GLN M 99 -26.924 -16.313-103.147 1.00 0.00 H
+ATOM 7461 1HE2 GLN M 99 -24.577 -14.334-101.042 1.00 0.00 H
+ATOM 7462 2HE2 GLN M 99 -25.733 -15.590-100.745 1.00 0.00 H
+ATOM 7463 N ASP M 100 -30.953 -13.469-103.705 1.00 87.18 N
+ATOM 7464 CA ASP M 100 -31.803 -12.345-104.094 1.00 97.99 C
+ATOM 7465 C ASP M 100 -30.878 -11.190-104.462 1.00106.75 C
+ATOM 7466 O ASP M 100 -30.564 -10.312-103.655 1.00119.22 O
+ATOM 7467 CB ASP M 100 -32.760 -11.981-102.967 1.00110.04 C
+ATOM 7468 CG ASP M 100 -33.866 -11.038-103.407 1.00123.18 C
+ATOM 7469 OD1 ASP M 100 -33.783 -10.486-104.525 1.00132.28 O
+ATOM 7470 OD2 ASP M 100 -34.818 -10.843-102.622 1.00124.09 O
+ATOM 7471 H ASP M 100 -30.699 -13.581-102.734 1.00 0.00 H
+ATOM 7472 HA ASP M 100 -32.389 -12.639-104.965 1.00 0.00 H
+ATOM 7473 1HB ASP M 100 -33.215 -12.888-102.569 1.00 0.00 H
+ATOM 7474 2HB ASP M 100 -32.204 -11.510-102.156 1.00 0.00 H
+ATOM 7475 N CYS M 101 -30.427 -11.209-105.716 1.00 90.74 N
+ATOM 7476 CA CYS M 101 -29.393 -10.278-106.148 1.00 98.03 C
+ATOM 7477 C CYS M 101 -29.894 -8.839-106.163 1.00 96.30 C
+ATOM 7478 O CYS M 101 -29.113 -7.911-105.924 1.00 98.30 O
+ATOM 7479 CB CYS M 101 -28.881 -10.692-107.527 1.00113.85 C
+ATOM 7480 SG CYS M 101 -27.397 -9.835-108.088 1.00147.97 S
+ATOM 7481 H CYS M 101 -30.800 -11.872-106.380 1.00 0.00 H
+ATOM 7482 HA CYS M 101 -28.570 -10.319-105.434 1.00 0.00 H
+ATOM 7483 1HB CYS M 101 -28.660 -11.760-107.528 1.00 0.00 H
+ATOM 7484 2HB CYS M 101 -29.658 -10.518-108.271 1.00 0.00 H
+ATOM 7485 N SER M 102 -31.190 -8.636-106.418 1.00118.61 N
+ATOM 7486 CA SER M 102 -31.745 -7.288-106.501 1.00114.84 C
+ATOM 7487 C SER M 102 -31.731 -6.559-105.163 1.00105.47 C
+ATOM 7488 O SER M 102 -31.849 -5.329-105.142 1.00109.57 O
+ATOM 7489 CB SER M 102 -33.170 -7.346-107.055 1.00121.29 C
+ATOM 7490 OG SER M 102 -33.945 -8.314-106.368 1.00128.17 O
+ATOM 7491 H SER M 102 -31.800 -9.429-106.557 1.00 0.00 H
+ATOM 7492 HA SER M 102 -31.125 -6.700-107.179 1.00 0.00 H
+ATOM 7493 1HB SER M 102 -33.638 -6.367-106.958 1.00 0.00 H
+ATOM 7494 2HB SER M 102 -33.138 -7.589-108.116 1.00 0.00 H
+ATOM 7495 HG SER M 102 -33.363 -8.700-105.709 1.00 0.00 H
+ATOM 7496 N SER M 103 -31.594 -7.279-104.050 1.00103.53 N
+ATOM 7497 CA SER M 103 -31.483 -6.650-102.741 1.00120.01 C
+ATOM 7498 C SER M 103 -30.049 -6.551-102.246 1.00104.61 C
+ATOM 7499 O SER M 103 -29.784 -5.784-101.316 1.00107.09 O
+ATOM 7500 CB SER M 103 -32.311 -7.420-101.705 1.00105.37 C
+ATOM 7501 OG SER M 103 -31.819 -8.737-101.546 1.00101.05 O
+ATOM 7502 H SER M 103 -31.566 -8.286-104.116 1.00 0.00 H
+ATOM 7503 HA SER M 103 -31.871 -5.633-102.812 1.00 0.00 H
+ATOM 7504 1HB SER M 103 -32.277 -6.896-100.750 1.00 0.00 H
+ATOM 7505 2HB SER M 103 -33.352 -7.452-102.023 1.00 0.00 H
+ATOM 7506 HG SER M 103 -31.072 -8.814-102.144 1.00 0.00 H
+ATOM 7507 N LYS M 104 -29.125 -7.291-102.852 1.00101.18 N
+ATOM 7508 CA LYS M 104 -27.748 -7.355-102.388 1.00106.19 C
+ATOM 7509 C LYS M 104 -26.803 -6.423-103.133 1.00106.57 C
+ATOM 7510 O LYS M 104 -25.702 -6.163-102.635 1.00111.94 O
+ATOM 7511 CB LYS M 104 -27.211 -8.784-102.520 1.00 99.06 C
+ATOM 7512 CG LYS M 104 -27.855 -9.796-101.600 1.00 99.46 C
+ATOM 7513 CD LYS M 104 -27.141 -11.138-101.684 1.00100.91 C
+ATOM 7514 CE LYS M 104 -25.736 -11.072-101.095 1.00106.52 C
+ATOM 7515 NZ LYS M 104 -24.713 -10.562-102.053 1.00107.27 N
+ATOM 7516 H LYS M 104 -29.396 -7.826-103.664 1.00 0.00 H
+ATOM 7517 HA LYS M 104 -27.723 -7.066-101.337 1.00 0.00 H
+ATOM 7518 1HB LYS M 104 -27.353 -9.133-103.543 1.00 0.00 H
+ATOM 7519 2HB LYS M 104 -26.140 -8.790-102.317 1.00 0.00 H
+ATOM 7520 1HG LYS M 104 -27.814 -9.432-100.573 1.00 0.00 H
+ATOM 7521 2HG LYS M 104 -28.900 -9.928-101.879 1.00 0.00 H
+ATOM 7522 1HD LYS M 104 -27.714 -11.890-101.140 1.00 0.00 H
+ATOM 7523 2HD LYS M 104 -27.068 -11.447-102.727 1.00 0.00 H
+ATOM 7524 1HE LYS M 104 -25.737 -10.418-100.224 1.00 0.00 H
+ATOM 7525 2HE LYS M 104 -25.429 -12.067-100.774 1.00 0.00 H
+ATOM 7526 1HZ LYS M 104 -23.809 -10.544-101.603 1.00 0.00 H
+ATOM 7527 2HZ LYS M 104 -24.675 -11.169-102.860 1.00 0.00 H
+ATOM 7528 3HZ LYS M 104 -24.961 -9.628-102.346 1.00 0.00 H
+ATOM 7529 N ALA M 105 -27.183 -5.931-104.310 1.00103.27 N
+ATOM 7530 CA ALA M 105 -26.251 -5.155-105.113 1.00105.09 C
+ATOM 7531 C ALA M 105 -27.008 -4.202-106.026 1.00108.49 C
+ATOM 7532 O ALA M 105 -28.231 -4.271-106.169 1.00110.71 O
+ATOM 7533 CB ALA M 105 -25.332 -6.062-105.936 1.00101.84 C
+ATOM 7534 H ALA M 105 -28.118 -6.090-104.658 1.00 0.00 H
+ATOM 7535 HA ALA M 105 -25.634 -4.562-104.438 1.00 0.00 H
+ATOM 7536 1HB ALA M 105 -24.648 -5.450-106.524 1.00 0.00 H
+ATOM 7537 2HB ALA M 105 -24.760 -6.704-105.266 1.00 0.00 H
+ATOM 7538 3HB ALA M 105 -25.932 -6.678-106.603 1.00 0.00 H
+ATOM 7539 N ASN M 106 -26.238 -3.321-106.659 1.00111.16 N
+ATOM 7540 CA ASN M 106 -26.745 -2.272-107.536 1.00131.09 C
+ATOM 7541 C ASN M 106 -26.753 -2.792-108.971 1.00113.47 C
+ATOM 7542 O ASN M 106 -25.694 -3.030-109.561 1.00115.39 O
+ATOM 7543 CB ASN M 106 -25.872 -1.032-107.360 1.00139.70 C
+ATOM 7544 CG ASN M 106 -26.286 0.127-108.228 1.00164.77 C
+ATOM 7545 OD1 ASN M 106 -27.350 0.131-108.846 1.00125.04 O
+ATOM 7546 ND2 ASN M 106 -25.429 1.142-108.261 1.00219.93 N
+ATOM 7547 H ASN M 106 -25.242 -3.399-106.510 1.00 0.00 H
+ATOM 7548 HA ASN M 106 -27.771 -2.042-107.244 1.00 0.00 H
+ATOM 7549 1HB ASN M 106 -25.905 -0.708-106.319 1.00 0.00 H
+ATOM 7550 2HB ASN M 106 -24.836 -1.280-107.593 1.00 0.00 H
+ATOM 7551 1HD2 ASN M 106 -25.632 1.950-108.815 1.00 0.00 H
+ATOM 7552 2HD2 ASN M 106 -24.582 1.098-107.732 1.00 0.00 H
+ATOM 7553 N LEU M 107 -27.951 -2.980-109.531 1.00113.49 N
+ATOM 7554 CA LEU M 107 -28.124 -3.690-110.794 1.00114.62 C
+ATOM 7555 C LEU M 107 -28.493 -2.775-111.960 1.00115.17 C
+ATOM 7556 O LEU M 107 -28.930 -3.267-113.003 1.00113.94 O
+ATOM 7557 CB LEU M 107 -29.183 -4.783-110.642 1.00108.07 C
+ATOM 7558 CG LEU M 107 -28.765 -6.079-109.950 1.00103.31 C
+ATOM 7559 CD1 LEU M 107 -29.787 -7.176-110.201 1.00100.60 C
+ATOM 7560 CD2 LEU M 107 -27.391 -6.507-110.426 1.00101.19 C
+ATOM 7561 H LEU M 107 -28.764 -2.614-109.057 1.00 0.00 H
+ATOM 7562 HA LEU M 107 -27.176 -4.154-111.062 1.00 0.00 H
+ATOM 7563 1HB LEU M 107 -30.019 -4.380-110.074 1.00 0.00 H
+ATOM 7564 2HB LEU M 107 -29.543 -5.058-111.633 1.00 0.00 H
+ATOM 7565 HG LEU M 107 -28.736 -5.923-108.871 1.00 0.00 H
+ATOM 7566 1HD1 LEU M 107 -29.470 -8.090-109.699 1.00 0.00 H
+ATOM 7567 2HD1 LEU M 107 -30.757 -6.866-109.811 1.00 0.00 H
+ATOM 7568 3HD1 LEU M 107 -29.868 -7.360-111.272 1.00 0.00 H
+ATOM 7569 1HD2 LEU M 107 -27.104 -7.432-109.925 1.00 0.00 H
+ATOM 7570 2HD2 LEU M 107 -27.414 -6.670-111.504 1.00 0.00 H
+ATOM 7571 3HD2 LEU M 107 -26.666 -5.727-110.192 1.00 0.00 H
+ATOM 7572 N SER M 108 -28.325 -1.462-111.816 1.00124.83 N
+ATOM 7573 CA SER M 108 -28.670 -0.543-112.894 1.00132.37 C
+ATOM 7574 C SER M 108 -27.605 -0.560-113.983 1.00136.41 C
+ATOM 7575 O SER M 108 -26.408 -0.665-113.701 1.00143.24 O
+ATOM 7576 CB SER M 108 -28.846 0.877-112.360 1.00132.24 C
+ATOM 7577 OG SER M 108 -30.178 1.091-111.931 1.00136.36 O
+ATOM 7578 H SER M 108 -27.955 -1.091-110.953 1.00 0.00 H
+ATOM 7579 HA SER M 108 -29.614 -0.866-113.336 1.00 0.00 H
+ATOM 7580 1HB SER M 108 -28.161 1.041-111.529 1.00 0.00 H
+ATOM 7581 2HB SER M 108 -28.591 1.593-113.140 1.00 0.00 H
+ATOM 7582 HG SER M 108 -30.643 0.266-112.090 1.00 0.00 H
+ATOM 7583 N GLY M 109 -28.052 -0.450-115.233 1.00129.95 N
+ATOM 7584 CA GLY M 109 -27.141 -0.511-116.356 1.00129.20 C
+ATOM 7585 C GLY M 109 -26.557 -1.877-116.626 1.00126.93 C
+ATOM 7586 O GLY M 109 -25.554 -1.982-117.336 1.00134.79 O
+ATOM 7587 H GLY M 109 -29.039 -0.322-115.406 1.00 0.00 H
+ATOM 7588 1HA GLY M 109 -27.655 -0.184-117.260 1.00 0.00 H
+ATOM 7589 2HA GLY M 109 -26.313 0.178-116.191 1.00 0.00 H
+ATOM 7590 N GLY M 110 -27.159 -2.934-116.084 1.00133.50 N
+ATOM 7591 CA GLY M 110 -26.594 -4.268-116.222 1.00131.38 C
+ATOM 7592 C GLY M 110 -26.847 -4.835-117.605 1.00128.38 C
+ATOM 7593 O GLY M 110 -27.961 -4.745-118.133 1.00120.56 O
+ATOM 7594 H GLY M 110 -28.020 -2.815-115.569 1.00 0.00 H
+ATOM 7595 1HA GLY M 110 -25.521 -4.230-116.033 1.00 0.00 H
+ATOM 7596 2HA GLY M 110 -27.029 -4.927-115.472 1.00 0.00 H
+ATOM 7597 N VAL M 111 -25.811 -5.423-118.196 1.00133.03 N
+ATOM 7598 CA VAL M 111 -25.920 -6.013-119.526 1.00131.84 C
+ATOM 7599 C VAL M 111 -26.455 -7.434-119.396 1.00116.98 C
+ATOM 7600 O VAL M 111 -25.875 -8.268-118.693 1.00123.14 O
+ATOM 7601 CB VAL M 111 -24.572 -5.987-120.261 1.00143.44 C
+ATOM 7602 CG1 VAL M 111 -24.303 -4.599-120.816 1.00153.70 C
+ATOM 7603 CG2 VAL M 111 -23.444 -6.406-119.329 1.00150.49 C
+ATOM 7604 H VAL M 111 -24.926 -5.462-117.711 1.00 0.00 H
+ATOM 7605 HA VAL M 111 -26.636 -5.429-120.106 1.00 0.00 H
+ATOM 7606 HB VAL M 111 -24.615 -6.677-121.103 1.00 0.00 H
+ATOM 7607 1HG1 VAL M 111 -23.344 -4.594-121.335 1.00 0.00 H
+ATOM 7608 2HG1 VAL M 111 -25.094 -4.327-121.514 1.00 0.00 H
+ATOM 7609 3HG1 VAL M 111 -24.275 -3.879-119.998 1.00 0.00 H
+ATOM 7610 1HG2 VAL M 111 -22.498 -6.382-119.869 1.00 0.00 H
+ATOM 7611 2HG2 VAL M 111 -23.397 -5.720-118.483 1.00 0.00 H
+ATOM 7612 3HG2 VAL M 111 -23.628 -7.417-118.966 1.00 0.00 H
+ATOM 7613 N TRP M 112 -27.572 -7.706-120.067 1.00112.37 N
+ATOM 7614 CA TRP M 112 -28.170 -9.031-120.017 1.00110.85 C
+ATOM 7615 C TRP M 112 -27.267 -10.040-120.715 1.00104.26 C
+ATOM 7616 O TRP M 112 -26.797 -9.801-121.832 1.00112.92 O
+ATOM 7617 CB TRP M 112 -29.552 -9.023-120.669 1.00110.77 C
+ATOM 7618 CG TRP M 112 -30.531 -8.079-120.031 1.00113.12 C
+ATOM 7619 CD1 TRP M 112 -30.718 -6.761-120.334 1.00124.47 C
+ATOM 7620 CD2 TRP M 112 -31.453 -8.381-118.975 1.00112.76 C
+ATOM 7621 NE1 TRP M 112 -31.703 -6.227-119.539 1.00128.37 N
+ATOM 7622 CE2 TRP M 112 -32.168 -7.201-118.695 1.00120.36 C
+ATOM 7623 CE3 TRP M 112 -31.743 -9.536-118.242 1.00110.56 C
+ATOM 7624 CZ2 TRP M 112 -33.154 -7.142-117.713 1.00122.09 C
+ATOM 7625 CZ3 TRP M 112 -32.722 -9.475-117.267 1.00102.17 C
+ATOM 7626 CH2 TRP M 112 -33.415 -8.287-117.012 1.00113.22 C
+ATOM 7627 H TRP M 112 -28.015 -6.987-120.620 1.00 0.00 H
+ATOM 7628 HA TRP M 112 -28.281 -9.321-118.972 1.00 0.00 H
+ATOM 7629 1HB TRP M 112 -29.457 -8.748-121.720 1.00 0.00 H
+ATOM 7630 2HB TRP M 112 -29.978 -10.025-120.630 1.00 0.00 H
+ATOM 7631 HD1 TRP M 112 -30.166 -6.213-121.095 1.00 0.00 H
+ATOM 7632 HE1 TRP M 112 -32.031 -5.272-119.570 1.00 0.00 H
+ATOM 7633 HE3 TRP M 112 -31.210 -10.466-118.437 1.00 0.00 H
+ATOM 7634 HZ2 TRP M 112 -33.706 -6.226-117.501 1.00 0.00 H
+ATOM 7635 HZ3 TRP M 112 -32.940 -10.380-116.700 1.00 0.00 H
+ATOM 7636 HH2 TRP M 112 -34.180 -8.277-116.235 1.00 0.00 H
+ATOM 7637 N LYS M 113 -27.021 -11.166-120.053 1.00 90.68 N
+ATOM 7638 CA LYS M 113 -26.176 -12.225-120.584 1.00 88.72 C
+ATOM 7639 C LYS M 113 -27.044 -13.427-120.922 1.00 93.74 C
+ATOM 7640 O LYS M 113 -27.807 -13.902-120.074 1.00 85.39 O
+ATOM 7641 CB LYS M 113 -25.083 -12.611-119.586 1.00 96.44 C
+ATOM 7642 CG LYS M 113 -24.167 -11.464-119.181 1.00100.84 C
+ATOM 7643 CD LYS M 113 -23.339 -10.976-120.361 1.00109.36 C
+ATOM 7644 CE LYS M 113 -22.347 -9.903-119.936 1.00 0.00 C
+ATOM 7645 NZ LYS M 113 -21.570 -9.375-121.089 1.00 0.00 N
+ATOM 7646 H LYS M 113 -27.443 -11.283-119.143 1.00 0.00 H
+ATOM 7647 HA LYS M 113 -25.689 -11.859-121.489 1.00 0.00 H
+ATOM 7648 1HB LYS M 113 -25.542 -13.009-118.680 1.00 0.00 H
+ATOM 7649 2HB LYS M 113 -24.463 -13.400-120.012 1.00 0.00 H
+ATOM 7650 1HG LYS M 113 -24.766 -10.636-118.801 1.00 0.00 H
+ATOM 7651 2HG LYS M 113 -23.496 -11.797-118.390 1.00 0.00 H
+ATOM 7652 1HD LYS M 113 -22.792 -11.814-120.793 1.00 0.00 H
+ATOM 7653 2HD LYS M 113 -24.000 -10.564-121.123 1.00 0.00 H
+ATOM 7654 1HE LYS M 113 -22.882 -9.079-119.466 1.00 0.00 H
+ATOM 7655 2HE LYS M 113 -21.653 -10.319-119.206 1.00 0.00 H
+ATOM 7656 1HZ LYS M 113 -20.925 -8.668-120.766 1.00 0.00 H
+ATOM 7657 2HZ LYS M 113 -21.054 -10.129-121.521 1.00 0.00 H
+ATOM 7658 3HZ LYS M 113 -22.202 -8.970-121.765 1.00 0.00 H
+ATOM 7659 N ASP M 114 -26.935 -13.911-122.157 1.00104.76 N
+ATOM 7660 CA ASP M 114 -27.714 -15.065-122.583 1.00 99.61 C
+ATOM 7661 C ASP M 114 -27.112 -16.340-122.005 1.00 90.71 C
+ATOM 7662 O ASP M 114 -25.904 -16.574-122.109 1.00 89.81 O
+ATOM 7663 CB ASP M 114 -27.779 -15.138-124.107 1.00112.80 C
+ATOM 7664 CG ASP M 114 -28.723 -14.105-124.700 1.00129.92 C
+ATOM 7665 OD1 ASP M 114 -29.550 -13.552-123.946 1.00128.86 O
+ATOM 7666 OD2 ASP M 114 -28.643 -13.851-125.921 1.00139.40 O
+ATOM 7667 H ASP M 114 -26.303 -13.475-122.813 1.00 0.00 H
+ATOM 7668 HA ASP M 114 -28.728 -14.959-122.197 1.00 0.00 H
+ATOM 7669 1HB ASP M 114 -26.783 -14.984-124.522 1.00 0.00 H
+ATOM 7670 2HB ASP M 114 -28.109 -16.132-124.410 1.00 0.00 H
+ATOM 7671 N ASN M 115 -27.961 -17.159-121.392 1.00 84.71 N
+ATOM 7672 CA ASN M 115 -27.539 -18.369-120.688 1.00 79.66 C
+ATOM 7673 C ASN M 115 -27.684 -19.556-121.633 1.00 74.87 C
+ATOM 7674 O ASN M 115 -28.746 -20.174-121.723 1.00 70.99 O
+ATOM 7675 CB ASN M 115 -28.363 -18.555-119.420 1.00 82.43 C
+ATOM 7676 CG ASN M 115 -27.960 -19.782-118.636 1.00 79.16 C
+ATOM 7677 OD1 ASN M 115 -26.883 -20.343-118.842 1.00 87.63 O
+ATOM 7678 ND2 ASN M 115 -28.826 -20.209-117.726 1.00 72.68 N
+ATOM 7679 H ASN M 115 -28.943 -16.924-121.421 1.00 0.00 H
+ATOM 7680 HA ASN M 115 -26.489 -18.260-120.412 1.00 0.00 H
+ATOM 7681 1HB ASN M 115 -28.251 -17.678-118.781 1.00 0.00 H
+ATOM 7682 2HB ASN M 115 -29.418 -18.637-119.681 1.00 0.00 H
+ATOM 7683 1HD2 ASN M 115 -28.615 -21.017-117.175 1.00 0.00 H
+ATOM 7684 2HD2 ASN M 115 -29.689 -19.723-117.591 1.00 0.00 H
+ATOM 7685 N ILE M 116 -26.598 -19.884-122.329 1.00 74.69 N
+ATOM 7686 CA ILE M 116 -26.601 -20.987-123.287 1.00 77.01 C
+ATOM 7687 C ILE M 116 -26.391 -22.299-122.543 1.00 69.61 C
+ATOM 7688 O ILE M 116 -25.421 -22.449-121.790 1.00 74.30 O
+ATOM 7689 CB ILE M 116 -25.519 -20.781-124.359 1.00 72.96 C
+ATOM 7690 CG1 ILE M 116 -25.760 -19.473-125.116 1.00 74.66 C
+ATOM 7691 CG2 ILE M 116 -25.493 -21.957-125.319 1.00 70.74 C
+ATOM 7692 CD1 ILE M 116 -24.712 -19.168-126.166 1.00 82.74 C
+ATOM 7693 H ILE M 116 -25.749 -19.355-122.190 1.00 0.00 H
+ATOM 7694 HA ILE M 116 -27.573 -21.016-123.778 1.00 0.00 H
+ATOM 7695 HB ILE M 116 -24.544 -20.693-123.880 1.00 0.00 H
+ATOM 7696 1HG1 ILE M 116 -26.732 -19.511-125.607 1.00 0.00 H
+ATOM 7697 2HG1 ILE M 116 -25.783 -18.643-124.410 1.00 0.00 H
+ATOM 7698 1HG2 ILE M 116 -24.722 -21.795-126.072 1.00 0.00 H
+ATOM 7699 2HG2 ILE M 116 -25.276 -22.871-124.768 1.00 0.00 H
+ATOM 7700 3HG2 ILE M 116 -26.463 -22.050-125.807 1.00 0.00 H
+ATOM 7701 1HD1 ILE M 116 -24.953 -18.225-126.658 1.00 0.00 H
+ATOM 7702 2HD1 ILE M 116 -23.733 -19.090-125.691 1.00 0.00 H
+ATOM 7703 3HD1 ILE M 116 -24.694 -19.968-126.905 1.00 0.00 H
+ATOM 7704 N ASN M 117 -27.295 -23.255-122.758 1.00 66.83 N
+ATOM 7705 CA ASN M 117 -27.191 -24.544-122.086 1.00 67.36 C
+ATOM 7706 C ASN M 117 -25.888 -25.232-122.459 1.00 72.64 C
+ATOM 7707 O ASN M 117 -25.417 -25.142-123.595 1.00 92.33 O
+ATOM 7708 CB ASN M 117 -28.372 -25.446-122.449 1.00 65.03 C
+ATOM 7709 CG ASN M 117 -28.251 -26.837-121.842 1.00 68.50 C
+ATOM 7710 OD1 ASN M 117 -27.690 -27.748-122.452 1.00 72.84 O
+ATOM 7711 ND2 ASN M 117 -28.778 -27.003-120.633 1.00 73.83 N
+ATOM 7712 H ASN M 117 -28.064 -23.092-123.392 1.00 0.00 H
+ATOM 7713 HA ASN M 117 -27.205 -24.375-121.008 1.00 0.00 H
+ATOM 7714 1HB ASN M 117 -29.299 -24.989-122.102 1.00 0.00 H
+ATOM 7715 2HB ASN M 117 -28.439 -25.539-123.533 1.00 0.00 H
+ATOM 7716 1HD2 ASN M 117 -28.729 -27.896-120.184 1.00 0.00 H
+ATOM 7717 2HD2 ASN M 117 -29.224 -26.236-120.172 1.00 0.00 H
+ATOM 7718 N MET M 118 -25.306 -25.923-121.497 1.00 70.10 N
+ATOM 7719 CA MET M 118 -24.032 -26.590-121.707 1.00 80.78 C
+ATOM 7720 C MET M 118 -24.070 -28.068-121.369 1.00 78.06 C
+ATOM 7721 O MET M 118 -23.458 -28.874-122.078 1.00 85.84 O
+ATOM 7722 CB MET M 118 -22.951 -25.911-120.873 1.00 74.56 C
+ATOM 7723 CG MET M 118 -22.757 -24.431-121.155 1.00 81.78 C
+ATOM 7724 SD MET M 118 -22.020 -24.132-122.766 1.00 96.85 S
+ATOM 7725 CE MET M 118 -20.606 -25.230-122.698 1.00 94.54 C
+ATOM 7726 H MET M 118 -25.754 -25.991-120.594 1.00 0.00 H
+ATOM 7727 HA MET M 118 -23.769 -26.509-122.762 1.00 0.00 H
+ATOM 7728 1HB MET M 118 -23.189 -26.015-119.815 1.00 0.00 H
+ATOM 7729 2HB MET M 118 -21.994 -26.406-121.044 1.00 0.00 H
+ATOM 7730 1HG MET M 118 -23.720 -23.924-121.114 1.00 0.00 H
+ATOM 7731 2HG MET M 118 -22.111 -23.997-120.392 1.00 0.00 H
+ATOM 7732 1HE MET M 118 -20.045 -25.159-123.630 1.00 0.00 H
+ATOM 7733 2HE MET M 118 -19.964 -24.945-121.864 1.00 0.00 H
+ATOM 7734 3HE MET M 118 -20.948 -26.256-122.558 1.00 0.00 H
+ATOM 7735 N ALA M 119 -24.768 -28.447-120.301 1.00 62.55 N
+ATOM 7736 CA ALA M 119 -24.889 -29.848-119.936 1.00 61.90 C
+ATOM 7737 C ALA M 119 -26.307 -30.132-119.469 1.00 61.53 C
+ATOM 7738 O ALA M 119 -26.963 -29.275-118.866 1.00 61.14 O
+ATOM 7739 CB ALA M 119 -23.891 -30.237-118.841 1.00 74.21 C
+ATOM 7740 H ALA M 119 -25.224 -27.749-119.731 1.00 0.00 H
+ATOM 7741 HA ALA M 119 -24.676 -30.448-120.821 1.00 0.00 H
+ATOM 7742 1HB ALA M 119 -24.013 -31.292-118.596 1.00 0.00 H
+ATOM 7743 2HB ALA M 119 -22.875 -30.062-119.196 1.00 0.00 H
+ATOM 7744 3HB ALA M 119 -24.073 -29.635-117.952 1.00 0.00 H
+ATOM 7745 N LEU M 120 -26.766 -31.351-119.751 1.00 68.39 N
+ATOM 7746 CA LEU M 120 -28.094 -31.809-119.358 1.00 71.52 C
+ATOM 7747 C LEU M 120 -27.981 -33.269-118.945 1.00 79.32 C
+ATOM 7748 O LEU M 120 -27.539 -34.106-119.737 1.00 94.08 O
+ATOM 7749 CB LEU M 120 -29.101 -31.635-120.500 1.00 64.06 C
+ATOM 7750 CG LEU M 120 -30.570 -31.501-120.089 1.00 63.12 C
+ATOM 7751 CD1 LEU M 120 -30.763 -30.310-119.161 1.00 62.80 C
+ATOM 7752 CD2 LEU M 120 -31.450 -31.373-121.319 1.00 65.31 C
+ATOM 7753 H LEU M 120 -26.160 -31.978-120.260 1.00 0.00 H
+ATOM 7754 HA LEU M 120 -28.430 -31.210-118.512 1.00 0.00 H
+ATOM 7755 1HB LEU M 120 -28.836 -30.742-121.063 1.00 0.00 H
+ATOM 7756 2HB LEU M 120 -29.024 -32.495-121.165 1.00 0.00 H
+ATOM 7757 HG LEU M 120 -30.872 -32.384-119.525 1.00 0.00 H
+ATOM 7758 1HD1 LEU M 120 -31.814 -30.233-118.881 1.00 0.00 H
+ATOM 7759 2HD1 LEU M 120 -30.158 -30.446-118.264 1.00 0.00 H
+ATOM 7760 3HD1 LEU M 120 -30.456 -29.398-119.671 1.00 0.00 H
+ATOM 7761 1HD2 LEU M 120 -32.492 -31.279-121.013 1.00 0.00 H
+ATOM 7762 2HD2 LEU M 120 -31.157 -30.489-121.885 1.00 0.00 H
+ATOM 7763 3HD2 LEU M 120 -31.334 -32.259-121.943 1.00 0.00 H
+ATOM 7764 N VAL M 121 -28.358 -33.565-117.702 1.00 74.88 N
+ATOM 7765 CA VAL M 121 -28.184 -34.885-117.107 1.00 73.89 C
+ATOM 7766 C VAL M 121 -29.446 -35.226-116.326 1.00 80.94 C
+ATOM 7767 O VAL M 121 -30.136 -34.340-115.819 1.00 88.65 O
+ATOM 7768 CB VAL M 121 -26.938 -34.931-116.187 1.00 77.26 C
+ATOM 7769 CG1 VAL M 121 -26.770 -36.301-115.557 1.00 92.52 C
+ATOM 7770 CG2 VAL M 121 -25.679 -34.543-116.954 1.00 77.93 C
+ATOM 7771 H VAL M 121 -28.784 -32.831-117.155 1.00 0.00 H
+ATOM 7772 HA VAL M 121 -28.042 -35.610-117.909 1.00 0.00 H
+ATOM 7773 HB VAL M 121 -27.081 -34.232-115.363 1.00 0.00 H
+ATOM 7774 1HG1 VAL M 121 -25.887 -36.301-114.917 1.00 0.00 H
+ATOM 7775 2HG1 VAL M 121 -27.651 -36.537-114.960 1.00 0.00 H
+ATOM 7776 3HG1 VAL M 121 -26.650 -37.049-116.340 1.00 0.00 H
+ATOM 7777 1HG2 VAL M 121 -24.819 -34.583-116.286 1.00 0.00 H
+ATOM 7778 2HG2 VAL M 121 -25.528 -35.237-117.781 1.00 0.00 H
+ATOM 7779 3HG2 VAL M 121 -25.788 -33.531-117.345 1.00 0.00 H
+ATOM 7780 N VAL M 122 -29.759 -36.517-116.237 1.00 86.47 N
+ATOM 7781 CA VAL M 122 -30.881 -37.003-115.440 1.00 93.72 C
+ATOM 7782 C VAL M 122 -30.354 -37.991-114.408 1.00103.25 C
+ATOM 7783 O VAL M 122 -29.588 -38.900-114.745 1.00107.35 O
+ATOM 7784 CB VAL M 122 -31.969 -37.649-116.317 1.00 88.22 C
+ATOM 7785 CG1 VAL M 122 -32.954 -38.421-115.458 1.00 85.00 C
+ATOM 7786 CG2 VAL M 122 -32.696 -36.581-117.114 1.00 89.02 C
+ATOM 7787 H VAL M 122 -29.192 -37.181-116.745 1.00 0.00 H
+ATOM 7788 HA VAL M 122 -31.328 -36.156-114.919 1.00 0.00 H
+ATOM 7789 HB VAL M 122 -31.499 -38.356-117.001 1.00 0.00 H
+ATOM 7790 1HG1 VAL M 122 -33.716 -38.872-116.094 1.00 0.00 H
+ATOM 7791 2HG1 VAL M 122 -32.426 -39.204-114.914 1.00 0.00 H
+ATOM 7792 3HG1 VAL M 122 -33.429 -37.742-114.749 1.00 0.00 H
+ATOM 7793 1HG2 VAL M 122 -33.463 -37.047-117.732 1.00 0.00 H
+ATOM 7794 2HG2 VAL M 122 -33.162 -35.871-116.431 1.00 0.00 H
+ATOM 7795 3HG2 VAL M 122 -31.985 -36.057-117.753 1.00 0.00 H
+ATOM 7796 N ASP M 123 -30.764 -37.806-113.154 1.00105.10 N
+ATOM 7797 CA ASP M 123 -30.352 -38.657-112.045 1.00101.53 C
+ATOM 7798 C ASP M 123 -31.526 -39.525-111.613 1.00 99.53 C
+ATOM 7799 O ASP M 123 -32.637 -39.020-111.410 1.00 93.50 O
+ATOM 7800 CB ASP M 123 -29.852 -37.822-110.864 1.00112.45 C
+ATOM 7801 CG ASP M 123 -29.781 -38.619-109.570 1.00137.57 C
+ATOM 7802 OD1 ASP M 123 -29.344 -39.790-109.608 1.00141.04 O
+ATOM 7803 OD2 ASP M 123 -30.170 -38.077-108.513 1.00151.93 O
+ATOM 7804 H ASP M 123 -31.391 -37.035-112.976 1.00 0.00 H
+ATOM 7805 HA ASP M 123 -29.535 -39.295-112.383 1.00 0.00 H
+ATOM 7806 1HB ASP M 123 -28.860 -37.430-111.089 1.00 0.00 H
+ATOM 7807 2HB ASP M 123 -30.515 -36.969-110.715 1.00 0.00 H
+ATOM 7808 N THR M 124 -31.269 -40.826-111.466 1.00107.45 N
+ATOM 7809 CA THR M 124 -32.277 -41.791-111.054 1.00112.65 C
+ATOM 7810 C THR M 124 -31.885 -42.567-109.803 1.00116.37 C
+ATOM 7811 O THR M 124 -32.711 -43.329-109.284 1.00112.16 O
+ATOM 7812 CB THR M 124 -32.563 -42.779-112.199 1.00115.15 C
+ATOM 7813 OG1 THR M 124 -32.568 -42.067-113.441 1.00114.98 O
+ATOM 7814 CG2 THR M 124 -33.923 -43.446-112.024 1.00121.41 C
+ATOM 7815 H THR M 124 -30.329 -41.145-111.652 1.00 0.00 H
+ATOM 7816 HA THR M 124 -33.195 -41.253-110.817 1.00 0.00 H
+ATOM 7817 HB THR M 124 -31.793 -43.550-112.215 1.00 0.00 H
+ATOM 7818 HG1 THR M 124 -32.392 -41.137-113.277 1.00 0.00 H
+ATOM 7819 1HG2 THR M 124 -34.097 -44.139-112.847 1.00 0.00 H
+ATOM 7820 2HG2 THR M 124 -33.942 -43.991-111.080 1.00 0.00 H
+ATOM 7821 3HG2 THR M 124 -34.703 -42.686-112.019 1.00 0.00 H
+ATOM 7822 N TYR M 125 -30.661 -42.393-109.301 1.00123.41 N
+ATOM 7823 CA TYR M 125 -30.235 -43.109-108.103 1.00132.25 C
+ATOM 7824 C TYR M 125 -31.166 -42.815-106.933 1.00138.64 C
+ATOM 7825 O TYR M 125 -31.809 -43.719-106.387 1.00142.50 O
+ATOM 7826 CB TYR M 125 -28.795 -42.738-107.749 1.00133.35 C
+ATOM 7827 CG TYR M 125 -28.195 -43.666-106.723 1.00143.36 C
+ATOM 7828 CD1 TYR M 125 -28.559 -45.006-106.683 1.00143.26 C
+ATOM 7829 CD2 TYR M 125 -27.298 -43.199-105.771 1.00150.15 C
+ATOM 7830 CE1 TYR M 125 -28.028 -45.862-105.744 1.00152.78 C
+ATOM 7831 CE2 TYR M 125 -26.762 -44.049-104.822 1.00156.37 C
+ATOM 7832 CZ TYR M 125 -27.131 -45.381-104.815 1.00161.10 C
+ATOM 7833 OH TYR M 125 -26.608 -46.240-103.877 1.00166.55 O
+ATOM 7834 H TYR M 125 -30.016 -41.759-109.751 1.00 0.00 H
+ATOM 7835 HA TYR M 125 -30.282 -44.179-108.305 1.00 0.00 H
+ATOM 7836 1HB TYR M 125 -28.180 -42.764-108.650 1.00 0.00 H
+ATOM 7837 2HB TYR M 125 -28.766 -41.720-107.362 1.00 0.00 H
+ATOM 7838 HD1 TYR M 125 -29.277 -45.397-107.404 1.00 0.00 H
+ATOM 7839 HD2 TYR M 125 -27.008 -42.148-105.765 1.00 0.00 H
+ATOM 7840 HE1 TYR M 125 -28.328 -46.910-105.731 1.00 0.00 H
+ATOM 7841 HE2 TYR M 125 -26.054 -43.667-104.086 1.00 0.00 H
+ATOM 7842 HH TYR M 125 -26.006 -45.759-103.304 1.00 0.00 H
+ATOM 7843 N TYR M 126 -31.252 -41.547-106.534 1.00137.26 N
+ATOM 7844 CA TYR M 126 -32.183 -41.145-105.488 1.00136.56 C
+ATOM 7845 C TYR M 126 -33.493 -40.690-106.114 1.00121.03 C
+ATOM 7846 O TYR M 126 -34.002 -41.336-107.036 1.00115.01 O
+ATOM 7847 CB TYR M 126 -31.577 -40.037-104.625 1.00148.38 C
+ATOM 7848 CG TYR M 126 -30.393 -40.492-103.802 1.00160.11 C
+ATOM 7849 CD1 TYR M 126 -30.399 -41.729-103.171 1.00165.93 C
+ATOM 7850 CD2 TYR M 126 -29.271 -39.684-103.655 1.00161.69 C
+ATOM 7851 CE1 TYR M 126 -29.321 -42.153-102.419 1.00168.84 C
+ATOM 7852 CE2 TYR M 126 -28.187 -40.099-102.903 1.00164.96 C
+ATOM 7853 CZ TYR M 126 -28.218 -41.334-102.287 1.00169.62 C
+ATOM 7854 OH TYR M 126 -27.142 -41.752-101.537 1.00171.18 O
+ATOM 7855 H TYR M 126 -30.662 -40.848-106.963 1.00 0.00 H
+ATOM 7856 HA TYR M 126 -32.385 -42.009-104.854 1.00 0.00 H
+ATOM 7857 1HB TYR M 126 -31.255 -39.213-105.264 1.00 0.00 H
+ATOM 7858 2HB TYR M 126 -32.336 -39.648-103.947 1.00 0.00 H
+ATOM 7859 HD1 TYR M 126 -31.265 -42.385-103.265 1.00 0.00 H
+ATOM 7860 HD2 TYR M 126 -29.237 -38.706-104.136 1.00 0.00 H
+ATOM 7861 HE1 TYR M 126 -29.346 -43.127-101.932 1.00 0.00 H
+ATOM 7862 HE2 TYR M 126 -27.316 -39.452-102.799 1.00 0.00 H
+ATOM 7863 HH TYR M 126 -26.464 -41.073-101.546 1.00 0.00 H
+ATOM 7864 N ASP M 127 -34.049 -39.587-105.622 1.00120.33 N
+ATOM 7865 CA ASP M 127 -35.222 -39.001-106.254 1.00120.63 C
+ATOM 7866 C ASP M 127 -34.856 -38.514-107.651 1.00113.83 C
+ATOM 7867 O ASP M 127 -33.911 -37.736-107.815 1.00111.63 O
+ATOM 7868 CB ASP M 127 -35.773 -37.843-105.418 1.00119.95 C
+ATOM 7869 CG ASP M 127 -36.393 -38.302-104.106 1.00 0.00 C
+ATOM 7870 OD1 ASP M 127 -36.620 -39.480-103.958 1.00 0.00 O
+ATOM 7871 OD2 ASP M 127 -36.634 -37.471-103.263 1.00 0.00 O
+ATOM 7872 H ASP M 127 -33.660 -39.145-104.802 1.00 0.00 H
+ATOM 7873 HA ASP M 127 -35.991 -39.769-106.335 1.00 0.00 H
+ATOM 7874 1HB ASP M 127 -34.971 -37.139-105.198 1.00 0.00 H
+ATOM 7875 2HB ASP M 127 -36.530 -37.308-105.993 1.00 0.00 H
+ATOM 7876 N ASP M 128 -35.594 -38.987-108.656 1.00108.38 N
+ATOM 7877 CA ASP M 128 -35.278 -38.664-110.042 1.00105.30 C
+ATOM 7878 C ASP M 128 -35.321 -37.157-110.263 1.00 97.18 C
+ATOM 7879 O ASP M 128 -36.256 -36.480-109.828 1.00 97.26 O
+ATOM 7880 CB ASP M 128 -36.252 -39.371-110.987 1.00117.80 C
+ATOM 7881 CG ASP M 128 -36.252 -40.884-110.808 1.00131.39 C
+ATOM 7882 OD1 ASP M 128 -35.880 -41.361-109.714 1.00143.07 O
+ATOM 7883 OD2 ASP M 128 -36.626 -41.596-111.766 1.00120.64 O
+ATOM 7884 H ASP M 128 -36.387 -39.580-108.458 1.00 0.00 H
+ATOM 7885 HA ASP M 128 -34.267 -39.012-110.257 1.00 0.00 H
+ATOM 7886 1HB ASP M 128 -37.262 -38.998-110.815 1.00 0.00 H
+ATOM 7887 2HB ASP M 128 -35.989 -39.140-112.020 1.00 0.00 H
+ATOM 7888 N GLN M 129 -34.297 -36.632-110.936 1.00 90.04 N
+ATOM 7889 CA GLN M 129 -34.161 -35.190-111.097 1.00 81.28 C
+ATOM 7890 C GLN M 129 -33.386 -34.883-112.372 1.00 88.89 C
+ATOM 7891 O GLN M 129 -32.846 -35.775-113.030 1.00100.61 O
+ATOM 7892 CB GLN M 129 -33.478 -34.561-109.879 1.00 83.20 C
+ATOM 7893 CG GLN M 129 -32.142 -35.192-109.526 1.00 91.19 C
+ATOM 7894 CD GLN M 129 -31.688 -34.851-108.119 1.00100.26 C
+ATOM 7895 OE1 GLN M 129 -32.474 -34.382-107.295 1.00107.56 O
+ATOM 7896 NE2 GLN M 129 -30.414 -35.092-107.836 1.00102.05 N
+ATOM 7897 H GLN M 129 -33.601 -37.240-111.343 1.00 0.00 H
+ATOM 7898 HA GLN M 129 -35.157 -34.757-111.193 1.00 0.00 H
+ATOM 7899 1HB GLN M 129 -33.313 -33.499-110.062 1.00 0.00 H
+ATOM 7900 2HB GLN M 129 -34.132 -34.645-109.011 1.00 0.00 H
+ATOM 7901 1HG GLN M 129 -32.233 -36.276-109.601 1.00 0.00 H
+ATOM 7902 2HG GLN M 129 -31.386 -34.832-110.224 1.00 0.00 H
+ATOM 7903 1HE2 GLN M 129 -30.056 -34.888-106.924 1.00 0.00 H
+ATOM 7904 2HE2 GLN M 129 -29.811 -35.478-108.534 1.00 0.00 H
+ATOM 7905 N LEU M 130 -33.330 -33.593-112.705 1.00 89.43 N
+ATOM 7906 CA LEU M 130 -32.726 -33.104-113.941 1.00 78.06 C
+ATOM 7907 C LEU M 130 -31.701 -32.034-113.588 1.00 82.21 C
+ATOM 7908 O LEU M 130 -32.065 -30.949-113.123 1.00 94.15 O
+ATOM 7909 CB LEU M 130 -33.793 -32.550-114.887 1.00 68.01 C
+ATOM 7910 CG LEU M 130 -33.332 -31.883-116.186 1.00 78.72 C
+ATOM 7911 CD1 LEU M 130 -32.608 -32.869-117.085 1.00 84.08 C
+ATOM 7912 CD2 LEU M 130 -34.508 -31.266-116.924 1.00 81.16 C
+ATOM 7913 H LEU M 130 -33.731 -32.930-112.057 1.00 0.00 H
+ATOM 7914 HA LEU M 130 -32.226 -33.937-114.435 1.00 0.00 H
+ATOM 7915 1HB LEU M 130 -34.456 -33.364-115.178 1.00 0.00 H
+ATOM 7916 2HB LEU M 130 -34.380 -31.805-114.350 1.00 0.00 H
+ATOM 7917 HG LEU M 130 -32.611 -31.098-115.956 1.00 0.00 H
+ATOM 7918 1HD1 LEU M 130 -32.293 -32.365-117.999 1.00 0.00 H
+ATOM 7919 2HD1 LEU M 130 -31.732 -33.259-116.566 1.00 0.00 H
+ATOM 7920 3HD1 LEU M 130 -33.277 -33.691-117.337 1.00 0.00 H
+ATOM 7921 1HD2 LEU M 130 -34.155 -30.797-117.843 1.00 0.00 H
+ATOM 7922 2HD2 LEU M 130 -35.233 -32.043-117.168 1.00 0.00 H
+ATOM 7923 3HD2 LEU M 130 -34.981 -30.514-116.292 1.00 0.00 H
+ATOM 7924 N ILE M 131 -30.426 -32.338-113.807 1.00 73.47 N
+ATOM 7925 CA ILE M 131 -29.331 -31.408-113.557 1.00 76.78 C
+ATOM 7926 C ILE M 131 -28.990 -30.696-114.861 1.00 71.97 C
+ATOM 7927 O ILE M 131 -28.664 -31.342-115.866 1.00 74.41 O
+ATOM 7928 CB ILE M 131 -28.102 -32.135-112.992 1.00 70.51 C
+ATOM 7929 CG1 ILE M 131 -28.459 -32.848-111.686 1.00 71.19 C
+ATOM 7930 CG2 ILE M 131 -26.950 -31.163-112.786 1.00 64.34 C
+ATOM 7931 CD1 ILE M 131 -27.323 -33.667-111.107 1.00 72.99 C
+ATOM 7932 H ILE M 131 -30.217 -33.260-114.164 1.00 0.00 H
+ATOM 7933 HA ILE M 131 -29.661 -30.674-112.823 1.00 0.00 H
+ATOM 7934 HB ILE M 131 -27.787 -32.912-113.688 1.00 0.00 H
+ATOM 7935 1HG1 ILE M 131 -28.764 -32.113-110.942 1.00 0.00 H
+ATOM 7936 2HG1 ILE M 131 -29.307 -33.513-111.854 1.00 0.00 H
+ATOM 7937 1HG2 ILE M 131 -26.090 -31.698-112.385 1.00 0.00 H
+ATOM 7938 2HG2 ILE M 131 -26.682 -30.709-113.739 1.00 0.00 H
+ATOM 7939 3HG2 ILE M 131 -27.252 -30.384-112.085 1.00 0.00 H
+ATOM 7940 1HD1 ILE M 131 -27.652 -34.143-110.183 1.00 0.00 H
+ATOM 7941 2HD1 ILE M 131 -27.025 -34.433-111.823 1.00 0.00 H
+ATOM 7942 3HD1 ILE M 131 -26.475 -33.016-110.898 1.00 0.00 H
+ATOM 7943 N SER M 132 -29.051 -29.367-114.843 1.00 68.87 N
+ATOM 7944 CA SER M 132 -28.716 -28.536-115.988 1.00 65.53 C
+ATOM 7945 C SER M 132 -27.566 -27.611-115.624 1.00 68.28 C
+ATOM 7946 O SER M 132 -27.567 -26.996-114.553 1.00 78.52 O
+ATOM 7947 CB SER M 132 -29.916 -27.706-116.444 1.00 72.00 C
+ATOM 7948 OG SER M 132 -30.180 -26.659-115.525 1.00 84.02 O
+ATOM 7949 H SER M 132 -29.347 -28.925-113.984 1.00 0.00 H
+ATOM 7950 HA SER M 132 -28.418 -29.186-116.812 1.00 0.00 H
+ATOM 7951 1HB SER M 132 -29.716 -27.289-117.431 1.00 0.00 H
+ATOM 7952 2HB SER M 132 -30.791 -28.349-116.532 1.00 0.00 H
+ATOM 7953 HG SER M 132 -29.520 -26.742-114.833 1.00 0.00 H
+ATOM 7954 N CYS M 133 -26.589 -27.510-116.520 1.00 71.04 N
+ATOM 7955 CA CYS M 133 -25.463 -26.603-116.352 1.00 74.46 C
+ATOM 7956 C CYS M 133 -25.453 -25.637-117.528 1.00 86.03 C
+ATOM 7957 O CYS M 133 -25.410 -26.067-118.687 1.00107.81 O
+ATOM 7958 CB CYS M 133 -24.146 -27.375-116.263 1.00 90.89 C
+ATOM 7959 SG CYS M 133 -24.131 -28.691-115.012 1.00116.23 S
+ATOM 7960 H CYS M 133 -26.636 -28.088-117.347 1.00 0.00 H
+ATOM 7961 HA CYS M 133 -25.601 -26.049-115.423 1.00 0.00 H
+ATOM 7962 1HB CYS M 133 -23.924 -27.829-117.229 1.00 0.00 H
+ATOM 7963 2HB CYS M 133 -23.335 -26.685-116.032 1.00 0.00 H
+ATOM 7964 N GLY M 134 -25.514 -24.338-117.227 1.00 77.54 N
+ATOM 7965 CA GLY M 134 -25.470 -23.303-118.235 1.00 68.49 C
+ATOM 7966 C GLY M 134 -24.101 -22.639-118.328 1.00 71.69 C
+ATOM 7967 O GLY M 134 -23.162 -22.964-117.604 1.00 84.82 O
+ATOM 7968 H GLY M 134 -25.594 -24.075-116.255 1.00 0.00 H
+ATOM 7969 1HA GLY M 134 -25.726 -23.729-119.205 1.00 0.00 H
+ATOM 7970 2HA GLY M 134 -26.219 -22.544-118.010 1.00 0.00 H
+ATOM 7971 N SER M 135 -24.011 -21.676-119.250 1.00 68.95 N
+ATOM 7972 CA SER M 135 -22.753 -20.994-119.535 1.00 70.95 C
+ATOM 7973 C SER M 135 -22.480 -19.828-118.595 1.00 81.76 C
+ATOM 7974 O SER M 135 -21.317 -19.562-118.270 1.00 89.07 O
+ATOM 7975 CB SER M 135 -22.746 -20.490-120.980 1.00 81.32 C
+ATOM 7976 OG SER M 135 -23.842 -19.625-121.235 1.00 82.09 O
+ATOM 7977 H SER M 135 -24.840 -21.414-119.764 1.00 0.00 H
+ATOM 7978 HA SER M 135 -21.936 -21.706-119.406 1.00 0.00 H
+ATOM 7979 1HB SER M 135 -21.814 -19.960-121.176 1.00 0.00 H
+ATOM 7980 2HB SER M 135 -22.789 -21.339-121.661 1.00 0.00 H
+ATOM 7981 HG SER M 135 -24.332 -19.569-120.411 1.00 0.00 H
+ATOM 7982 N VAL M 136 -23.522 -19.134-118.148 1.00 77.28 N
+ATOM 7983 CA VAL M 136 -23.374 -17.946-117.314 1.00 75.78 C
+ATOM 7984 C VAL M 136 -23.274 -18.336-115.846 1.00 85.32 C
+ATOM 7985 O VAL M 136 -23.339 -19.521-115.501 1.00 89.54 O
+ATOM 7986 CB VAL M 136 -24.551 -16.984-117.527 1.00 78.76 C
+ATOM 7987 CG1 VAL M 136 -24.651 -16.575-118.985 1.00 95.76 C
+ATOM 7988 CG2 VAL M 136 -25.822 -17.661-117.076 1.00 74.01 C
+ATOM 7989 H VAL M 136 -24.449 -19.446-118.399 1.00 0.00 H
+ATOM 7990 HA VAL M 136 -22.453 -17.436-117.599 1.00 0.00 H
+ATOM 7991 HB VAL M 136 -24.381 -16.081-116.941 1.00 0.00 H
+ATOM 7992 1HG1 VAL M 136 -25.492 -15.893-119.115 1.00 0.00 H
+ATOM 7993 2HG1 VAL M 136 -23.730 -16.077-119.287 1.00 0.00 H
+ATOM 7994 3HG1 VAL M 136 -24.805 -17.460-119.601 1.00 0.00 H
+ATOM 7995 1HG2 VAL M 136 -26.665 -16.986-117.222 1.00 0.00 H
+ATOM 7996 2HG2 VAL M 136 -25.978 -18.569-117.660 1.00 0.00 H
+ATOM 7997 3HG2 VAL M 136 -25.742 -17.918-116.020 1.00 0.00 H
+ATOM 7998 N ASN M 137 -23.132 -17.332-114.976 1.00 91.74 N
+ATOM 7999 CA ASN M 137 -23.128 -17.523-113.525 1.00 92.84 C
+ATOM 8000 C ASN M 137 -22.036 -18.501-113.098 1.00 82.30 C
+ATOM 8001 O ASN M 137 -22.283 -19.469-112.375 1.00 75.43 O
+ATOM 8002 CB ASN M 137 -24.501 -17.979-113.025 1.00113.65 C
+ATOM 8003 CG ASN M 137 -25.541 -16.879-113.100 1.00133.90 C
+ATOM 8004 OD1 ASN M 137 -25.215 -15.695-113.008 1.00140.41 O
+ATOM 8005 ND2 ASN M 137 -26.801 -17.265-113.268 1.00146.34 N
+ATOM 8006 H ASN M 137 -23.023 -16.400-115.350 1.00 0.00 H
+ATOM 8007 HA ASN M 137 -22.889 -16.570-113.051 1.00 0.00 H
+ATOM 8008 1HB ASN M 137 -24.842 -18.827-113.620 1.00 0.00 H
+ATOM 8009 2HB ASN M 137 -24.418 -18.316-111.992 1.00 0.00 H
+ATOM 8010 1HD2 ASN M 137 -27.530 -16.582-113.325 1.00 0.00 H
+ATOM 8011 2HD2 ASN M 137 -27.021 -18.238-113.338 1.00 0.00 H
+ATOM 8012 N ARG M 138 -20.815 -18.241-113.568 1.00 81.80 N
+ATOM 8013 CA ARG M 138 -19.632 -19.037-113.247 1.00 86.15 C
+ATOM 8014 C ARG M 138 -19.763 -20.489-113.698 1.00 90.85 C
+ATOM 8015 O ARG M 138 -19.018 -21.356-113.233 1.00 96.78 O
+ATOM 8016 CB ARG M 138 -19.367 -19.006-111.749 1.00 82.68 C
+ATOM 8017 CG ARG M 138 -19.100 -17.623-111.175 1.00 0.00 C
+ATOM 8018 CD ARG M 138 -18.733 -17.687-109.738 1.00 0.00 C
+ATOM 8019 NE ARG M 138 -18.463 -16.368-109.188 1.00 0.00 N
+ATOM 8020 CZ ARG M 138 -19.401 -15.541-108.686 1.00 0.00 C
+ATOM 8021 NH1 ARG M 138 -20.662 -15.911-108.672 1.00 0.00 N
+ATOM 8022 NH2 ARG M 138 -19.053 -14.359-108.209 1.00 0.00 N
+ATOM 8023 H ARG M 138 -20.720 -17.443-114.180 1.00 0.00 H
+ATOM 8024 HA ARG M 138 -18.782 -18.629-113.795 1.00 0.00 H
+ATOM 8025 1HB ARG M 138 -20.223 -19.422-111.220 1.00 0.00 H
+ATOM 8026 2HB ARG M 138 -18.504 -19.631-111.519 1.00 0.00 H
+ATOM 8027 1HG ARG M 138 -18.279 -17.156-111.719 1.00 0.00 H
+ATOM 8028 2HG ARG M 138 -19.996 -17.009-111.273 1.00 0.00 H
+ATOM 8029 1HD ARG M 138 -19.551 -18.130-109.172 1.00 0.00 H
+ATOM 8030 2HD ARG M 138 -17.837 -18.296-109.618 1.00 0.00 H
+ATOM 8031 HE ARG M 138 -17.503 -16.048-109.182 1.00 0.00 H
+ATOM 8032 1HH1 ARG M 138 -20.928 -16.814-109.036 1.00 0.00 H
+ATOM 8033 2HH1 ARG M 138 -21.365 -15.291-108.295 1.00 0.00 H
+ATOM 8034 1HH2 ARG M 138 -18.083 -14.075-108.220 1.00 0.00 H
+ATOM 8035 2HH2 ARG M 138 -19.755 -13.740-107.833 1.00 0.00 H
+ATOM 8036 N GLY M 139 -20.693 -20.773-114.605 1.00 90.22 N
+ATOM 8037 CA GLY M 139 -20.883 -22.137-115.068 1.00 78.99 C
+ATOM 8038 C GLY M 139 -21.317 -23.095-113.982 1.00 74.61 C
+ATOM 8039 O GLY M 139 -20.804 -24.219-113.906 1.00 78.98 O
+ATOM 8040 H GLY M 139 -21.277 -20.040-114.981 1.00 0.00 H
+ATOM 8041 1HA GLY M 139 -21.634 -22.152-115.858 1.00 0.00 H
+ATOM 8042 2HA GLY M 139 -19.954 -22.507-115.500 1.00 0.00 H
+ATOM 8043 N THR M 140 -22.248 -22.674-113.130 1.00 68.32 N
+ATOM 8044 CA THR M 140 -22.776 -23.537-112.086 1.00 67.04 C
+ATOM 8045 C THR M 140 -23.997 -24.296-112.593 1.00 65.62 C
+ATOM 8046 O THR M 140 -24.550 -24.004-113.654 1.00 67.97 O
+ATOM 8047 CB THR M 140 -23.135 -22.727-110.844 1.00 67.77 C
+ATOM 8048 OG1 THR M 140 -24.136 -21.758-111.177 1.00 68.22 O
+ATOM 8049 CG2 THR M 140 -21.904 -22.019-110.311 1.00 74.62 C
+ATOM 8050 H THR M 140 -22.597 -21.730-113.211 1.00 0.00 H
+ATOM 8051 HA THR M 140 -22.008 -24.263-111.816 1.00 0.00 H
+ATOM 8052 HB THR M 140 -23.530 -23.393-110.077 1.00 0.00 H
+ATOM 8053 HG1 THR M 140 -24.358 -21.835-112.108 1.00 0.00 H
+ATOM 8054 1HG2 THR M 140 -22.170 -21.444-109.424 1.00 0.00 H
+ATOM 8055 2HG2 THR M 140 -21.144 -22.756-110.051 1.00 0.00 H
+ATOM 8056 3HG2 THR M 140 -21.512 -21.348-111.074 1.00 0.00 H
+ATOM 8057 N CYS M 141 -24.421 -25.282-111.811 1.00 76.33 N
+ATOM 8058 CA CYS M 141 -25.500 -26.172-112.203 1.00 75.57 C
+ATOM 8059 C CYS M 141 -26.657 -26.067-111.220 1.00 72.57 C
+ATOM 8060 O CYS M 141 -26.509 -25.577-110.098 1.00 81.51 O
+ATOM 8061 CB CYS M 141 -25.009 -27.620-112.292 1.00 87.04 C
+ATOM 8062 SG CYS M 141 -23.506 -27.814-113.282 1.00108.93 S
+ATOM 8063 H CYS M 141 -23.976 -25.414-110.914 1.00 0.00 H
+ATOM 8064 HA CYS M 141 -25.859 -25.868-113.187 1.00 0.00 H
+ATOM 8065 1HB CYS M 141 -24.810 -27.999-111.289 1.00 0.00 H
+ATOM 8066 2HB CYS M 141 -25.790 -28.243-112.729 1.00 0.00 H
+ATOM 8067 N GLN M 142 -27.827 -26.517-111.674 1.00 65.43 N
+ATOM 8068 CA GLN M 142 -29.045 -26.520-110.877 1.00 68.89 C
+ATOM 8069 C GLN M 142 -29.786 -27.823-111.136 1.00 82.60 C
+ATOM 8070 O GLN M 142 -29.634 -28.433-112.196 1.00 83.28 O
+ATOM 8071 CB GLN M 142 -29.951 -25.326-111.218 1.00 77.64 C
+ATOM 8072 CG GLN M 142 -29.211 -24.056-111.616 1.00 99.62 C
+ATOM 8073 CD GLN M 142 -30.055 -23.138-112.478 1.00124.15 C
+ATOM 8074 OE1 GLN M 142 -31.262 -23.013-112.273 1.00128.20 O
+ATOM 8075 NE2 GLN M 142 -29.423 -22.500-113.461 1.00132.32 N
+ATOM 8076 H GLN M 142 -27.857 -26.871-112.620 1.00 0.00 H
+ATOM 8077 HA GLN M 142 -28.770 -26.445-109.825 1.00 0.00 H
+ATOM 8078 1HB GLN M 142 -30.613 -25.595-112.041 1.00 0.00 H
+ATOM 8079 2HB GLN M 142 -30.578 -25.088-110.359 1.00 0.00 H
+ATOM 8080 1HG GLN M 142 -28.930 -23.513-110.713 1.00 0.00 H
+ATOM 8081 2HG GLN M 142 -28.319 -24.329-112.180 1.00 0.00 H
+ATOM 8082 1HE2 GLN M 142 -29.929 -21.881-114.063 1.00 0.00 H
+ATOM 8083 2HE2 GLN M 142 -28.442 -22.639-113.599 1.00 0.00 H
+ATOM 8084 N ARG M 143 -30.593 -28.249-110.167 1.00 77.81 N
+ATOM 8085 CA ARG M 143 -31.345 -29.491-110.282 1.00 79.34 C
+ATOM 8086 C ARG M 143 -32.840 -29.227-110.137 1.00 72.01 C
+ATOM 8087 O ARG M 143 -33.264 -28.339-109.391 1.00 71.60 O
+ATOM 8088 CB ARG M 143 -30.878 -30.529-109.240 1.00 79.35 C
+ATOM 8089 CG ARG M 143 -31.089 -30.131-107.793 1.00 80.42 C
+ATOM 8090 CD ARG M 143 -30.322 -31.040-106.840 1.00 78.45 C
+ATOM 8091 NE ARG M 143 -30.568 -30.688-105.443 1.00 85.38 N
+ATOM 8092 CZ ARG M 143 -31.423 -31.325-104.650 1.00 96.48 C
+ATOM 8093 NH1 ARG M 143 -32.110 -32.364-105.109 1.00 98.09 N
+ATOM 8094 NH2 ARG M 143 -31.587 -30.930-103.394 1.00 98.50 N
+ATOM 8095 H ARG M 143 -30.685 -27.694-109.328 1.00 0.00 H
+ATOM 8096 HA ARG M 143 -31.177 -29.906-111.276 1.00 0.00 H
+ATOM 8097 1HB ARG M 143 -31.406 -31.468-109.400 1.00 0.00 H
+ATOM 8098 2HB ARG M 143 -29.814 -30.725-109.373 1.00 0.00 H
+ATOM 8099 1HG ARG M 143 -30.744 -29.108-107.643 1.00 0.00 H
+ATOM 8100 2HG ARG M 143 -32.150 -30.196-107.549 1.00 0.00 H
+ATOM 8101 1HD ARG M 143 -30.633 -32.073-106.993 1.00 0.00 H
+ATOM 8102 2HD ARG M 143 -29.254 -30.951-107.033 1.00 0.00 H
+ATOM 8103 HE ARG M 143 -30.053 -29.908-105.057 1.00 0.00 H
+ATOM 8104 1HH1 ARG M 143 -31.983 -32.672-106.063 1.00 0.00 H
+ATOM 8105 2HH1 ARG M 143 -32.759 -32.847-104.505 1.00 0.00 H
+ATOM 8106 1HH2 ARG M 143 -31.061 -30.143-103.039 1.00 0.00 H
+ATOM 8107 2HH2 ARG M 143 -32.237 -31.415-102.793 1.00 0.00 H
+ATOM 8108 N HIS M 144 -33.630 -30.006-110.877 1.00 79.58 N
+ATOM 8109 CA HIS M 144 -35.086 -29.915-110.894 1.00 91.70 C
+ATOM 8110 C HIS M 144 -35.642 -31.276-110.497 1.00106.61 C
+ATOM 8111 O HIS M 144 -35.334 -32.282-111.142 1.00114.89 O
+ATOM 8112 CB HIS M 144 -35.610 -29.522-112.283 1.00 96.08 C
+ATOM 8113 CG HIS M 144 -34.873 -28.385-112.929 1.00 92.75 C
+ATOM 8114 ND1 HIS M 144 -33.545 -28.464-113.294 1.00 93.13 N
+ATOM 8115 CD2 HIS M 144 -35.287 -27.149-113.296 1.00 80.71 C
+ATOM 8116 CE1 HIS M 144 -33.171 -27.323-113.844 1.00 78.58 C
+ATOM 8117 NE2 HIS M 144 -34.209 -26.507-113.858 1.00 69.65 N
+ATOM 8118 H HIS M 144 -33.173 -30.697-111.456 1.00 0.00 H
+ATOM 8119 HA HIS M 144 -35.411 -29.149-110.190 1.00 0.00 H
+ATOM 8120 1HB HIS M 144 -35.549 -30.381-112.952 1.00 0.00 H
+ATOM 8121 2HB HIS M 144 -36.660 -29.239-112.209 1.00 0.00 H
+ATOM 8122 HD2 HIS M 144 -36.288 -26.738-113.164 1.00 0.00 H
+ATOM 8123 HE1 HIS M 144 -32.175 -27.094-114.222 1.00 0.00 H
+ATOM 8124 HE2 HIS M 144 -34.215 -25.565-114.221 1.00 0.00 H
+ATOM 8125 N VAL M 145 -36.465 -31.315-109.452 1.00110.09 N
+ATOM 8126 CA VAL M 145 -36.955 -32.577-108.903 1.00107.36 C
+ATOM 8127 C VAL M 145 -38.320 -32.899-109.497 1.00106.70 C
+ATOM 8128 O VAL M 145 -39.140 -32.002-109.729 1.00110.47 O
+ATOM 8129 CB VAL M 145 -37.012 -32.526-107.365 1.00104.49 C
+ATOM 8130 CG1 VAL M 145 -37.180 -33.924-106.793 1.00104.36 C
+ATOM 8131 CG2 VAL M 145 -35.752 -31.874-106.817 1.00 97.15 C
+ATOM 8132 H VAL M 145 -36.758 -30.447-109.027 1.00 0.00 H
+ATOM 8133 HA VAL M 145 -36.268 -33.372-109.195 1.00 0.00 H
+ATOM 8134 HB VAL M 145 -37.883 -31.944-107.062 1.00 0.00 H
+ATOM 8135 1HG1 VAL M 145 -37.219 -33.870-105.705 1.00 0.00 H
+ATOM 8136 2HG1 VAL M 145 -38.105 -34.361-107.167 1.00 0.00 H
+ATOM 8137 3HG1 VAL M 145 -36.336 -34.544-107.095 1.00 0.00 H
+ATOM 8138 1HG2 VAL M 145 -35.803 -31.842-105.729 1.00 0.00 H
+ATOM 8139 2HG2 VAL M 145 -34.880 -32.452-107.123 1.00 0.00 H
+ATOM 8140 3HG2 VAL M 145 -35.669 -30.859-107.206 1.00 0.00 H
+ATOM 8141 N PHE M 146 -38.569 -34.209-109.746 1.00108.84 N
+ATOM 8142 CA PHE M 146 -39.782 -34.734-110.370 1.00120.92 C
+ATOM 8143 C PHE M 146 -40.724 -35.299-109.321 1.00135.13 C
+ATOM 8144 O PHE M 146 -40.303 -36.136-108.509 1.00146.13 O
+ATOM 8145 CB PHE M 146 -39.439 -35.828-111.378 1.00125.85 C
+ATOM 8146 CG PHE M 146 -38.601 -35.359-112.534 1.00128.11 C
+ATOM 8147 CD1 PHE M 146 -38.838 -34.133-113.131 1.00129.73 C
+ATOM 8148 CD2 PHE M 146 -37.578 -36.154-113.028 1.00123.25 C
+ATOM 8149 CE1 PHE M 146 -38.068 -33.707-114.197 1.00126.19 C
+ATOM 8150 CE2 PHE M 146 -36.806 -35.734-114.091 1.00115.97 C
+ATOM 8151 CZ PHE M 146 -37.051 -34.509-114.677 1.00119.53 C
+ATOM 8152 H PHE M 146 -37.841 -34.852-109.468 1.00 0.00 H
+ATOM 8153 HA PHE M 146 -40.280 -33.919-110.898 1.00 0.00 H
+ATOM 8154 1HB PHE M 146 -38.900 -36.630-110.875 1.00 0.00 H
+ATOM 8155 2HB PHE M 146 -40.358 -36.254-111.779 1.00 0.00 H
+ATOM 8156 HD1 PHE M 146 -39.642 -33.502-112.751 1.00 0.00 H
+ATOM 8157 HD2 PHE M 146 -37.386 -37.122-112.564 1.00 0.00 H
+ATOM 8158 HE1 PHE M 146 -38.264 -32.739-114.657 1.00 0.00 H
+ATOM 8159 HE2 PHE M 146 -36.004 -36.368-114.469 1.00 0.00 H
+ATOM 8160 HZ PHE M 146 -36.444 -34.176-115.518 1.00 0.00 H
+ATOM 8161 N PRO M 147 -41.984 -34.880-109.298 1.00138.20 N
+ATOM 8162 CA PRO M 147 -42.969 -35.518-108.418 1.00145.32 C
+ATOM 8163 C PRO M 147 -43.451 -36.850-108.984 1.00143.34 C
+ATOM 8164 O PRO M 147 -43.205 -37.199-110.140 1.00138.81 O
+ATOM 8165 CB PRO M 147 -44.113 -34.496-108.361 1.00151.60 C
+ATOM 8166 CG PRO M 147 -43.506 -33.203-108.835 1.00146.75 C
+ATOM 8167 CD PRO M 147 -42.471 -33.600-109.835 1.00137.24 C
+ATOM 8168 HA PRO M 147 -42.525 -35.662-107.422 1.00 0.00 H
+ATOM 8169 1HB PRO M 147 -44.946 -34.827-108.999 1.00 0.00 H
+ATOM 8170 2HB PRO M 147 -44.503 -34.425-107.335 1.00 0.00 H
+ATOM 8171 1HG PRO M 147 -44.282 -32.557-109.272 1.00 0.00 H
+ATOM 8172 2HG PRO M 147 -43.075 -32.652-107.986 1.00 0.00 H
+ATOM 8173 1HD PRO M 147 -42.941 -33.720-110.822 1.00 0.00 H
+ATOM 8174 2HD PRO M 147 -41.683 -32.834-109.871 1.00 0.00 H
+ATOM 8175 N HIS M 148 -44.161 -37.597-108.133 1.00144.43 N
+ATOM 8176 CA HIS M 148 -44.661 -38.916-108.516 1.00140.99 C
+ATOM 8177 C HIS M 148 -45.967 -38.811-109.297 1.00143.91 C
+ATOM 8178 O HIS M 148 -46.068 -39.315-110.425 1.00129.28 O
+ATOM 8179 CB HIS M 148 -44.871 -39.795-107.279 1.00135.35 C
+ATOM 8180 CG HIS M 148 -45.345 -41.179-107.597 1.00 0.00 C
+ATOM 8181 ND1 HIS M 148 -44.537 -42.122-108.197 1.00 0.00 N
+ATOM 8182 CD2 HIS M 148 -46.542 -41.779-107.400 1.00 0.00 C
+ATOM 8183 CE1 HIS M 148 -45.218 -43.244-108.355 1.00 0.00 C
+ATOM 8184 NE2 HIS M 148 -46.436 -43.061-107.879 1.00 0.00 N
+ATOM 8185 H HIS M 148 -44.358 -37.246-107.206 1.00 0.00 H
+ATOM 8186 HA HIS M 148 -43.941 -39.401-109.174 1.00 0.00 H
+ATOM 8187 1HB HIS M 148 -43.935 -39.873-106.725 1.00 0.00 H
+ATOM 8188 2HB HIS M 148 -45.602 -39.327-106.620 1.00 0.00 H
+ATOM 8189 HD1 HIS M 148 -43.565 -42.019-108.409 1.00 0.00 H
+ATOM 8190 HD2 HIS M 148 -47.480 -41.435-106.963 1.00 0.00 H
+ATOM 8191 HE1 HIS M 148 -44.752 -44.116-108.813 1.00 0.00 H
+ATOM 8192 N ASN M 149 -46.982 -38.180-108.687 1.00161.03 N
+ATOM 8193 CA ASN M 149 -48.252 -37.919-109.363 1.00178.23 C
+ATOM 8194 C ASN M 149 -48.032 -37.306-110.751 1.00182.46 C
+ATOM 8195 O ASN M 149 -48.678 -37.711-111.725 1.00185.60 O
+ATOM 8196 CB ASN M 149 -49.121 -37.034-108.461 1.00193.63 C
+ATOM 8197 CG ASN M 149 -50.244 -36.342-109.196 1.00216.68 C
+ATOM 8198 OD1 ASN M 149 -50.799 -36.819-110.183 1.00213.08 O
+ATOM 8199 ND2 ASN M 149 -50.559 -35.160-108.699 1.00244.10 N
+ATOM 8200 H ASN M 149 -46.862 -37.877-107.731 1.00 0.00 H
+ATOM 8201 HA ASN M 149 -48.757 -38.872-109.531 1.00 0.00 H
+ATOM 8202 1HB ASN M 149 -49.555 -37.640-107.665 1.00 0.00 H
+ATOM 8203 2HB ASN M 149 -48.499 -36.272-107.990 1.00 0.00 H
+ATOM 8204 1HD2 ASN M 149 -51.291 -34.621-109.116 1.00 0.00 H
+ATOM 8205 2HD2 ASN M 149 -50.066 -34.804-107.906 1.00 0.00 H
+ATOM 8206 N HIS M 150 -47.088 -36.374-110.880 1.00180.22 N
+ATOM 8207 CA HIS M 150 -46.803 -35.735-112.163 1.00178.03 C
+ATOM 8208 C HIS M 150 -45.299 -35.722-112.390 1.00169.98 C
+ATOM 8209 O HIS M 150 -44.554 -35.142-111.592 1.00172.94 O
+ATOM 8210 CB HIS M 150 -47.374 -34.313-112.209 1.00179.40 C
+ATOM 8211 CG HIS M 150 -47.233 -33.645-113.541 1.00176.51 C
+ATOM 8212 ND1 HIS M 150 -46.802 -32.343-113.679 1.00175.42 N
+ATOM 8213 CD2 HIS M 150 -47.454 -34.103-114.796 1.00182.05 C
+ATOM 8214 CE1 HIS M 150 -46.772 -32.025-114.961 1.00179.78 C
+ATOM 8215 NE2 HIS M 150 -47.162 -33.075-115.660 1.00183.11 N
+ATOM 8216 H HIS M 150 -46.555 -36.103-110.066 1.00 0.00 H
+ATOM 8217 HA HIS M 150 -47.267 -36.307-112.966 1.00 0.00 H
+ATOM 8218 1HB HIS M 150 -48.434 -34.338-111.953 1.00 0.00 H
+ATOM 8219 2HB HIS M 150 -46.872 -33.695-111.465 1.00 0.00 H
+ATOM 8220 HD2 HIS M 150 -47.802 -35.099-115.070 1.00 0.00 H
+ATOM 8221 HE1 HIS M 150 -46.475 -31.060-115.372 1.00 0.00 H
+ATOM 8222 HE2 HIS M 150 -47.235 -33.121-116.666 1.00 0.00 H
+ATOM 8223 N THR M 151 -44.853 -36.355-113.478 1.00164.25 N
+ATOM 8224 CA THR M 151 -43.431 -36.528-113.754 1.00158.37 C
+ATOM 8225 C THR M 151 -42.891 -35.484-114.727 1.00146.31 C
+ATOM 8226 O THR M 151 -41.912 -35.748-115.437 1.00126.70 O
+ATOM 8227 CB THR M 151 -43.153 -37.933-114.291 1.00159.05 C
+ATOM 8228 OG1 THR M 151 -43.522 -38.004-115.673 1.00158.86 O
+ATOM 8229 CG2 THR M 151 -43.957 -38.962-113.513 1.00161.84 C
+ATOM 8230 H THR M 151 -45.529 -36.725-114.130 1.00 0.00 H
+ATOM 8231 HA THR M 151 -42.879 -36.397-112.823 1.00 0.00 H
+ATOM 8232 HB THR M 151 -42.091 -38.156-114.193 1.00 0.00 H
+ATOM 8233 HG1 THR M 151 -43.863 -37.152-115.957 1.00 0.00 H
+ATOM 8234 1HG2 THR M 151 -43.750 -39.958-113.905 1.00 0.00 H
+ATOM 8235 2HG2 THR M 151 -43.679 -38.921-112.460 1.00 0.00 H
+ATOM 8236 3HG2 THR M 151 -45.020 -38.746-113.616 1.00 0.00 H
+ATOM 8237 N ALA M 152 -43.507 -34.299-114.776 1.00147.82 N
+ATOM 8238 CA ALA M 152 -43.081 -33.252-115.697 1.00141.31 C
+ATOM 8239 C ALA M 152 -43.026 -31.881-115.027 1.00147.04 C
+ATOM 8240 O ALA M 152 -43.027 -30.860-115.721 1.00145.92 O
+ATOM 8241 CB ALA M 152 -43.997 -33.207-116.923 1.00133.41 C
+ATOM 8242 H ALA M 152 -44.288 -34.124-114.159 1.00 0.00 H
+ATOM 8243 HA ALA M 152 -42.067 -33.481-116.025 1.00 0.00 H
+ATOM 8244 1HB ALA M 152 -43.663 -32.419-117.598 1.00 0.00 H
+ATOM 8245 2HB ALA M 152 -43.962 -34.167-117.439 1.00 0.00 H
+ATOM 8246 3HB ALA M 152 -45.019 -33.003-116.606 1.00 0.00 H
+ATOM 8247 N ASP M 153 -42.977 -31.832-113.695 1.00147.55 N
+ATOM 8248 CA ASP M 153 -42.917 -30.562-112.969 1.00148.50 C
+ATOM 8249 C ASP M 153 -41.455 -30.182-112.768 1.00145.89 C
+ATOM 8250 O ASP M 153 -40.816 -30.571-111.792 1.00145.38 O
+ATOM 8251 CB ASP M 153 -43.629 -30.660-111.618 1.00149.91 C
+ATOM 8252 CG ASP M 153 -43.674 -29.332-110.874 1.00 0.00 C
+ATOM 8253 OD1 ASP M 153 -42.781 -28.540-111.059 1.00 0.00 O
+ATOM 8254 OD2 ASP M 153 -44.601 -29.123-110.128 1.00 0.00 O
+ATOM 8255 H ASP M 153 -42.981 -32.697-113.174 1.00 0.00 H
+ATOM 8256 HA ASP M 153 -43.399 -29.794-113.575 1.00 0.00 H
+ATOM 8257 1HB ASP M 153 -44.651 -31.009-111.770 1.00 0.00 H
+ATOM 8258 2HB ASP M 153 -43.122 -31.394-110.991 1.00 0.00 H
+ATOM 8259 N ILE M 154 -40.919 -29.397-113.706 1.00142.07 N
+ATOM 8260 CA ILE M 154 -39.532 -28.942-113.614 1.00131.78 C
+ATOM 8261 C ILE M 154 -39.403 -27.565-112.983 1.00131.00 C
+ATOM 8262 O ILE M 154 -38.274 -27.093-112.775 1.00131.99 O
+ATOM 8263 CB ILE M 154 -38.878 -28.917-115.008 1.00118.77 C
+ATOM 8264 CG1 ILE M 154 -39.560 -27.876-115.899 1.00117.14 C
+ATOM 8265 CG2 ILE M 154 -38.940 -30.294-115.649 1.00116.76 C
+ATOM 8266 CD1 ILE M 154 -38.839 -27.623-117.203 1.00 0.00 C
+ATOM 8267 H ILE M 154 -41.480 -29.110-114.496 1.00 0.00 H
+ATOM 8268 HA ILE M 154 -38.985 -29.630-112.971 1.00 0.00 H
+ATOM 8269 HB ILE M 154 -37.835 -28.617-114.914 1.00 0.00 H
+ATOM 8270 1HG1 ILE M 154 -40.575 -28.201-116.127 1.00 0.00 H
+ATOM 8271 2HG1 ILE M 154 -39.634 -26.929-115.362 1.00 0.00 H
+ATOM 8272 1HG2 ILE M 154 -38.474 -30.259-116.634 1.00 0.00 H
+ATOM 8273 2HG2 ILE M 154 -38.411 -31.011-115.023 1.00 0.00 H
+ATOM 8274 3HG2 ILE M 154 -39.981 -30.601-115.752 1.00 0.00 H
+ATOM 8275 1HD1 ILE M 154 -39.383 -26.873-117.780 1.00 0.00 H
+ATOM 8276 2HD1 ILE M 154 -37.831 -27.262-116.998 1.00 0.00 H
+ATOM 8277 3HD1 ILE M 154 -38.785 -28.549-117.774 1.00 0.00 H
+ATOM 8278 N GLN M 155 -40.515 -26.903-112.670 1.00125.78 N
+ATOM 8279 CA GLN M 155 -40.484 -25.593-112.039 1.00123.18 C
+ATOM 8280 C GLN M 155 -41.013 -25.631-110.612 1.00122.54 C
+ATOM 8281 O GLN M 155 -41.168 -24.580-109.986 1.00116.78 O
+ATOM 8282 CB GLN M 155 -41.275 -24.588-112.881 1.00128.89 C
+ATOM 8283 CG GLN M 155 -40.728 -23.165-112.841 1.00137.61 C
+ATOM 8284 CD GLN M 155 -41.179 -22.323-114.024 1.00143.56 C
+ATOM 8285 OE1 GLN M 155 -42.067 -22.717-114.782 1.00145.06 O
+ATOM 8286 NE2 GLN M 155 -40.557 -21.160-114.193 1.00144.66 N
+ATOM 8287 H GLN M 155 -41.407 -27.327-112.879 1.00 0.00 H
+ATOM 8288 HA GLN M 155 -39.447 -25.263-111.978 1.00 0.00 H
+ATOM 8289 1HB GLN M 155 -41.285 -24.913-113.921 1.00 0.00 H
+ATOM 8290 2HB GLN M 155 -42.309 -24.559-112.537 1.00 0.00 H
+ATOM 8291 1HG GLN M 155 -41.075 -22.679-111.929 1.00 0.00 H
+ATOM 8292 2HG GLN M 155 -39.639 -23.205-112.851 1.00 0.00 H
+ATOM 8293 1HE2 GLN M 155 -40.811 -20.562-114.955 1.00 0.00 H
+ATOM 8294 2HE2 GLN M 155 -39.835 -20.882-113.559 1.00 0.00 H
+ATOM 8295 N SER M 156 -41.282 -26.821-110.076 1.00126.76 N
+ATOM 8296 CA SER M 156 -41.836 -26.922-108.730 1.00126.21 C
+ATOM 8297 C SER M 156 -40.736 -26.906-107.674 1.00129.34 C
+ATOM 8298 O SER M 156 -40.747 -26.068-106.766 1.00139.72 O
+ATOM 8299 CB SER M 156 -42.656 -28.190-108.598 1.00117.41 C
+ATOM 8300 OG SER M 156 -43.167 -28.326-107.301 1.00 0.00 O
+ATOM 8301 H SER M 156 -41.104 -27.666-110.599 1.00 0.00 H
+ATOM 8302 HA SER M 156 -42.464 -26.049-108.548 1.00 0.00 H
+ATOM 8303 1HB SER M 156 -43.477 -28.169-109.315 1.00 0.00 H
+ATOM 8304 2HB SER M 156 -42.035 -29.052-108.839 1.00 0.00 H
+ATOM 8305 HG SER M 156 -44.061 -28.660-107.402 1.00 0.00 H
+ATOM 8306 N GLU M 157 -39.772 -27.819-107.785 1.00113.06 N
+ATOM 8307 CA GLU M 157 -38.684 -27.942-106.820 1.00106.98 C
+ATOM 8308 C GLU M 157 -37.361 -27.826-107.567 1.00101.76 C
+ATOM 8309 O GLU M 157 -36.950 -28.765-108.257 1.00 98.40 O
+ATOM 8310 CB GLU M 157 -38.760 -29.272-106.067 1.00102.22 C
+ATOM 8311 CG GLU M 157 -37.692 -29.451-104.998 1.00 93.88 C
+ATOM 8312 CD GLU M 157 -37.835 -30.741-104.239 1.00 0.00 C
+ATOM 8313 OE1 GLU M 157 -38.749 -31.477-104.522 1.00 0.00 O
+ATOM 8314 OE2 GLU M 157 -37.028 -30.991-103.374 1.00 0.00 O
+ATOM 8315 H GLU M 157 -39.803 -28.449-108.574 1.00 0.00 H
+ATOM 8316 HA GLU M 157 -38.764 -27.125-106.102 1.00 0.00 H
+ATOM 8317 1HB GLU M 157 -39.734 -29.363-105.586 1.00 0.00 H
+ATOM 8318 2HB GLU M 157 -38.667 -30.096-106.774 1.00 0.00 H
+ATOM 8319 1HG GLU M 157 -36.711 -29.429-105.471 1.00 0.00 H
+ATOM 8320 2HG GLU M 157 -37.748 -28.617-104.300 1.00 0.00 H
+ATOM 8321 N VAL M 158 -36.699 -26.678-107.430 1.00 93.49 N
+ATOM 8322 CA VAL M 158 -35.449 -26.388-108.127 1.00 85.33 C
+ATOM 8323 C VAL M 158 -34.427 -25.920-107.101 1.00 78.22 C
+ATOM 8324 O VAL M 158 -34.671 -24.946-106.378 1.00 94.53 O
+ATOM 8325 CB VAL M 158 -35.633 -25.327-109.226 1.00 77.61 C
+ATOM 8326 CG1 VAL M 158 -34.290 -24.943-109.829 1.00 77.51 C
+ATOM 8327 CG2 VAL M 158 -36.570 -25.838-110.303 1.00 78.48 C
+ATOM 8328 H VAL M 158 -37.090 -25.982-106.811 1.00 0.00 H
+ATOM 8329 HA VAL M 158 -35.097 -27.304-108.602 1.00 0.00 H
+ATOM 8330 HB VAL M 158 -36.054 -24.426-108.781 1.00 0.00 H
+ATOM 8331 1HG1 VAL M 158 -34.441 -24.191-110.604 1.00 0.00 H
+ATOM 8332 2HG1 VAL M 158 -33.645 -24.536-109.051 1.00 0.00 H
+ATOM 8333 3HG1 VAL M 158 -33.822 -25.825-110.266 1.00 0.00 H
+ATOM 8334 1HG2 VAL M 158 -36.690 -25.076-111.072 1.00 0.00 H
+ATOM 8335 2HG2 VAL M 158 -36.154 -26.742-110.749 1.00 0.00 H
+ATOM 8336 3HG2 VAL M 158 -37.541 -26.065-109.863 1.00 0.00 H
+ATOM 8337 N HIS M 159 -33.282 -26.602-107.047 1.00 70.69 N
+ATOM 8338 CA HIS M 159 -32.203 -26.263-106.124 1.00 91.43 C
+ATOM 8339 C HIS M 159 -30.914 -26.089-106.912 1.00 95.96 C
+ATOM 8340 O HIS M 159 -30.458 -27.030-107.567 1.00111.98 O
+ATOM 8341 CB HIS M 159 -32.013 -27.347-105.054 1.00 98.46 C
+ATOM 8342 CG HIS M 159 -33.246 -27.652-104.261 1.00107.64 C
+ATOM 8343 ND1 HIS M 159 -33.758 -26.788-103.315 1.00110.25 N
+ATOM 8344 CD2 HIS M 159 -34.055 -28.738-104.255 1.00102.20 C
+ATOM 8345 CE1 HIS M 159 -34.837 -27.323-102.772 1.00113.49 C
+ATOM 8346 NE2 HIS M 159 -35.039 -28.506-103.325 1.00111.06 N
+ATOM 8347 H HIS M 159 -33.165 -27.385-107.675 1.00 0.00 H
+ATOM 8348 HA HIS M 159 -32.443 -25.332-105.611 1.00 0.00 H
+ATOM 8349 1HB HIS M 159 -31.681 -28.272-105.527 1.00 0.00 H
+ATOM 8350 2HB HIS M 159 -31.234 -27.038-104.358 1.00 0.00 H
+ATOM 8351 HD2 HIS M 159 -33.949 -29.627-104.877 1.00 0.00 H
+ATOM 8352 HE1 HIS M 159 -35.455 -26.866-102.000 1.00 0.00 H
+ATOM 8353 HE2 HIS M 159 -35.793 -29.141-103.104 1.00 0.00 H
+ATOM 8354 N CYS M 160 -30.324 -24.899-106.843 1.00 84.95 N
+ATOM 8355 CA CYS M 160 -28.987 -24.703-107.387 1.00 89.55 C
+ATOM 8356 C CYS M 160 -27.979 -25.527-106.592 1.00 85.05 C
+ATOM 8357 O CYS M 160 -28.105 -25.688-105.376 1.00 95.17 O
+ATOM 8358 CB CYS M 160 -28.612 -23.225-107.340 1.00110.25 C
+ATOM 8359 SG CYS M 160 -28.664 -22.614-105.654 1.00165.66 S
+ATOM 8360 H CYS M 160 -30.799 -24.119-106.412 1.00 0.00 H
+ATOM 8361 HA CYS M 160 -28.984 -25.033-108.426 1.00 0.00 H
+ATOM 8362 1HB CYS M 160 -27.612 -23.090-107.752 1.00 0.00 H
+ATOM 8363 2HB CYS M 160 -29.302 -22.655-107.962 1.00 0.00 H
+ATOM 8364 N ILE M 161 -26.977 -26.058-107.284 1.00 85.43 N
+ATOM 8365 CA ILE M 161 -25.947 -26.891-106.663 1.00 76.68 C
+ATOM 8366 C ILE M 161 -24.725 -25.998-106.480 1.00 74.72 C
+ATOM 8367 O ILE M 161 -23.826 -25.955-107.323 1.00 84.56 O
+ATOM 8368 CB ILE M 161 -25.632 -28.130-107.499 1.00 74.49 C
+ATOM 8369 CG1 ILE M 161 -26.920 -28.860-107.885 1.00 80.01 C
+ATOM 8370 CG2 ILE M 161 -24.698 -29.057-106.738 1.00 72.72 C
+ATOM 8371 CD1 ILE M 161 -26.712 -29.985-108.881 1.00 68.58 C
+ATOM 8372 H ILE M 161 -26.930 -25.876-108.276 1.00 0.00 H
+ATOM 8373 HA ILE M 161 -26.312 -27.226-105.693 1.00 0.00 H
+ATOM 8374 HB ILE M 161 -25.153 -27.828-108.430 1.00 0.00 H
+ATOM 8375 1HG1 ILE M 161 -27.384 -29.277-106.991 1.00 0.00 H
+ATOM 8376 2HG1 ILE M 161 -27.625 -28.150-108.317 1.00 0.00 H
+ATOM 8377 1HG2 ILE M 161 -24.483 -29.936-107.346 1.00 0.00 H
+ATOM 8378 2HG2 ILE M 161 -23.769 -28.534-106.515 1.00 0.00 H
+ATOM 8379 3HG2 ILE M 161 -25.172 -29.367-105.807 1.00 0.00 H
+ATOM 8380 1HD1 ILE M 161 -27.670 -30.454-109.106 1.00 0.00 H
+ATOM 8381 2HD1 ILE M 161 -26.280 -29.584-109.799 1.00 0.00 H
+ATOM 8382 3HD1 ILE M 161 -26.037 -30.726-108.456 1.00 0.00 H
+ATOM 8383 N PHE M 162 -24.684 -25.279-105.359 1.00 68.29 N
+ATOM 8384 CA PHE M 162 -23.596 -24.347-105.107 1.00 70.13 C
+ATOM 8385 C PHE M 162 -23.357 -24.199-103.611 1.00 76.05 C
+ATOM 8386 O PHE M 162 -24.306 -24.097-102.828 1.00 70.47 O
+ATOM 8387 CB PHE M 162 -23.885 -22.976-105.723 1.00 69.27 C
+ATOM 8388 CG PHE M 162 -22.809 -21.967-105.469 1.00 70.64 C
+ATOM 8389 CD1 PHE M 162 -21.699 -21.904-106.293 1.00 75.13 C
+ATOM 8390 CD2 PHE M 162 -22.900 -21.086-104.405 1.00 72.01 C
+ATOM 8391 CE1 PHE M 162 -20.699 -20.981-106.060 1.00 79.98 C
+ATOM 8392 CE2 PHE M 162 -21.905 -20.160-104.167 1.00 73.55 C
+ATOM 8393 CZ PHE M 162 -20.802 -20.107-104.995 1.00 73.92 C
+ATOM 8394 H PHE M 162 -25.416 -25.378-104.670 1.00 0.00 H
+ATOM 8395 HA PHE M 162 -22.688 -24.743-105.565 1.00 0.00 H
+ATOM 8396 1HB PHE M 162 -24.009 -23.080-106.800 1.00 0.00 H
+ATOM 8397 2HB PHE M 162 -24.820 -22.587-105.322 1.00 0.00 H
+ATOM 8398 HD1 PHE M 162 -21.620 -22.593-107.134 1.00 0.00 H
+ATOM 8399 HD2 PHE M 162 -23.772 -21.129-103.751 1.00 0.00 H
+ATOM 8400 HE1 PHE M 162 -19.830 -20.943-106.716 1.00 0.00 H
+ATOM 8401 HE2 PHE M 162 -21.988 -19.471-103.326 1.00 0.00 H
+ATOM 8402 HZ PHE M 162 -20.014 -19.379-104.808 1.00 0.00 H
+ATOM 8403 N SER M 163 -22.075 -24.172-103.230 1.00 79.04 N
+ATOM 8404 CA SER M 163 -21.620 -23.916-101.868 1.00 74.69 C
+ATOM 8405 C SER M 163 -20.299 -23.157-101.909 1.00 76.36 C
+ATOM 8406 O SER M 163 -19.321 -23.649-102.484 1.00 84.41 O
+ATOM 8407 CB SER M 163 -21.450 -25.218-101.084 1.00 82.85 C
+ATOM 8408 OG SER M 163 -22.702 -25.805-100.790 1.00 94.09 O
+ATOM 8409 H SER M 163 -21.391 -24.344-103.953 1.00 0.00 H
+ATOM 8410 HA SER M 163 -22.370 -23.308-101.361 1.00 0.00 H
+ATOM 8411 1HB SER M 163 -20.847 -25.916-101.664 1.00 0.00 H
+ATOM 8412 2HB SER M 163 -20.915 -25.017-100.157 1.00 0.00 H
+ATOM 8413 HG SER M 163 -23.364 -25.221-101.168 1.00 0.00 H
+ATOM 8414 N PRO M 164 -20.226 -21.967-101.319 1.00 74.85 N
+ATOM 8415 CA PRO M 164 -18.972 -21.207-101.339 1.00 76.52 C
+ATOM 8416 C PRO M 164 -17.895 -21.906-100.522 1.00 88.47 C
+ATOM 8417 O PRO M 164 -18.149 -22.841 -99.761 1.00108.67 O
+ATOM 8418 CB PRO M 164 -19.354 -19.858-100.722 1.00 85.62 C
+ATOM 8419 CG PRO M 164 -20.858 -19.820-100.749 1.00 83.14 C
+ATOM 8420 CD PRO M 164 -21.302 -21.238-100.629 1.00 75.20 C
+ATOM 8421 HA PRO M 164 -18.644 -21.078-102.381 1.00 0.00 H
+ATOM 8422 1HB PRO M 164 -18.953 -19.785 -99.700 1.00 0.00 H
+ATOM 8423 2HB PRO M 164 -18.906 -19.038-101.303 1.00 0.00 H
+ATOM 8424 1HG PRO M 164 -21.237 -19.199 -99.924 1.00 0.00 H
+ATOM 8425 2HG PRO M 164 -21.210 -19.357-101.683 1.00 0.00 H
+ATOM 8426 1HD PRO M 164 -21.370 -21.513 -99.566 1.00 0.00 H
+ATOM 8427 2HD PRO M 164 -22.276 -21.361-101.124 1.00 0.00 H
+ATOM 8428 N GLN M 165 -16.661 -21.428-100.689 1.00 83.50 N
+ATOM 8429 CA GLN M 165 -15.490 -22.002-100.027 1.00 83.07 C
+ATOM 8430 C GLN M 165 -14.766 -20.893 -99.257 1.00 83.73 C
+ATOM 8431 O GLN M 165 -13.679 -20.461 -99.643 1.00 87.86 O
+ATOM 8432 CB GLN M 165 -14.570 -22.685-101.043 1.00 90.85 C
+ATOM 8433 CG GLN M 165 -15.224 -23.833-101.810 1.00 79.70 C
+ATOM 8434 CD GLN M 165 -15.519 -25.035-100.927 1.00 81.37 C
+ATOM 8435 OE1 GLN M 165 -14.606 -25.739-100.495 1.00 85.43 O
+ATOM 8436 NE2 GLN M 165 -16.798 -25.272-100.649 1.00 77.63 N
+ATOM 8437 H GLN M 165 -16.540 -20.634-101.302 1.00 0.00 H
+ATOM 8438 HA GLN M 165 -15.830 -22.750 -99.311 1.00 0.00 H
+ATOM 8439 1HB GLN M 165 -14.222 -21.951-101.770 1.00 0.00 H
+ATOM 8440 2HB GLN M 165 -13.693 -23.080-100.531 1.00 0.00 H
+ATOM 8441 1HG GLN M 165 -16.166 -23.483-102.234 1.00 0.00 H
+ATOM 8442 2HG GLN M 165 -14.552 -24.153-102.606 1.00 0.00 H
+ATOM 8443 1HE2 GLN M 165 -17.049 -26.050-100.072 1.00 0.00 H
+ATOM 8444 2HE2 GLN M 165 -17.509 -24.673-101.016 1.00 0.00 H
+ATOM 8445 N ILE M 166 -15.377 -20.446 -98.155 1.00 86.66 N
+ATOM 8446 CA ILE M 166 -14.805 -19.365 -97.352 1.00 86.22 C
+ATOM 8447 C ILE M 166 -13.418 -19.736 -96.847 1.00 88.65 C
+ATOM 8448 O ILE M 166 -12.544 -18.870 -96.714 1.00 99.19 O
+ATOM 8449 CB ILE M 166 -15.751 -19.001 -96.187 1.00100.69 C
+ATOM 8450 CG1 ILE M 166 -17.083 -18.473 -96.716 1.00113.24 C
+ATOM 8451 CG2 ILE M 166 -15.122 -17.957 -95.275 1.00103.84 C
+ATOM 8452 CD1 ILE M 166 -18.141 -19.525 -96.879 1.00121.81 C
+ATOM 8453 H ILE M 166 -16.252 -20.862 -97.869 1.00 0.00 H
+ATOM 8454 HA ILE M 166 -14.682 -18.489 -97.988 1.00 0.00 H
+ATOM 8455 HB ILE M 166 -15.964 -19.893 -95.599 1.00 0.00 H
+ATOM 8456 1HG1 ILE M 166 -17.467 -17.710 -96.039 1.00 0.00 H
+ATOM 8457 2HG1 ILE M 166 -16.928 -18.000 -97.686 1.00 0.00 H
+ATOM 8458 1HG2 ILE M 166 -15.811 -17.720 -94.464 1.00 0.00 H
+ATOM 8459 2HG2 ILE M 166 -14.194 -18.349 -94.860 1.00 0.00 H
+ATOM 8460 3HG2 ILE M 166 -14.911 -17.054 -95.847 1.00 0.00 H
+ATOM 8461 1HD1 ILE M 166 -19.054 -19.067 -97.259 1.00 0.00 H
+ATOM 8462 2HD1 ILE M 166 -17.795 -20.283 -97.583 1.00 0.00 H
+ATOM 8463 3HD1 ILE M 166 -18.343 -19.990 -95.915 1.00 0.00 H
+ATOM 8464 N GLU M 167 -13.189 -21.021 -96.570 1.00 89.88 N
+ATOM 8465 CA GLU M 167 -11.881 -21.472 -96.105 1.00100.06 C
+ATOM 8466 C GLU M 167 -10.799 -21.175 -97.138 1.00105.95 C
+ATOM 8467 O GLU M 167 -9.795 -20.519 -96.838 1.00104.93 O
+ATOM 8468 CB GLU M 167 -11.935 -22.969 -95.792 1.00111.40 C
+ATOM 8469 CG GLU M 167 -12.998 -23.364 -94.775 1.00111.75 C
+ATOM 8470 CD GLU M 167 -12.532 -23.199 -93.341 1.00117.05 C
+ATOM 8471 OE1 GLU M 167 -11.411 -22.691 -93.130 1.00126.15 O
+ATOM 8472 OE2 GLU M 167 -13.287 -23.580 -92.423 1.00116.81 O
+ATOM 8473 H GLU M 167 -13.931 -21.697 -96.683 1.00 0.00 H
+ATOM 8474 HA GLU M 167 -11.631 -20.927 -95.194 1.00 0.00 H
+ATOM 8475 1HB GLU M 167 -12.128 -23.526 -96.709 1.00 0.00 H
+ATOM 8476 2HB GLU M 167 -10.969 -23.296 -95.408 1.00 0.00 H
+ATOM 8477 1HG GLU M 167 -13.882 -22.747 -94.931 1.00 0.00 H
+ATOM 8478 2HG GLU M 167 -13.279 -24.403 -94.944 1.00 0.00 H
+ATOM 8479 N GLU M 168 -10.989 -21.656 -98.364 1.00110.57 N
+ATOM 8480 CA GLU M 168 -10.043 -21.442 -99.460 1.00111.63 C
+ATOM 8481 C GLU M 168 -10.729 -20.656-100.567 1.00106.72 C
+ATOM 8482 O GLU M 168 -11.505 -21.232-101.352 1.00 98.70 O
+ATOM 8483 CB GLU M 168 -9.514 -22.774 -99.988 1.00114.65 C
+ATOM 8484 CG GLU M 168 -8.695 -23.551 -98.971 1.00129.51 C
+ATOM 8485 CD GLU M 168 -8.203 -24.881 -99.505 1.00150.11 C
+ATOM 8486 OE1 GLU M 168 -8.703 -25.324-100.560 1.00152.51 O
+ATOM 8487 OE2 GLU M 168 -7.309 -25.480 -98.871 1.00161.97 O
+ATOM 8488 H GLU M 168 -11.828 -22.192 -98.536 1.00 0.00 H
+ATOM 8489 HA GLU M 168 -9.201 -20.861 -99.082 1.00 0.00 H
+ATOM 8490 1HB GLU M 168 -10.350 -23.399-100.302 1.00 0.00 H
+ATOM 8491 2HB GLU M 168 -8.891 -22.596-100.864 1.00 0.00 H
+ATOM 8492 1HG GLU M 168 -7.835 -22.950 -98.677 1.00 0.00 H
+ATOM 8493 2HG GLU M 168 -9.304 -23.723 -98.085 1.00 0.00 H
+ATOM 8494 N PRO M 169 -10.471 -19.349-100.681 1.00113.00 N
+ATOM 8495 CA PRO M 169 -11.243 -18.520-101.621 1.00106.34 C
+ATOM 8496 C PRO M 169 -10.916 -18.764-103.085 1.00106.81 C
+ATOM 8497 O PRO M 169 -11.628 -18.237-103.950 1.00104.62 O
+ATOM 8498 CB PRO M 169 -10.872 -17.091-101.208 1.00105.95 C
+ATOM 8499 CG PRO M 169 -9.508 -17.222-100.622 1.00112.42 C
+ATOM 8500 CD PRO M 169 -9.473 -18.562 -99.937 1.00118.33 C
+ATOM 8501 HA PRO M 169 -12.317 -18.707-101.471 1.00 0.00 H
+ATOM 8502 1HB PRO M 169 -10.898 -16.427-102.085 1.00 0.00 H
+ATOM 8503 2HB PRO M 169 -11.610 -16.703-100.490 1.00 0.00 H
+ATOM 8504 1HG PRO M 169 -8.746 -17.148-101.412 1.00 0.00 H
+ATOM 8505 2HG PRO M 169 -9.316 -16.399 -99.918 1.00 0.00 H
+ATOM 8506 1HD PRO M 169 -8.466 -18.995-100.029 1.00 0.00 H
+ATOM 8507 2HD PRO M 169 -9.749 -18.441 -98.879 1.00 0.00 H
+ATOM 8508 N SER M 170 -9.873 -19.531-103.396 1.00112.25 N
+ATOM 8509 CA SER M 170 -9.513 -19.792-104.782 1.00112.01 C
+ATOM 8510 C SER M 170 -10.120 -21.079-105.326 1.00107.39 C
+ATOM 8511 O SER M 170 -10.138 -21.267-106.548 1.00103.58 O
+ATOM 8512 CB SER M 170 -7.987 -19.840-104.935 1.00111.14 C
+ATOM 8513 OG SER M 170 -7.409 -20.766-104.033 1.00118.67 O
+ATOM 8514 H SER M 170 -9.319 -19.941-102.658 1.00 0.00 H
+ATOM 8515 HA SER M 170 -9.902 -18.981-105.399 1.00 0.00 H
+ATOM 8516 1HB SER M 170 -7.733 -20.120-105.957 1.00 0.00 H
+ATOM 8517 2HB SER M 170 -7.572 -18.849-104.755 1.00 0.00 H
+ATOM 8518 HG SER M 170 -8.139 -21.143-103.537 1.00 0.00 H
+ATOM 8519 N GLN M 171 -10.625 -21.955-104.462 1.00101.27 N
+ATOM 8520 CA GLN M 171 -11.177 -23.233-104.888 1.00 95.69 C
+ATOM 8521 C GLN M 171 -12.685 -23.117-105.082 1.00 89.48 C
+ATOM 8522 O GLN M 171 -13.389 -22.580-104.221 1.00 89.97 O
+ATOM 8523 CB GLN M 171 -10.856 -24.329-103.868 1.00 91.89 C
+ATOM 8524 CG GLN M 171 -9.371 -24.567-103.656 1.00 91.76 C
+ATOM 8525 CD GLN M 171 -8.685 -25.086-104.905 1.00 0.00 C
+ATOM 8526 OE1 GLN M 171 -9.073 -26.118-105.461 1.00 0.00 O
+ATOM 8527 NE2 GLN M 171 -7.658 -24.374-105.355 1.00 0.00 N
+ATOM 8528 H GLN M 171 -10.624 -21.723-103.479 1.00 0.00 H
+ATOM 8529 HA GLN M 171 -10.723 -23.505-105.841 1.00 0.00 H
+ATOM 8530 1HB GLN M 171 -11.296 -24.069-102.905 1.00 0.00 H
+ATOM 8531 2HB GLN M 171 -11.305 -25.268-104.190 1.00 0.00 H
+ATOM 8532 1HG GLN M 171 -8.899 -23.626-103.373 1.00 0.00 H
+ATOM 8533 2HG GLN M 171 -9.241 -25.303-102.863 1.00 0.00 H
+ATOM 8534 1HE2 GLN M 171 -7.166 -24.668-106.176 1.00 0.00 H
+ATOM 8535 2HE2 GLN M 171 -7.376 -23.544-104.874 1.00 0.00 H
+ATOM 8536 N CYS M 172 -13.174 -23.618-106.215 1.00 88.53 N
+ATOM 8537 CA CYS M 172 -14.607 -23.652-106.504 1.00104.53 C
+ATOM 8538 C CYS M 172 -14.952 -24.989-107.149 1.00106.60 C
+ATOM 8539 O CYS M 172 -14.812 -25.150-108.373 1.00111.14 O
+ATOM 8540 CB CYS M 172 -15.037 -22.498-107.405 1.00125.05 C
+ATOM 8541 SG CYS M 172 -16.779 -22.604-107.908 1.00147.98 S
+ATOM 8542 H CYS M 172 -12.526 -23.987-106.896 1.00 0.00 H
+ATOM 8543 HA CYS M 172 -15.152 -23.564-105.564 1.00 0.00 H
+ATOM 8544 1HB CYS M 172 -14.881 -21.553-106.885 1.00 0.00 H
+ATOM 8545 2HB CYS M 172 -14.416 -22.485-108.301 1.00 0.00 H
+ATOM 8546 N PRO M 173 -15.400 -25.971-106.364 1.00 92.89 N
+ATOM 8547 CA PRO M 173 -15.843 -27.242-106.953 1.00 75.21 C
+ATOM 8548 C PRO M 173 -17.219 -27.178-107.593 1.00 72.65 C
+ATOM 8549 O PRO M 173 -17.613 -28.144-108.258 1.00 99.06 O
+ATOM 8550 CB PRO M 173 -15.848 -28.204-105.752 1.00 82.76 C
+ATOM 8551 CG PRO M 173 -15.092 -27.488-104.657 1.00 93.19 C
+ATOM 8552 CD PRO M 173 -15.339 -26.037-104.897 1.00 89.31 C
+ATOM 8553 HA PRO M 173 -15.113 -27.564-107.710 1.00 0.00 H
+ATOM 8554 1HB PRO M 173 -16.883 -28.435-105.459 1.00 0.00 H
+ATOM 8555 2HB PRO M 173 -15.373 -29.156-106.031 1.00 0.00 H
+ATOM 8556 1HG PRO M 173 -15.453 -27.815-103.670 1.00 0.00 H
+ATOM 8557 2HG PRO M 173 -14.023 -27.742-104.705 1.00 0.00 H
+ATOM 8558 1HD PRO M 173 -16.291 -25.744-104.430 1.00 0.00 H
+ATOM 8559 2HD PRO M 173 -14.506 -25.449-104.483 1.00 0.00 H
+ATOM 8560 N ASP M 174 -17.963 -26.088-107.406 1.00 74.33 N
+ATOM 8561 CA ASP M 174 -19.281 -25.924-108.004 1.00 81.62 C
+ATOM 8562 C ASP M 174 -19.242 -25.164-109.323 1.00 84.00 C
+ATOM 8563 O ASP M 174 -20.245 -25.153-110.046 1.00 68.54 O
+ATOM 8564 CB ASP M 174 -20.218 -25.207-107.026 1.00103.07 C
+ATOM 8565 CG ASP M 174 -20.272 -25.884-105.671 1.00116.69 C
+ATOM 8566 OD1 ASP M 174 -21.150 -26.749-105.475 1.00118.97 O
+ATOM 8567 OD2 ASP M 174 -19.437 -25.552-104.801 1.00121.72 O
+ATOM 8568 H ASP M 174 -17.591 -25.350-106.825 1.00 0.00 H
+ATOM 8569 HA ASP M 174 -19.688 -26.912-108.221 1.00 0.00 H
+ATOM 8570 1HB ASP M 174 -19.886 -24.177-106.892 1.00 0.00 H
+ATOM 8571 2HB ASP M 174 -21.225 -25.174-107.444 1.00 0.00 H
+ATOM 8572 N CYS M 175 -18.124 -24.511-109.634 1.00 96.52 N
+ATOM 8573 CA CYS M 175 -17.868 -23.979-110.968 1.00 91.47 C
+ATOM 8574 C CYS M 175 -17.540 -25.160-111.868 1.00 87.16 C
+ATOM 8575 O CYS M 175 -16.409 -25.650-111.884 1.00 94.95 O
+ATOM 8576 CB CYS M 175 -16.723 -22.973-110.938 1.00115.89 C
+ATOM 8577 SG CYS M 175 -16.871 -21.656-109.705 1.00136.24 S
+ATOM 8578 H CYS M 175 -17.430 -24.383-108.912 1.00 0.00 H
+ATOM 8579 HA CYS M 175 -18.767 -23.470-111.316 1.00 0.00 H
+ATOM 8580 1HB CYS M 175 -15.786 -23.494-110.743 1.00 0.00 H
+ATOM 8581 2HB CYS M 175 -16.634 -22.494-111.913 1.00 0.00 H
+ATOM 8582 N VAL M 176 -18.533 -25.636-112.608 1.00 73.77 N
+ATOM 8583 CA VAL M 176 -18.428 -26.892-113.338 1.00 73.43 C
+ATOM 8584 C VAL M 176 -18.024 -26.674-114.788 1.00 88.33 C
+ATOM 8585 O VAL M 176 -17.072 -27.284-115.274 1.00 82.82 O
+ATOM 8586 CB VAL M 176 -19.759 -27.672-113.247 1.00 68.01 C
+ATOM 8587 CG1 VAL M 176 -19.683 -28.938-114.083 1.00 68.60 C
+ATOM 8588 CG2 VAL M 176 -20.080 -28.004-111.803 1.00 79.95 C
+ATOM 8589 H VAL M 176 -19.390 -25.105-112.664 1.00 0.00 H
+ATOM 8590 HA VAL M 176 -17.637 -27.491-112.884 1.00 0.00 H
+ATOM 8591 HB VAL M 176 -20.559 -27.057-113.661 1.00 0.00 H
+ATOM 8592 1HG1 VAL M 176 -20.627 -29.479-114.011 1.00 0.00 H
+ATOM 8593 2HG1 VAL M 176 -19.494 -28.676-115.124 1.00 0.00 H
+ATOM 8594 3HG1 VAL M 176 -18.875 -29.569-113.714 1.00 0.00 H
+ATOM 8595 1HG2 VAL M 176 -21.020 -28.552-111.756 1.00 0.00 H
+ATOM 8596 2HG2 VAL M 176 -19.281 -28.616-111.384 1.00 0.00 H
+ATOM 8597 3HG2 VAL M 176 -20.169 -27.082-111.229 1.00 0.00 H
+ATOM 8598 N VAL M 177 -18.735 -25.800-115.494 1.00 83.00 N
+ATOM 8599 CA VAL M 177 -18.766 -25.802-116.950 1.00 67.01 C
+ATOM 8600 C VAL M 177 -18.129 -24.531-117.495 1.00 69.73 C
+ATOM 8601 O VAL M 177 -18.476 -23.419-117.075 1.00 68.13 O
+ATOM 8602 CB VAL M 177 -20.204 -25.948-117.465 1.00 68.19 C
+ATOM 8603 CG1 VAL M 177 -20.246 -25.595-118.915 1.00 92.81 C
+ATOM 8604 CG2 VAL M 177 -20.692 -27.368-117.252 1.00 62.63 C
+ATOM 8605 H VAL M 177 -19.273 -25.109-114.991 1.00 0.00 H
+ATOM 8606 HA VAL M 177 -18.183 -26.652-117.307 1.00 0.00 H
+ATOM 8607 HB VAL M 177 -20.847 -25.258-116.919 1.00 0.00 H
+ATOM 8608 1HG1 VAL M 177 -21.267 -25.697-119.285 1.00 0.00 H
+ATOM 8609 2HG1 VAL M 177 -19.914 -24.566-119.049 1.00 0.00 H
+ATOM 8610 3HG1 VAL M 177 -19.590 -26.264-119.472 1.00 0.00 H
+ATOM 8611 1HG2 VAL M 177 -21.713 -27.461-117.620 1.00 0.00 H
+ATOM 8612 2HG2 VAL M 177 -20.046 -28.060-117.794 1.00 0.00 H
+ATOM 8613 3HG2 VAL M 177 -20.667 -27.606-116.188 1.00 0.00 H
+ATOM 8614 N SER M 178 -17.216 -24.703-118.451 1.00 69.68 N
+ATOM 8615 CA SER M 178 -16.644 -23.591-119.195 1.00 71.82 C
+ATOM 8616 C SER M 178 -17.590 -23.135-120.299 1.00 73.55 C
+ATOM 8617 O SER M 178 -18.153 -23.952-121.030 1.00 69.96 O
+ATOM 8618 CB SER M 178 -15.302 -23.997-119.804 1.00 70.06 C
+ATOM 8619 OG SER M 178 -14.925 -23.108-120.838 1.00 71.15 O
+ATOM 8620 H SER M 178 -16.914 -25.643-118.662 1.00 0.00 H
+ATOM 8621 HA SER M 178 -16.480 -22.761-118.506 1.00 0.00 H
+ATOM 8622 1HB SER M 178 -14.537 -24.002-119.028 1.00 0.00 H
+ATOM 8623 2HB SER M 178 -15.374 -25.009-120.199 1.00 0.00 H
+ATOM 8624 HG SER M 178 -15.628 -22.457-120.896 1.00 0.00 H
+ATOM 8625 N ALA M 179 -17.755 -21.817-120.424 1.00 84.50 N
+ATOM 8626 CA ALA M 179 -18.586 -21.268-121.488 1.00 71.53 C
+ATOM 8627 C ALA M 179 -17.940 -21.390-122.861 1.00 77.20 C
+ATOM 8628 O ALA M 179 -18.626 -21.190-123.869 1.00 85.38 O
+ATOM 8629 CB ALA M 179 -18.910 -19.802-121.200 1.00 66.73 C
+ATOM 8630 H ALA M 179 -17.302 -21.186-119.778 1.00 0.00 H
+ATOM 8631 HA ALA M 179 -19.515 -21.837-121.520 1.00 0.00 H
+ATOM 8632 1HB ALA M 179 -19.531 -19.402-122.002 1.00 0.00 H
+ATOM 8633 2HB ALA M 179 -19.446 -19.727-120.254 1.00 0.00 H
+ATOM 8634 3HB ALA M 179 -17.985 -19.231-121.139 1.00 0.00 H
+ATOM 8635 N LEU M 180 -16.650 -21.712-122.928 1.00 78.34 N
+ATOM 8636 CA LEU M 180 -15.937 -21.862-124.188 1.00 77.97 C
+ATOM 8637 C LEU M 180 -16.063 -23.258-124.782 1.00 80.90 C
+ATOM 8638 O LEU M 180 -15.438 -23.539-125.810 1.00 85.61 O
+ATOM 8639 CB LEU M 180 -14.457 -21.518-124.004 1.00 73.92 C
+ATOM 8640 CG LEU M 180 -14.026 -20.200-124.644 1.00 91.95 C
+ATOM 8641 CD1 LEU M 180 -14.602 -19.007-123.896 1.00 98.01 C
+ATOM 8642 CD2 LEU M 180 -12.514 -20.117-124.751 1.00 96.60 C
+ATOM 8643 H LEU M 180 -16.153 -21.857-122.061 1.00 0.00 H
+ATOM 8644 HA LEU M 180 -16.369 -21.174-124.914 1.00 0.00 H
+ATOM 8645 1HB LEU M 180 -14.242 -21.466-122.938 1.00 0.00 H
+ATOM 8646 2HB LEU M 180 -13.858 -22.320-124.435 1.00 0.00 H
+ATOM 8647 HG LEU M 180 -14.452 -20.125-125.645 1.00 0.00 H
+ATOM 8648 1HD1 LEU M 180 -14.277 -18.084-124.377 1.00 0.00 H
+ATOM 8649 2HD1 LEU M 180 -15.691 -19.059-123.912 1.00 0.00 H
+ATOM 8650 3HD1 LEU M 180 -14.252 -19.021-122.864 1.00 0.00 H
+ATOM 8651 1HD2 LEU M 180 -12.233 -19.169-125.211 1.00 0.00 H
+ATOM 8652 2HD2 LEU M 180 -12.075 -20.182-123.755 1.00 0.00 H
+ATOM 8653 3HD2 LEU M 180 -12.147 -20.940-125.364 1.00 0.00 H
+ATOM 8654 N GLY M 181 -16.846 -24.136-124.162 1.00 74.33 N
+ATOM 8655 CA GLY M 181 -16.971 -25.499-124.633 1.00 76.56 C
+ATOM 8656 C GLY M 181 -16.714 -26.516-123.543 1.00 85.20 C
+ATOM 8657 O GLY M 181 -15.634 -26.535-122.944 1.00 92.39 O
+ATOM 8658 H GLY M 181 -17.365 -23.848-123.345 1.00 0.00 H
+ATOM 8659 1HA GLY M 181 -17.972 -25.655-125.035 1.00 0.00 H
+ATOM 8660 2HA GLY M 181 -16.268 -25.668-125.448 1.00 0.00 H
+ATOM 8661 N ALA M 182 -17.699 -27.369-123.276 1.00 86.39 N
+ATOM 8662 CA ALA M 182 -17.592 -28.341-122.201 1.00 59.45 C
+ATOM 8663 C ALA M 182 -18.346 -29.604-122.582 1.00 66.50 C
+ATOM 8664 O ALA M 182 -19.379 -29.552-123.255 1.00 85.65 O
+ATOM 8665 CB ALA M 182 -18.137 -27.782-120.885 1.00 63.23 C
+ATOM 8666 H ALA M 182 -18.541 -27.342-123.832 1.00 0.00 H
+ATOM 8667 HA ALA M 182 -16.537 -28.578-122.063 1.00 0.00 H
+ATOM 8668 1HB ALA M 182 -18.042 -28.535-120.103 1.00 0.00 H
+ATOM 8669 2HB ALA M 182 -17.571 -26.894-120.605 1.00 0.00 H
+ATOM 8670 3HB ALA M 182 -19.186 -27.519-121.009 1.00 0.00 H
+ATOM 8671 N LYS M 183 -17.810 -30.741-122.147 1.00 62.58 N
+ATOM 8672 CA LYS M 183 -18.444 -32.039-122.337 1.00 68.14 C
+ATOM 8673 C LYS M 183 -18.565 -32.686-120.967 1.00 77.14 C
+ATOM 8674 O LYS M 183 -17.551 -32.907-120.295 1.00 85.49 O
+ATOM 8675 CB LYS M 183 -17.630 -32.917-123.291 1.00 72.19 C
+ATOM 8676 CG LYS M 183 -18.368 -34.139-123.802 1.00 83.13 C
+ATOM 8677 CD LYS M 183 -19.620 -33.734-124.559 1.00 91.59 C
+ATOM 8678 CE LYS M 183 -20.354 -34.946-125.098 1.00 98.43 C
+ATOM 8679 NZ LYS M 183 -21.656 -34.563-125.702 1.00 98.35 N
+ATOM 8680 H LYS M 183 -16.924 -30.692-121.665 1.00 0.00 H
+ATOM 8681 HA LYS M 183 -19.431 -31.882-122.774 1.00 0.00 H
+ATOM 8682 1HB LYS M 183 -17.322 -32.327-124.155 1.00 0.00 H
+ATOM 8683 2HB LYS M 183 -16.725 -33.259-122.788 1.00 0.00 H
+ATOM 8684 1HG LYS M 183 -17.715 -34.708-124.465 1.00 0.00 H
+ATOM 8685 2HG LYS M 183 -18.645 -34.774-122.961 1.00 0.00 H
+ATOM 8686 1HD LYS M 183 -20.285 -33.182-123.894 1.00 0.00 H
+ATOM 8687 2HD LYS M 183 -19.348 -33.086-125.392 1.00 0.00 H
+ATOM 8688 1HE LYS M 183 -19.741 -35.437-125.852 1.00 0.00 H
+ATOM 8689 2HE LYS M 183 -20.531 -35.654-124.288 1.00 0.00 H
+ATOM 8690 1HZ LYS M 183 -22.122 -35.389-126.051 1.00 0.00 H
+ATOM 8691 2HZ LYS M 183 -22.235 -34.121-125.002 1.00 0.00 H
+ATOM 8692 3HZ LYS M 183 -21.498 -33.919-126.464 1.00 0.00 H
+ATOM 8693 N VAL M 184 -19.795 -32.970-120.547 1.00 73.69 N
+ATOM 8694 CA VAL M 184 -20.080 -33.464-119.203 1.00 67.15 C
+ATOM 8695 C VAL M 184 -20.663 -34.865-119.305 1.00 68.52 C
+ATOM 8696 O VAL M 184 -21.648 -35.087-120.021 1.00 76.67 O
+ATOM 8697 CB VAL M 184 -21.042 -32.530-118.446 1.00 61.27 C
+ATOM 8698 CG1 VAL M 184 -21.469 -33.165-117.138 1.00 56.72 C
+ATOM 8699 CG2 VAL M 184 -20.389 -31.178-118.197 1.00 53.77 C
+ATOM 8700 H VAL M 184 -20.559 -32.835-121.194 1.00 0.00 H
+ATOM 8701 HA VAL M 184 -19.144 -33.509-118.645 1.00 0.00 H
+ATOM 8702 HB VAL M 184 -21.942 -32.388-119.044 1.00 0.00 H
+ATOM 8703 1HG1 VAL M 184 -22.149 -32.494-116.613 1.00 0.00 H
+ATOM 8704 2HG1 VAL M 184 -21.975 -34.109-117.340 1.00 0.00 H
+ATOM 8705 3HG1 VAL M 184 -20.591 -33.348-116.519 1.00 0.00 H
+ATOM 8706 1HG2 VAL M 184 -21.084 -30.531-117.662 1.00 0.00 H
+ATOM 8707 2HG2 VAL M 184 -19.487 -31.314-117.601 1.00 0.00 H
+ATOM 8708 3HG2 VAL M 184 -20.128 -30.719-119.151 1.00 0.00 H
+ATOM 8709 N LEU M 185 -20.056 -35.805-118.583 1.00 54.75 N
+ATOM 8710 CA LEU M 185 -20.502 -37.192-118.537 1.00 55.01 C
+ATOM 8711 C LEU M 185 -20.687 -37.589-117.081 1.00 68.38 C
+ATOM 8712 O LEU M 185 -19.731 -37.556-116.300 1.00 79.74 O
+ATOM 8713 CB LEU M 185 -19.498 -38.120-119.226 1.00 60.53 C
+ATOM 8714 CG LEU M 185 -19.787 -39.620-119.106 1.00 72.50 C
+ATOM 8715 CD1 LEU M 185 -21.090 -39.976-119.802 1.00 80.96 C
+ATOM 8716 CD2 LEU M 185 -18.635 -40.443-119.667 1.00 69.97 C
+ATOM 8717 H LEU M 185 -19.247 -35.530-118.045 1.00 0.00 H
+ATOM 8718 HA LEU M 185 -21.453 -37.267-119.063 1.00 0.00 H
+ATOM 8719 1HB LEU M 185 -19.467 -37.873-120.286 1.00 0.00 H
+ATOM 8720 2HB LEU M 185 -18.510 -37.938-118.803 1.00 0.00 H
+ATOM 8721 HG LEU M 185 -19.925 -39.881-118.056 1.00 0.00 H
+ATOM 8722 1HD1 LEU M 185 -21.275 -41.046-119.704 1.00 0.00 H
+ATOM 8723 2HD1 LEU M 185 -21.910 -39.423-119.344 1.00 0.00 H
+ATOM 8724 3HD1 LEU M 185 -21.021 -39.716-120.858 1.00 0.00 H
+ATOM 8725 1HD2 LEU M 185 -18.865 -41.505-119.569 1.00 0.00 H
+ATOM 8726 2HD2 LEU M 185 -18.492 -40.198-120.720 1.00 0.00 H
+ATOM 8727 3HD2 LEU M 185 -17.723 -40.217-119.114 1.00 0.00 H
+ATOM 8728 N SER M 186 -21.909 -37.963-116.721 1.00 69.92 N
+ATOM 8729 CA SER M 186 -22.252 -38.329-115.357 1.00 71.49 C
+ATOM 8730 C SER M 186 -22.449 -39.833-115.245 1.00 72.30 C
+ATOM 8731 O SER M 186 -22.861 -40.494-116.202 1.00 86.24 O
+ATOM 8732 CB SER M 186 -23.525 -37.615-114.903 1.00 84.93 C
+ATOM 8733 OG SER M 186 -24.045 -38.211-113.727 1.00101.16 O
+ATOM 8734 H SER M 186 -22.625 -37.991-117.433 1.00 0.00 H
+ATOM 8735 HA SER M 186 -21.434 -38.026-114.701 1.00 0.00 H
+ATOM 8736 1HB SER M 186 -23.306 -36.564-114.717 1.00 0.00 H
+ATOM 8737 2HB SER M 186 -24.269 -37.658-115.697 1.00 0.00 H
+ATOM 8738 HG SER M 186 -23.449 -38.931-113.509 1.00 0.00 H
+ATOM 8739 N SER M 187 -22.157 -40.367-114.061 1.00 78.36 N
+ATOM 8740 CA SER M 187 -22.366 -41.789-113.825 1.00 98.20 C
+ATOM 8741 C SER M 187 -22.430 -42.041-112.327 1.00 98.12 C
+ATOM 8742 O SER M 187 -21.722 -41.395-111.553 1.00 98.04 O
+ATOM 8743 CB SER M 187 -21.253 -42.636-114.454 1.00102.55 C
+ATOM 8744 OG SER M 187 -20.047 -42.519-113.721 1.00113.36 O
+ATOM 8745 H SER M 187 -21.788 -39.794-113.316 1.00 0.00 H
+ATOM 8746 HA SER M 187 -23.313 -42.080-114.282 1.00 0.00 H
+ATOM 8747 1HB SER M 187 -21.563 -43.680-114.483 1.00 0.00 H
+ATOM 8748 2HB SER M 187 -21.088 -42.315-115.482 1.00 0.00 H
+ATOM 8749 HG SER M 187 -20.236 -41.921-112.994 1.00 0.00 H
+ATOM 8750 N VAL M 188 -23.277 -42.983-111.932 1.00 94.09 N
+ATOM 8751 CA VAL M 188 -23.402 -43.379-110.537 1.00 95.93 C
+ATOM 8752 C VAL M 188 -22.462 -44.546-110.274 1.00106.03 C
+ATOM 8753 O VAL M 188 -22.473 -45.542-111.006 1.00123.54 O
+ATOM 8754 CB VAL M 188 -24.855 -43.751-110.200 1.00102.57 C
+ATOM 8755 CG1 VAL M 188 -24.957 -44.224-108.759 1.00 99.82 C
+ATOM 8756 CG2 VAL M 188 -25.771 -42.563-110.445 1.00108.58 C
+ATOM 8757 H VAL M 188 -23.853 -43.438-112.626 1.00 0.00 H
+ATOM 8758 HA VAL M 188 -23.108 -42.536-109.910 1.00 0.00 H
+ATOM 8759 HB VAL M 188 -25.164 -44.582-110.834 1.00 0.00 H
+ATOM 8760 1HG1 VAL M 188 -25.992 -44.485-108.534 1.00 0.00 H
+ATOM 8761 2HG1 VAL M 188 -24.324 -45.100-108.618 1.00 0.00 H
+ATOM 8762 3HG1 VAL M 188 -24.631 -43.427-108.091 1.00 0.00 H
+ATOM 8763 1HG2 VAL M 188 -26.797 -42.839-110.204 1.00 0.00 H
+ATOM 8764 2HG2 VAL M 188 -25.461 -41.729-109.815 1.00 0.00 H
+ATOM 8765 3HG2 VAL M 188 -25.712 -42.268-111.493 1.00 0.00 H
+ATOM 8766 N LYS M 189 -21.645 -44.424-109.231 1.00112.02 N
+ATOM 8767 CA LYS M 189 -20.692 -45.466-108.878 1.00121.00 C
+ATOM 8768 C LYS M 189 -20.442 -45.423-107.379 1.00125.48 C
+ATOM 8769 O LYS M 189 -20.310 -44.343-106.797 1.00112.65 O
+ATOM 8770 CB LYS M 189 -19.381 -45.298-109.648 1.00116.57 C
+ATOM 8771 CG LYS M 189 -18.377 -46.423-109.435 1.00 0.00 C
+ATOM 8772 CD LYS M 189 -17.144 -46.236-110.306 1.00 0.00 C
+ATOM 8773 CE LYS M 189 -16.142 -47.362-110.096 1.00 0.00 C
+ATOM 8774 NZ LYS M 189 -14.930 -47.192-110.943 1.00 0.00 N
+ATOM 8775 H LYS M 189 -21.688 -43.586-108.669 1.00 0.00 H
+ATOM 8776 HA LYS M 189 -21.121 -46.432-109.146 1.00 0.00 H
+ATOM 8777 1HB LYS M 189 -19.592 -45.236-110.716 1.00 0.00 H
+ATOM 8778 2HB LYS M 189 -18.904 -44.363-109.354 1.00 0.00 H
+ATOM 8779 1HG LYS M 189 -18.073 -46.445-108.388 1.00 0.00 H
+ATOM 8780 2HG LYS M 189 -18.843 -47.377-109.679 1.00 0.00 H
+ATOM 8781 1HD LYS M 189 -17.440 -46.214-111.355 1.00 0.00 H
+ATOM 8782 2HD LYS M 189 -16.666 -45.288-110.061 1.00 0.00 H
+ATOM 8783 1HE LYS M 189 -15.839 -47.389-109.051 1.00 0.00 H
+ATOM 8784 2HE LYS M 189 -16.610 -48.315-110.341 1.00 0.00 H
+ATOM 8785 1HZ LYS M 189 -14.292 -47.957-110.775 1.00 0.00 H
+ATOM 8786 2HZ LYS M 189 -15.197 -47.184-111.917 1.00 0.00 H
+ATOM 8787 3HZ LYS M 189 -14.476 -46.320-110.711 1.00 0.00 H
+ATOM 8788 N ASP M 190 -20.380 -46.607-106.764 1.00139.74 N
+ATOM 8789 CA ASP M 190 -20.132 -46.743-105.327 1.00148.34 C
+ATOM 8790 C ASP M 190 -21.140 -45.935-104.512 1.00147.15 C
+ATOM 8791 O ASP M 190 -20.795 -45.285-103.522 1.00141.30 O
+ATOM 8792 CB ASP M 190 -18.711 -46.291-104.982 1.00145.40 C
+ATOM 8793 CG ASP M 190 -17.640 -47.166-105.619 1.00 0.00 C
+ATOM 8794 OD1 ASP M 190 -17.796 -48.364-105.610 1.00 0.00 O
+ATOM 8795 OD2 ASP M 190 -16.675 -46.628-106.109 1.00 0.00 O
+ATOM 8796 H ASP M 190 -20.511 -47.439-107.322 1.00 0.00 H
+ATOM 8797 HA ASP M 190 -20.275 -47.787-105.049 1.00 0.00 H
+ATOM 8798 1HB ASP M 190 -18.565 -45.263-105.315 1.00 0.00 H
+ATOM 8799 2HB ASP M 190 -18.576 -46.307-103.900 1.00 0.00 H
+ATOM 8800 N ARG M 191 -22.401 -45.969-104.951 1.00148.91 N
+ATOM 8801 CA ARG M 191 -23.517 -45.333-104.247 1.00145.83 C
+ATOM 8802 C ARG M 191 -23.379 -43.809-104.210 1.00138.55 C
+ATOM 8803 O ARG M 191 -23.759 -43.166-103.232 1.00140.55 O
+ATOM 8804 CB ARG M 191 -23.614 -45.860-102.823 1.00142.48 C
+ATOM 8805 CG ARG M 191 -23.845 -47.359-102.710 1.00 0.00 C
+ATOM 8806 CD ARG M 191 -24.006 -47.784-101.296 1.00 0.00 C
+ATOM 8807 NE ARG M 191 -24.221 -49.218-101.182 1.00 0.00 N
+ATOM 8808 CZ ARG M 191 -24.319 -49.887-100.017 1.00 0.00 C
+ATOM 8809 NH1 ARG M 191 -24.221 -49.239 -98.877 1.00 0.00 N
+ATOM 8810 NH2 ARG M 191 -24.515 -51.194-100.020 1.00 0.00 N
+ATOM 8811 H ARG M 191 -22.581 -46.462-105.814 1.00 0.00 H
+ATOM 8812 HA ARG M 191 -24.435 -45.536-104.799 1.00 0.00 H
+ATOM 8813 1HB ARG M 191 -22.696 -45.627-102.286 1.00 0.00 H
+ATOM 8814 2HB ARG M 191 -24.432 -45.360-102.305 1.00 0.00 H
+ATOM 8815 1HG ARG M 191 -24.750 -47.629-103.254 1.00 0.00 H
+ATOM 8816 2HG ARG M 191 -22.993 -47.891-103.134 1.00 0.00 H
+ATOM 8817 1HD ARG M 191 -23.108 -47.529-100.735 1.00 0.00 H
+ATOM 8818 2HD ARG M 191 -24.864 -47.276-100.858 1.00 0.00 H
+ATOM 8819 HE ARG M 191 -24.301 -49.750-102.038 1.00 0.00 H
+ATOM 8820 1HH1 ARG M 191 -24.071 -48.240 -98.875 1.00 0.00 H
+ATOM 8821 2HH1 ARG M 191 -24.295 -49.740 -98.004 1.00 0.00 H
+ATOM 8822 1HH2 ARG M 191 -24.591 -51.692-100.896 1.00 0.00 H
+ATOM 8823 2HH2 ARG M 191 -24.589 -51.695 -99.147 1.00 0.00 H
+ATOM 8824 N PHE M 192 -22.854 -43.225-105.287 1.00125.45 N
+ATOM 8825 CA PHE M 192 -22.678 -41.781-105.375 1.00109.29 C
+ATOM 8826 C PHE M 192 -22.730 -41.361-106.837 1.00 98.72 C
+ATOM 8827 O PHE M 192 -22.549 -42.178-107.741 1.00111.67 O
+ATOM 8828 CB PHE M 192 -21.357 -41.335-104.738 1.00117.81 C
+ATOM 8829 CG PHE M 192 -21.428 -41.171-103.247 1.00134.85 C
+ATOM 8830 CD1 PHE M 192 -20.455 -41.725-102.430 1.00133.96 C
+ATOM 8831 CD2 PHE M 192 -22.459 -40.454-102.661 1.00143.28 C
+ATOM 8832 CE1 PHE M 192 -20.515 -41.576-101.058 1.00133.23 C
+ATOM 8833 CE2 PHE M 192 -22.525 -40.302-101.288 1.00139.31 C
+ATOM 8834 CZ PHE M 192 -21.551 -40.863-100.486 1.00135.80 C
+ATOM 8835 H PHE M 192 -22.570 -43.804-106.065 1.00 0.00 H
+ATOM 8836 HA PHE M 192 -23.495 -41.299-104.835 1.00 0.00 H
+ATOM 8837 1HB PHE M 192 -20.580 -42.065-104.963 1.00 0.00 H
+ATOM 8838 2HB PHE M 192 -21.048 -40.384-105.170 1.00 0.00 H
+ATOM 8839 HD1 PHE M 192 -19.635 -42.283-102.882 1.00 0.00 H
+ATOM 8840 HD2 PHE M 192 -23.228 -40.012-103.296 1.00 0.00 H
+ATOM 8841 HE1 PHE M 192 -19.745 -42.021-100.428 1.00 0.00 H
+ATOM 8842 HE2 PHE M 192 -23.344 -39.741-100.838 1.00 0.00 H
+ATOM 8843 HZ PHE M 192 -21.600 -40.745 -99.404 1.00 0.00 H
+ATOM 8844 N ILE M 193 -22.975 -40.071-107.059 1.00 89.35 N
+ATOM 8845 CA ILE M 193 -23.071 -39.498-108.400 1.00 86.00 C
+ATOM 8846 C ILE M 193 -21.766 -38.787-108.727 1.00 94.26 C
+ATOM 8847 O ILE M 193 -21.295 -37.944-107.951 1.00102.40 O
+ATOM 8848 CB ILE M 193 -24.250 -38.514-108.513 1.00 82.17 C
+ATOM 8849 CG1 ILE M 193 -25.574 -39.234-108.245 1.00 91.27 C
+ATOM 8850 CG2 ILE M 193 -24.265 -37.858-109.885 1.00 61.93 C
+ATOM 8851 CD1 ILE M 193 -26.754 -38.303-108.087 1.00 0.00 C
+ATOM 8852 H ILE M 193 -23.099 -39.470-106.257 1.00 0.00 H
+ATOM 8853 HA ILE M 193 -23.221 -40.308-109.112 1.00 0.00 H
+ATOM 8854 HB ILE M 193 -24.152 -37.740-107.752 1.00 0.00 H
+ATOM 8855 1HG1 ILE M 193 -25.787 -39.919-109.065 1.00 0.00 H
+ATOM 8856 2HG1 ILE M 193 -25.487 -39.830-107.337 1.00 0.00 H
+ATOM 8857 1HG2 ILE M 193 -25.105 -37.166-109.949 1.00 0.00 H
+ATOM 8858 2HG2 ILE M 193 -23.334 -37.314-110.038 1.00 0.00 H
+ATOM 8859 3HG2 ILE M 193 -24.368 -38.624-110.654 1.00 0.00 H
+ATOM 8860 1HD1 ILE M 193 -27.656 -38.887-107.899 1.00 0.00 H
+ATOM 8861 2HD1 ILE M 193 -26.577 -37.630-107.248 1.00 0.00 H
+ATOM 8862 3HD1 ILE M 193 -26.883 -37.721-108.999 1.00 0.00 H
+ATOM 8863 N ASN M 194 -21.189 -39.112-109.883 1.00 88.95 N
+ATOM 8864 CA ASN M 194 -19.911 -38.565-110.316 1.00 84.79 C
+ATOM 8865 C ASN M 194 -20.065 -37.816-111.634 1.00 80.26 C
+ATOM 8866 O ASN M 194 -20.830 -38.230-112.515 1.00 87.08 O
+ATOM 8867 CB ASN M 194 -18.864 -39.669-110.469 1.00 90.39 C
+ATOM 8868 CG ASN M 194 -18.480 -40.294-109.146 1.00104.39 C
+ATOM 8869 OD1 ASN M 194 -18.946 -41.380-108.804 1.00117.66 O
+ATOM 8870 ND2 ASN M 194 -17.627 -39.611-108.393 1.00115.09 N
+ATOM 8871 H ASN M 194 -21.670 -39.770-110.479 1.00 0.00 H
+ATOM 8872 HA ASN M 194 -19.561 -37.862-109.559 1.00 0.00 H
+ATOM 8873 1HB ASN M 194 -19.250 -40.448-111.127 1.00 0.00 H
+ATOM 8874 2HB ASN M 194 -17.969 -39.259-110.937 1.00 0.00 H
+ATOM 8875 1HD2 ASN M 194 -17.338 -39.976-107.508 1.00 0.00 H
+ATOM 8876 2HD2 ASN M 194 -17.274 -38.732-108.710 1.00 0.00 H
+ATOM 8877 N PHE M 195 -19.307 -36.727-111.760 1.00 67.72 N
+ATOM 8878 CA PHE M 195 -19.341 -35.808-112.897 1.00 62.64 C
+ATOM 8879 C PHE M 195 -17.940 -35.698-113.493 1.00 64.91 C
+ATOM 8880 O PHE M 195 -17.076 -34.998-112.948 1.00 62.83 O
+ATOM 8881 CB PHE M 195 -19.854 -34.438-112.465 1.00 55.44 C
+ATOM 8882 CG PHE M 195 -21.320 -34.244-112.683 1.00 69.21 C
+ATOM 8883 CD1 PHE M 195 -22.226 -35.202-112.265 1.00 74.99 C
+ATOM 8884 CD2 PHE M 195 -21.795 -33.087-113.282 1.00 63.97 C
+ATOM 8885 CE1 PHE M 195 -23.581 -35.021-112.460 1.00 85.26 C
+ATOM 8886 CE2 PHE M 195 -23.149 -32.897-113.477 1.00 69.71 C
+ATOM 8887 CZ PHE M 195 -24.043 -33.865-113.066 1.00 85.64 C
+ATOM 8888 H PHE M 195 -18.669 -36.545-110.999 1.00 0.00 H
+ATOM 8889 HA PHE M 195 -20.020 -36.212-113.649 1.00 0.00 H
+ATOM 8890 1HB PHE M 195 -19.646 -34.289-111.406 1.00 0.00 H
+ATOM 8891 2HB PHE M 195 -19.324 -33.661-113.015 1.00 0.00 H
+ATOM 8892 HD1 PHE M 195 -21.859 -36.105-111.777 1.00 0.00 H
+ATOM 8893 HD2 PHE M 195 -21.086 -32.325-113.606 1.00 0.00 H
+ATOM 8894 HE1 PHE M 195 -24.285 -35.788-112.137 1.00 0.00 H
+ATOM 8895 HE2 PHE M 195 -23.513 -31.987-113.954 1.00 0.00 H
+ATOM 8896 HZ PHE M 195 -25.111 -33.719-113.220 1.00 0.00 H
+ATOM 8897 N PHE M 196 -17.721 -36.389-114.610 1.00 67.18 N
+ATOM 8898 CA PHE M 196 -16.497 -36.263-115.392 1.00 60.26 C
+ATOM 8899 C PHE M 196 -16.682 -35.137-116.405 1.00 64.06 C
+ATOM 8900 O PHE M 196 -17.549 -35.222-117.281 1.00 70.21 O
+ATOM 8901 CB PHE M 196 -16.174 -37.576-116.099 1.00 57.58 C
+ATOM 8902 CG PHE M 196 -16.122 -38.763-115.182 1.00 66.61 C
+ATOM 8903 CD1 PHE M 196 -17.259 -39.510-114.927 1.00 73.49 C
+ATOM 8904 CD2 PHE M 196 -14.929 -39.148-114.591 1.00 80.96 C
+ATOM 8905 CE1 PHE M 196 -17.213 -40.609-114.087 1.00 73.52 C
+ATOM 8906 CE2 PHE M 196 -14.875 -40.247-113.752 1.00 79.29 C
+ATOM 8907 CZ PHE M 196 -16.018 -40.978-113.500 1.00 71.85 C
+ATOM 8908 H PHE M 196 -18.440 -37.026-114.921 1.00 0.00 H
+ATOM 8909 HA PHE M 196 -15.677 -36.022-114.714 1.00 0.00 H
+ATOM 8910 1HB PHE M 196 -16.924 -37.771-116.864 1.00 0.00 H
+ATOM 8911 2HB PHE M 196 -15.210 -37.492-116.600 1.00 0.00 H
+ATOM 8912 HD1 PHE M 196 -18.200 -39.225-115.397 1.00 0.00 H
+ATOM 8913 HD2 PHE M 196 -14.026 -38.570-114.790 1.00 0.00 H
+ATOM 8914 HE1 PHE M 196 -18.119 -41.182-113.890 1.00 0.00 H
+ATOM 8915 HE2 PHE M 196 -13.931 -40.536-113.289 1.00 0.00 H
+ATOM 8916 HZ PHE M 196 -15.979 -41.843-112.839 1.00 0.00 H
+ATOM 8917 N VAL M 197 -15.877 -34.084-116.285 1.00 59.11 N
+ATOM 8918 CA VAL M 197 -16.073 -32.858-117.051 1.00 61.38 C
+ATOM 8919 C VAL M 197 -14.800 -32.536-117.818 1.00 67.83 C
+ATOM 8920 O VAL M 197 -13.704 -32.535-117.242 1.00 60.61 O
+ATOM 8921 CB VAL M 197 -16.468 -31.676-116.146 1.00 64.69 C
+ATOM 8922 CG1 VAL M 197 -16.550 -30.397-116.958 1.00 58.43 C
+ATOM 8923 CG2 VAL M 197 -17.793 -31.952-115.453 1.00 71.99 C
+ATOM 8924 H VAL M 197 -15.103 -34.142-115.638 1.00 0.00 H
+ATOM 8925 HA VAL M 197 -16.881 -33.021-117.765 1.00 0.00 H
+ATOM 8926 HB VAL M 197 -15.693 -31.532-115.393 1.00 0.00 H
+ATOM 8927 1HG1 VAL M 197 -16.830 -29.569-116.306 1.00 0.00 H
+ATOM 8928 2HG1 VAL M 197 -15.580 -30.190-117.410 1.00 0.00 H
+ATOM 8929 3HG1 VAL M 197 -17.300 -30.511-117.741 1.00 0.00 H
+ATOM 8930 1HG2 VAL M 197 -18.054 -31.106-114.818 1.00 0.00 H
+ATOM 8931 2HG2 VAL M 197 -18.572 -32.098-116.202 1.00 0.00 H
+ATOM 8932 3HG2 VAL M 197 -17.704 -32.850-114.842 1.00 0.00 H
+ATOM 8933 N GLY M 198 -14.954 -32.263-119.115 1.00 75.70 N
+ATOM 8934 CA GLY M 198 -13.892 -31.718-119.937 1.00 67.17 C
+ATOM 8935 C GLY M 198 -14.207 -30.294-120.350 1.00 71.11 C
+ATOM 8936 O GLY M 198 -15.246 -30.038-120.965 1.00 61.22 O
+ATOM 8937 H GLY M 198 -15.854 -32.448-119.533 1.00 0.00 H
+ATOM 8938 1HA GLY M 198 -12.953 -31.745-119.383 1.00 0.00 H
+ATOM 8939 2HA GLY M 198 -13.761 -32.340-120.822 1.00 0.00 H
+ATOM 8940 N ASN M 199 -13.326 -29.358-120.007 1.00 79.42 N
+ATOM 8941 CA ASN M 199 -13.549 -27.939-120.245 1.00 77.19 C
+ATOM 8942 C ASN M 199 -12.479 -27.383-121.170 1.00 75.16 C
+ATOM 8943 O ASN M 199 -11.294 -27.706-121.036 1.00 87.49 O
+ATOM 8944 CB ASN M 199 -13.545 -27.144-118.934 1.00 84.08 C
+ATOM 8945 CG ASN M 199 -14.746 -27.441-118.064 1.00 89.15 C
+ATOM 8946 OD1 ASN M 199 -15.862 -27.596-118.556 1.00 87.91 O
+ATOM 8947 ND2 ASN M 199 -14.524 -27.512-116.758 1.00102.16 N
+ATOM 8948 H ASN M 199 -12.468 -29.654-119.563 1.00 0.00 H
+ATOM 8949 HA ASN M 199 -14.526 -27.816-120.715 1.00 0.00 H
+ATOM 8950 1HB ASN M 199 -12.640 -27.375-118.371 1.00 0.00 H
+ATOM 8951 2HB ASN M 199 -13.529 -26.077-119.156 1.00 0.00 H
+ATOM 8952 1HD2 ASN M 199 -15.280 -27.706-116.132 1.00 0.00 H
+ATOM 8953 2HD2 ASN M 199 -13.602 -27.372-116.400 1.00 0.00 H
+ATOM 8954 N THR M 200 -12.907 -26.540-122.105 1.00 64.24 N
+ATOM 8955 CA THR M 200 -11.995 -25.762-122.932 1.00 75.97 C
+ATOM 8956 C THR M 200 -11.736 -24.425-122.248 1.00 90.75 C
+ATOM 8957 O THR M 200 -12.682 -23.741-121.846 1.00 98.84 O
+ATOM 8958 CB THR M 200 -12.585 -25.542-124.325 1.00 71.62 C
+ATOM 8959 OG1 THR M 200 -12.716 -26.801-124.998 1.00 76.89 O
+ATOM 8960 CG2 THR M 200 -11.692 -24.624-125.141 1.00 64.43 C
+ATOM 8961 H THR M 200 -13.903 -26.440-122.242 1.00 0.00 H
+ATOM 8962 HA THR M 200 -11.062 -26.317-123.034 1.00 0.00 H
+ATOM 8963 HB THR M 200 -13.574 -25.092-124.234 1.00 0.00 H
+ATOM 8964 HG1 THR M 200 -12.404 -27.504-124.424 1.00 0.00 H
+ATOM 8965 1HG2 THR M 200 -12.127 -24.478-126.130 1.00 0.00 H
+ATOM 8966 2HG2 THR M 200 -11.603 -23.662-124.637 1.00 0.00 H
+ATOM 8967 3HG2 THR M 200 -10.705 -25.073-125.242 1.00 0.00 H
+ATOM 8968 N ILE M 201 -10.465 -24.051-122.112 1.00 86.84 N
+ATOM 8969 CA ILE M 201 -10.081 -22.891-121.311 1.00 94.04 C
+ATOM 8970 C ILE M 201 -9.494 -21.798-122.197 1.00105.81 C
+ATOM 8971 O ILE M 201 -8.645 -22.061-123.059 1.00104.50 O
+ATOM 8972 CB ILE M 201 -9.105 -23.276-120.184 1.00 91.38 C
+ATOM 8973 CG1 ILE M 201 -7.740 -23.701-120.739 1.00103.70 C
+ATOM 8974 CG2 ILE M 201 -9.708 -24.357-119.303 1.00 70.43 C
+ATOM 8975 CD1 ILE M 201 -6.826 -24.295-119.693 1.00108.43 C
+ATOM 8976 H ILE M 201 -9.747 -24.587-122.578 1.00 0.00 H
+ATOM 8977 HA ILE M 201 -10.978 -22.475-120.854 1.00 0.00 H
+ATOM 8978 HB ILE M 201 -8.892 -22.400-119.572 1.00 0.00 H
+ATOM 8979 1HG1 ILE M 201 -7.882 -24.435-121.531 1.00 0.00 H
+ATOM 8980 2HG1 ILE M 201 -7.242 -22.838-121.181 1.00 0.00 H
+ATOM 8981 1HG2 ILE M 201 -9.004 -24.617-118.513 1.00 0.00 H
+ATOM 8982 2HG2 ILE M 201 -10.633 -23.990-118.859 1.00 0.00 H
+ATOM 8983 3HG2 ILE M 201 -9.920 -25.241-119.905 1.00 0.00 H
+ATOM 8984 1HD1 ILE M 201 -5.878 -24.573-120.154 1.00 0.00 H
+ATOM 8985 2HD1 ILE M 201 -6.646 -23.560-118.907 1.00 0.00 H
+ATOM 8986 3HD1 ILE M 201 -7.293 -25.180-119.263 1.00 0.00 H
+ATOM 8987 N ASN M 202 -9.962 -20.573-121.980 1.00118.22 N
+ATOM 8988 CA ASN M 202 -9.392 -19.333-122.486 1.00122.57 C
+ATOM 8989 C ASN M 202 -8.366 -18.878-121.458 1.00124.96 C
+ATOM 8990 O ASN M 202 -8.396 -19.300-120.302 1.00122.41 O
+ATOM 8991 CB ASN M 202 -10.512 -18.303-122.640 1.00133.16 C
+ATOM 8992 CG ASN M 202 -10.210 -17.145-123.585 1.00144.98 C
+ATOM 8993 OD1 ASN M 202 -9.107 -16.917-124.080 1.00131.36 O
+ATOM 8994 ND2 ASN M 202 -11.300 -16.419-123.845 1.00181.39 N
+ATOM 8995 H ASN M 202 -10.792 -20.535-121.406 1.00 0.00 H
+ATOM 8996 HA ASN M 202 -8.943 -19.531-123.461 1.00 0.00 H
+ATOM 8997 1HB ASN M 202 -11.412 -18.797-123.008 1.00 0.00 H
+ATOM 8998 2HB ASN M 202 -10.749 -17.874-121.666 1.00 0.00 H
+ATOM 8999 1HD2 ASN M 202 -11.240 -15.627-124.453 1.00 0.00 H
+ATOM 9000 2HD2 ASN M 202 -12.176 -16.667-123.432 1.00 0.00 H
+ATOM 9001 N SER M 203 -7.445 -18.018-121.875 1.00132.64 N
+ATOM 9002 CA SER M 203 -6.409 -17.612-120.932 1.00137.24 C
+ATOM 9003 C SER M 203 -6.917 -16.613-119.900 1.00134.46 C
+ATOM 9004 O SER M 203 -6.260 -16.416-118.872 1.00129.29 O
+ATOM 9005 CB SER M 203 -5.215 -17.025-121.682 1.00145.20 C
+ATOM 9006 OG SER M 203 -4.795 -17.896-122.722 1.00146.13 O
+ATOM 9007 H SER M 203 -7.435 -17.638-122.811 1.00 0.00 H
+ATOM 9008 HA SER M 203 -6.079 -18.493-120.380 1.00 0.00 H
+ATOM 9009 1HB SER M 203 -5.489 -16.057-122.101 1.00 0.00 H
+ATOM 9010 2HB SER M 203 -4.394 -16.860-120.986 1.00 0.00 H
+ATOM 9011 HG SER M 203 -5.385 -18.653-122.688 1.00 0.00 H
+ATOM 9012 N SER M 204 -8.070 -15.984-120.147 1.00143.72 N
+ATOM 9013 CA SER M 204 -8.580 -14.968-119.230 1.00156.17 C
+ATOM 9014 C SER M 204 -9.187 -15.585-117.978 1.00159.01 C
+ATOM 9015 O SER M 204 -9.245 -14.929-116.932 1.00167.91 O
+ATOM 9016 CB SER M 204 -9.610 -14.093-119.943 1.00158.57 C
+ATOM 9017 OG SER M 204 -10.884 -14.718-119.969 1.00150.53 O
+ATOM 9018 H SER M 204 -8.601 -16.209-120.976 1.00 0.00 H
+ATOM 9019 HA SER M 204 -7.746 -14.342-118.908 1.00 0.00 H
+ATOM 9020 1HB SER M 204 -9.685 -13.132-119.434 1.00 0.00 H
+ATOM 9021 2HB SER M 204 -9.279 -13.898-120.962 1.00 0.00 H
+ATOM 9022 HG SER M 204 -10.775 -15.559-119.519 1.00 0.00 H
+ATOM 9023 N TYR M 205 -9.655 -16.830-118.066 1.00159.42 N
+ATOM 9024 CA TYR M 205 -10.227 -17.490-116.898 1.00167.80 C
+ATOM 9025 C TYR M 205 -9.186 -17.665-115.799 1.00186.41 C
+ATOM 9026 O TYR M 205 -9.412 -17.279-114.645 1.00188.69 O
+ATOM 9027 CB TYR M 205 -10.816 -18.846-117.292 1.00158.90 C
+ATOM 9028 CG TYR M 205 -12.016 -18.767-118.203 1.00155.07 C
+ATOM 9029 CD1 TYR M 205 -13.298 -18.618-117.680 1.00153.85 C
+ATOM 9030 CD2 TYR M 205 -11.879 -18.857-119.575 1.00155.75 C
+ATOM 9031 CE1 TYR M 205 -14.402 -18.553-118.510 1.00152.74 C
+ATOM 9032 CE2 TYR M 205 -12.975 -18.793-120.408 1.00155.15 C
+ATOM 9033 CZ TYR M 205 -14.231 -18.641-119.873 1.00154.48 C
+ATOM 9034 OH TYR M 205 -15.319 -18.578-120.712 1.00155.85 O
+ATOM 9035 H TYR M 205 -9.618 -17.328-118.944 1.00 0.00 H
+ATOM 9036 HA TYR M 205 -11.026 -16.862-116.502 1.00 0.00 H
+ATOM 9037 1HB TYR M 205 -10.053 -19.442-117.796 1.00 0.00 H
+ATOM 9038 2HB TYR M 205 -11.114 -19.388-116.395 1.00 0.00 H
+ATOM 9039 HD1 TYR M 205 -13.442 -18.551-116.601 1.00 0.00 H
+ATOM 9040 HD2 TYR M 205 -10.890 -18.982-120.017 1.00 0.00 H
+ATOM 9041 HE1 TYR M 205 -15.398 -18.436-118.084 1.00 0.00 H
+ATOM 9042 HE2 TYR M 205 -12.844 -18.864-121.488 1.00 0.00 H
+ATOM 9043 HH TYR M 205 -15.024 -18.655-121.623 1.00 0.00 H
+ATOM 9044 N PHE M 206 -8.029 -18.232-116.155 1.00203.55 N
+ATOM 9045 CA PHE M 206 -6.962 -18.581-115.211 1.00201.15 C
+ATOM 9046 C PHE M 206 -6.690 -17.531-114.135 1.00213.87 C
+ATOM 9047 O PHE M 206 -6.577 -17.913-112.959 1.00229.95 O
+ATOM 9048 CB PHE M 206 -5.689 -18.884-116.016 1.00188.48 C
+ATOM 9049 CG PHE M 206 -5.401 -20.348-116.181 1.00171.69 C
+ATOM 9050 CD1 PHE M 206 -5.195 -20.868-117.436 1.00166.20 C
+ATOM 9051 CD2 PHE M 206 -5.311 -21.196-115.091 1.00161.46 C
+ATOM 9052 CE1 PHE M 206 -4.925 -22.205-117.616 1.00155.64 C
+ATOM 9053 CE2 PHE M 206 -5.035 -22.541-115.272 1.00153.81 C
+ATOM 9054 CZ PHE M 206 -4.843 -23.042-116.533 1.00149.84 C
+ATOM 9055 H PHE M 206 -7.899 -18.425-117.138 1.00 0.00 H
+ATOM 9056 HA PHE M 206 -7.267 -19.469-114.657 1.00 0.00 H
+ATOM 9057 1HB PHE M 206 -5.773 -18.443-117.009 1.00 0.00 H
+ATOM 9058 2HB PHE M 206 -4.831 -18.425-115.526 1.00 0.00 H
+ATOM 9059 HD1 PHE M 206 -5.246 -20.207-118.301 1.00 0.00 H
+ATOM 9060 HD2 PHE M 206 -5.464 -20.802-114.086 1.00 0.00 H
+ATOM 9061 HE1 PHE M 206 -4.776 -22.600-118.621 1.00 0.00 H
+ATOM 9062 HE2 PHE M 206 -4.971 -23.202-114.408 1.00 0.00 H
+ATOM 9063 HZ PHE M 206 -4.628 -24.100-116.676 1.00 0.00 H
+ATOM 9064 N PRO M 207 -6.583 -16.225-114.439 1.00188.56 N
+ATOM 9065 CA PRO M 207 -6.254 -15.277-113.355 1.00173.83 C
+ATOM 9066 C PRO M 207 -7.270 -15.235-112.224 1.00160.94 C
+ATOM 9067 O PRO M 207 -6.885 -15.310-111.051 1.00143.74 O
+ATOM 9068 CB PRO M 207 -6.165 -13.932-114.092 1.00174.73 C
+ATOM 9069 CG PRO M 207 -5.691 -14.293-115.429 1.00175.75 C
+ATOM 9070 CD PRO M 207 -6.443 -15.569-115.758 1.00176.28 C
+ATOM 9071 HA PRO M 207 -5.283 -15.552-112.916 1.00 0.00 H
+ATOM 9072 1HB PRO M 207 -7.150 -13.443-114.104 1.00 0.00 H
+ATOM 9073 2HB PRO M 207 -5.478 -13.257-113.561 1.00 0.00 H
+ATOM 9074 1HG PRO M 207 -5.902 -13.480-116.139 1.00 0.00 H
+ATOM 9075 2HG PRO M 207 -4.600 -14.432-115.420 1.00 0.00 H
+ATOM 9076 1HD PRO M 207 -7.422 -15.317-116.193 1.00 0.00 H
+ATOM 9077 2HD PRO M 207 -5.851 -16.174-116.460 1.00 0.00 H
+ATOM 9078 N ASP M 208 -8.560 -15.120-112.536 1.00164.02 N
+ATOM 9079 CA ASP M 208 -9.588 -14.922-111.520 1.00165.56 C
+ATOM 9080 C ASP M 208 -10.525 -16.117-111.392 1.00159.40 C
+ATOM 9081 O ASP M 208 -10.708 -16.642-110.290 1.00141.16 O
+ATOM 9082 CB ASP M 208 -10.406 -13.668-111.837 1.00168.10 C
+ATOM 9083 CG ASP M 208 -9.585 -12.388-111.758 1.00 0.00 C
+ATOM 9084 OD1 ASP M 208 -8.861 -12.228-110.803 1.00 0.00 O
+ATOM 9085 OD2 ASP M 208 -9.688 -11.583-112.652 1.00 0.00 O
+ATOM 9086 H ASP M 208 -8.832 -15.172-113.507 1.00 0.00 H
+ATOM 9087 HA ASP M 208 -9.100 -14.803-110.552 1.00 0.00 H
+ATOM 9088 1HB ASP M 208 -10.826 -13.751-112.840 1.00 0.00 H
+ATOM 9089 2HB ASP M 208 -11.240 -13.591-111.138 1.00 0.00 H
+ATOM 9090 N HIS M 209 -11.136 -16.556-112.496 1.00167.57 N
+ATOM 9091 CA HIS M 209 -12.120 -17.637-112.508 1.00168.65 C
+ATOM 9092 C HIS M 209 -11.574 -18.851-113.248 1.00162.27 C
+ATOM 9093 O HIS M 209 -11.836 -19.020-114.450 1.00160.16 O
+ATOM 9094 CB HIS M 209 -13.429 -17.164-113.148 1.00169.91 C
+ATOM 9095 CG HIS M 209 -14.456 -18.246-113.302 1.00165.72 C
+ATOM 9096 ND1 HIS M 209 -15.019 -18.904-112.229 1.00167.20 N
+ATOM 9097 CD2 HIS M 209 -15.016 -18.788-114.410 1.00152.84 C
+ATOM 9098 CE1 HIS M 209 -15.883 -19.803-112.671 1.00158.09 C
+ATOM 9099 NE2 HIS M 209 -15.900 -19.751-113.990 1.00148.82 N
+ATOM 9100 H HIS M 209 -10.892 -16.103-113.365 1.00 0.00 H
+ATOM 9101 HA HIS M 209 -12.335 -17.945-111.485 1.00 0.00 H
+ATOM 9102 1HB HIS M 209 -13.863 -16.368-112.543 1.00 0.00 H
+ATOM 9103 2HB HIS M 209 -13.223 -16.750-114.134 1.00 0.00 H
+ATOM 9104 HD2 HIS M 209 -14.805 -18.509-115.443 1.00 0.00 H
+ATOM 9105 HE1 HIS M 209 -16.480 -20.472-112.052 1.00 0.00 H
+ATOM 9106 HE2 HIS M 209 -16.469 -20.324-114.597 1.00 0.00 H
+ATOM 9107 N PRO M 210 -10.835 -19.737-112.580 1.00158.13 N
+ATOM 9108 CA PRO M 210 -10.221 -20.873-113.271 1.00153.65 C
+ATOM 9109 C PRO M 210 -11.073 -22.128-113.225 1.00142.28 C
+ATOM 9110 O PRO M 210 -11.864 -22.342-112.311 1.00147.63 O
+ATOM 9111 CB PRO M 210 -8.919 -21.071-112.483 1.00154.72 C
+ATOM 9112 CG PRO M 210 -9.320 -20.734-111.080 1.00155.20 C
+ATOM 9113 CD PRO M 210 -10.390 -19.653-111.174 1.00156.69 C
+ATOM 9114 HA PRO M 210 -10.017 -20.594-114.315 1.00 0.00 H
+ATOM 9115 1HB PRO M 210 -8.562 -22.105-112.599 1.00 0.00 H
+ATOM 9116 2HB PRO M 210 -8.133 -20.413-112.883 1.00 0.00 H
+ATOM 9117 1HG PRO M 210 -9.699 -21.631-110.567 1.00 0.00 H
+ATOM 9118 2HG PRO M 210 -8.447 -20.386-110.509 1.00 0.00 H
+ATOM 9119 1HD PRO M 210 -11.208 -19.884-110.476 1.00 0.00 H
+ATOM 9120 2HD PRO M 210 -9.945 -18.675-110.940 1.00 0.00 H
+ATOM 9121 N LEU M 211 -10.875 -22.974-114.229 1.00124.08 N
+ATOM 9122 CA LEU M 211 -11.556 -24.255-114.344 1.00103.36 C
+ATOM 9123 C LEU M 211 -10.519 -25.332-114.632 1.00100.93 C
+ATOM 9124 O LEU M 211 -9.324 -25.054-114.770 1.00115.99 O
+ATOM 9125 CB LEU M 211 -12.630 -24.211-115.436 1.00 89.26 C
+ATOM 9126 CG LEU M 211 -13.903 -23.447-115.073 1.00 81.60 C
+ATOM 9127 CD1 LEU M 211 -14.579 -22.920-116.337 1.00 66.96 C
+ATOM 9128 CD2 LEU M 211 -14.855 -24.302-114.255 1.00 72.39 C
+ATOM 9129 H LEU M 211 -10.215 -22.702-114.943 1.00 0.00 H
+ATOM 9130 HA LEU M 211 -12.041 -24.475-113.394 1.00 0.00 H
+ATOM 9131 1HB LEU M 211 -12.204 -23.747-116.324 1.00 0.00 H
+ATOM 9132 2HB LEU M 211 -12.913 -25.233-115.686 1.00 0.00 H
+ATOM 9133 HG LEU M 211 -13.643 -22.565-114.487 1.00 0.00 H
+ATOM 9134 1HD1 LEU M 211 -15.485 -22.377-116.066 1.00 0.00 H
+ATOM 9135 2HD1 LEU M 211 -13.898 -22.249-116.861 1.00 0.00 H
+ATOM 9136 3HD1 LEU M 211 -14.838 -23.756-116.986 1.00 0.00 H
+ATOM 9137 1HD2 LEU M 211 -15.748 -23.724-114.015 1.00 0.00 H
+ATOM 9138 2HD2 LEU M 211 -15.137 -25.184-114.830 1.00 0.00 H
+ATOM 9139 3HD2 LEU M 211 -14.364 -24.612-113.332 1.00 0.00 H
+ATOM 9140 N HIS M 212 -10.983 -26.572-114.742 1.00 78.54 N
+ATOM 9141 CA HIS M 212 -10.108 -27.723-114.895 1.00 78.34 C
+ATOM 9142 C HIS M 212 -10.324 -28.375-116.251 1.00 75.46 C
+ATOM 9143 O HIS M 212 -11.466 -28.555-116.690 1.00 74.94 O
+ATOM 9144 CB HIS M 212 -10.345 -28.743-113.779 1.00 83.72 C
+ATOM 9145 CG HIS M 212 -10.053 -28.217-112.407 1.00 84.58 C
+ATOM 9146 ND1 HIS M 212 -8.791 -27.824-112.017 1.00 81.72 N
+ATOM 9147 CD2 HIS M 212 -10.852 -28.040-111.328 1.00 92.79 C
+ATOM 9148 CE1 HIS M 212 -8.826 -27.418-110.761 1.00 92.80 C
+ATOM 9149 NE2 HIS M 212 -10.065 -27.540-110.319 1.00 93.11 N
+ATOM 9150 H HIS M 212 -11.983 -26.714-114.718 1.00 0.00 H
+ATOM 9151 HA HIS M 212 -9.069 -27.400-114.838 1.00 0.00 H
+ATOM 9152 1HB HIS M 212 -11.384 -29.074-113.803 1.00 0.00 H
+ATOM 9153 2HB HIS M 212 -9.719 -29.619-113.948 1.00 0.00 H
+ATOM 9154 HD2 HIS M 212 -11.920 -28.252-111.271 1.00 0.00 H
+ATOM 9155 HE1 HIS M 212 -7.977 -27.046-110.188 1.00 0.00 H
+ATOM 9156 HE2 HIS M 212 -10.387 -27.305-109.391 1.00 0.00 H
+ATOM 9157 N SER M 213 -9.215 -28.736-116.902 1.00 75.75 N
+ATOM 9158 CA SER M 213 -9.288 -29.326-118.235 1.00 81.74 C
+ATOM 9159 C SER M 213 -10.044 -30.648-118.210 1.00 74.47 C
+ATOM 9160 O SER M 213 -10.944 -30.876-119.025 1.00 70.74 O
+ATOM 9161 CB SER M 213 -7.881 -29.515-118.801 1.00 85.44 C
+ATOM 9162 OG SER M 213 -7.229 -28.269-118.986 1.00 82.61 O
+ATOM 9163 H SER M 213 -8.311 -28.602-116.472 1.00 0.00 H
+ATOM 9164 HA SER M 213 -9.841 -28.646-118.885 1.00 0.00 H
+ATOM 9165 1HB SER M 213 -7.296 -30.135-118.122 1.00 0.00 H
+ATOM 9166 2HB SER M 213 -7.940 -30.040-119.754 1.00 0.00 H
+ATOM 9167 HG SER M 213 -7.854 -27.598-118.701 1.00 0.00 H
+ATOM 9168 N ILE M 214 -9.681 -31.540-117.289 1.00 71.93 N
+ATOM 9169 CA ILE M 214 -10.398 -32.794-117.075 1.00 78.00 C
+ATOM 9170 C ILE M 214 -10.550 -32.982-115.573 1.00 82.53 C
+ATOM 9171 O ILE M 214 -9.552 -32.984-114.844 1.00 98.76 O
+ATOM 9172 CB ILE M 214 -9.658 -33.994-117.694 1.00 78.75 C
+ATOM 9173 CG1 ILE M 214 -9.468 -33.786-119.198 1.00 84.44 C
+ATOM 9174 CG2 ILE M 214 -10.418 -35.284-117.423 1.00 79.66 C
+ATOM 9175 CD1 ILE M 214 -8.591 -34.829-119.853 1.00 0.00 C
+ATOM 9176 H ILE M 214 -8.874 -31.331-116.719 1.00 0.00 H
+ATOM 9177 HA ILE M 214 -11.377 -32.717-117.545 1.00 0.00 H
+ATOM 9178 HB ILE M 214 -8.663 -34.072-117.258 1.00 0.00 H
+ATOM 9179 1HG1 ILE M 214 -10.439 -33.798-119.693 1.00 0.00 H
+ATOM 9180 2HG1 ILE M 214 -9.023 -32.807-119.377 1.00 0.00 H
+ATOM 9181 1HG2 ILE M 214 -9.882 -36.122-117.868 1.00 0.00 H
+ATOM 9182 2HG2 ILE M 214 -10.503 -35.437-116.348 1.00 0.00 H
+ATOM 9183 3HG2 ILE M 214 -11.415 -35.218-117.860 1.00 0.00 H
+ATOM 9184 1HD1 ILE M 214 -8.503 -34.614-120.918 1.00 0.00 H
+ATOM 9185 2HD1 ILE M 214 -7.601 -34.811-119.396 1.00 0.00 H
+ATOM 9186 3HD1 ILE M 214 -9.035 -35.814-119.718 1.00 0.00 H
+ATOM 9187 N SER M 215 -11.786 -33.133-115.104 1.00 70.76 N
+ATOM 9188 CA SER M 215 -12.033 -33.250-113.674 1.00 68.66 C
+ATOM 9189 C SER M 215 -13.072 -34.329-113.412 1.00 68.31 C
+ATOM 9190 O SER M 215 -13.831 -34.726-114.300 1.00 73.55 O
+ATOM 9191 CB SER M 215 -12.509 -31.920-113.068 1.00 78.32 C
+ATOM 9192 OG SER M 215 -13.827 -31.595-113.492 1.00 72.18 O
+ATOM 9193 H SER M 215 -12.568 -33.168-115.743 1.00 0.00 H
+ATOM 9194 HA SER M 215 -11.100 -33.530-113.183 1.00 0.00 H
+ATOM 9195 1HB SER M 215 -12.485 -31.987-111.981 1.00 0.00 H
+ATOM 9196 2HB SER M 215 -11.828 -31.122-113.362 1.00 0.00 H
+ATOM 9197 HG SER M 215 -14.103 -32.310-114.071 1.00 0.00 H
+ATOM 9198 N VAL M 216 -13.094 -34.800-112.167 1.00 73.22 N
+ATOM 9199 CA VAL M 216 -14.152 -35.667-111.662 1.00 73.06 C
+ATOM 9200 C VAL M 216 -14.626 -35.091-110.334 1.00 73.93 C
+ATOM 9201 O VAL M 216 -13.834 -34.946-109.395 1.00 63.49 O
+ATOM 9202 CB VAL M 216 -13.690 -37.125-111.497 1.00 62.98 C
+ATOM 9203 CG1 VAL M 216 -12.375 -37.195-110.747 1.00 66.24 C
+ATOM 9204 CG2 VAL M 216 -14.755 -37.930-110.786 1.00 63.52 C
+ATOM 9205 H VAL M 216 -12.337 -34.538-111.552 1.00 0.00 H
+ATOM 9206 HA VAL M 216 -14.976 -35.660-112.377 1.00 0.00 H
+ATOM 9207 HB VAL M 216 -13.510 -37.553-112.483 1.00 0.00 H
+ATOM 9208 1HG1 VAL M 216 -12.070 -38.237-110.644 1.00 0.00 H
+ATOM 9209 2HG1 VAL M 216 -11.612 -36.647-111.299 1.00 0.00 H
+ATOM 9210 3HG1 VAL M 216 -12.496 -36.754-109.758 1.00 0.00 H
+ATOM 9211 1HG2 VAL M 216 -14.419 -38.960-110.675 1.00 0.00 H
+ATOM 9212 2HG2 VAL M 216 -14.940 -37.500-109.801 1.00 0.00 H
+ATOM 9213 3HG2 VAL M 216 -15.676 -37.910-111.369 1.00 0.00 H
+ATOM 9214 N ARG M 217 -15.905 -34.739-110.261 1.00 78.08 N
+ATOM 9215 CA ARG M 217 -16.482 -34.155-109.060 1.00 60.94 C
+ATOM 9216 C ARG M 217 -17.539 -35.101-108.515 1.00 75.45 C
+ATOM 9217 O ARG M 217 -18.292 -35.706-109.280 1.00 64.48 O
+ATOM 9218 CB ARG M 217 -17.091 -32.775-109.353 1.00 59.79 C
+ATOM 9219 CG ARG M 217 -16.406 -32.063-110.508 1.00 79.66 C
+ATOM 9220 CD ARG M 217 -16.675 -30.570-110.553 1.00 70.03 C
+ATOM 9221 NE ARG M 217 -15.869 -29.957-111.606 1.00 80.00 N
+ATOM 9222 CZ ARG M 217 -15.738 -28.650-111.793 1.00 94.19 C
+ATOM 9223 NH1 ARG M 217 -16.372 -27.797-111.003 1.00102.87 N
+ATOM 9224 NH2 ARG M 217 -14.977 -28.196-112.781 1.00102.42 N
+ATOM 9225 H ARG M 217 -16.493 -34.884-111.069 1.00 0.00 H
+ATOM 9226 HA ARG M 217 -15.690 -34.030-108.321 1.00 0.00 H
+ATOM 9227 1HB ARG M 217 -18.148 -32.887-109.589 1.00 0.00 H
+ATOM 9228 2HB ARG M 217 -17.019 -32.149-108.464 1.00 0.00 H
+ATOM 9229 1HG ARG M 217 -15.327 -32.195-110.428 1.00 0.00 H
+ATOM 9230 2HG ARG M 217 -16.754 -32.483-111.452 1.00 0.00 H
+ATOM 9231 1HD ARG M 217 -17.731 -30.397-110.759 1.00 0.00 H
+ATOM 9232 2HD ARG M 217 -16.415 -30.125-109.593 1.00 0.00 H
+ATOM 9233 HE ARG M 217 -15.375 -30.573-112.238 1.00 0.00 H
+ATOM 9234 1HH1 ARG M 217 -16.958 -28.141-110.255 1.00 0.00 H
+ATOM 9235 2HH1 ARG M 217 -16.270 -26.803-111.148 1.00 0.00 H
+ATOM 9236 1HH2 ARG M 217 -14.498 -28.846-113.390 1.00 0.00 H
+ATOM 9237 2HH2 ARG M 217 -14.876 -27.202-112.925 1.00 0.00 H
+ATOM 9238 N ARG M 218 -17.584 -35.243-107.195 1.00 74.78 N
+ATOM 9239 CA ARG M 218 -18.577 -36.084-106.544 1.00 74.38 C
+ATOM 9240 C ARG M 218 -19.688 -35.204-105.994 1.00 78.84 C
+ATOM 9241 O ARG M 218 -19.418 -34.192-105.341 1.00 95.05 O
+ATOM 9242 CB ARG M 218 -17.958 -36.911-105.417 1.00 86.16 C
+ATOM 9243 CG ARG M 218 -18.970 -37.709-104.607 1.00 91.53 C
+ATOM 9244 CD ARG M 218 -18.268 -38.579-103.580 1.00110.21 C
+ATOM 9245 NE ARG M 218 -17.412 -39.582-104.206 1.00120.33 N
+ATOM 9246 CZ ARG M 218 -16.673 -40.456-103.532 1.00133.09 C
+ATOM 9247 NH1 ARG M 218 -16.679 -40.449-102.205 1.00124.01 N
+ATOM 9248 NH2 ARG M 218 -15.922 -41.333-104.184 1.00146.96 N
+ATOM 9249 H ARG M 218 -16.908 -34.752-106.628 1.00 0.00 H
+ATOM 9250 HA ARG M 218 -18.987 -36.772-107.284 1.00 0.00 H
+ATOM 9251 1HB ARG M 218 -17.233 -37.609-105.834 1.00 0.00 H
+ATOM 9252 2HB ARG M 218 -17.422 -36.252-104.734 1.00 0.00 H
+ATOM 9253 1HG ARG M 218 -19.642 -37.025-104.089 1.00 0.00 H
+ATOM 9254 2HG ARG M 218 -19.548 -38.349-105.275 1.00 0.00 H
+ATOM 9255 1HD ARG M 218 -17.647 -37.955-102.938 1.00 0.00 H
+ATOM 9256 2HD ARG M 218 -19.010 -39.097-102.974 1.00 0.00 H
+ATOM 9257 HE ARG M 218 -17.382 -39.610-105.217 1.00 0.00 H
+ATOM 9258 1HH1 ARG M 218 -17.246 -39.778-101.706 1.00 0.00 H
+ATOM 9259 2HH1 ARG M 218 -16.117 -41.114-101.694 1.00 0.00 H
+ATOM 9260 1HH2 ARG M 218 -15.912 -41.337-105.195 1.00 0.00 H
+ATOM 9261 2HH2 ARG M 218 -15.361 -41.997-103.671 1.00 0.00 H
+ATOM 9262 N LEU M 219 -20.931 -35.587-106.262 1.00 71.90 N
+ATOM 9263 CA LEU M 219 -22.071 -34.849-105.739 1.00 78.58 C
+ATOM 9264 C LEU M 219 -22.271 -35.223-104.276 1.00 81.97 C
+ATOM 9265 O LEU M 219 -22.464 -36.402-103.956 1.00 82.48 O
+ATOM 9266 CB LEU M 219 -23.322 -35.155-106.556 1.00 81.40 C
+ATOM 9267 CG LEU M 219 -24.538 -34.273-106.289 1.00 80.46 C
+ATOM 9268 CD1 LEU M 219 -24.152 -32.809-106.410 1.00 74.00 C
+ATOM 9269 CD2 LEU M 219 -25.641 -34.611-107.269 1.00 88.24 C
+ATOM 9270 H LEU M 219 -21.094 -36.402-106.837 1.00 0.00 H
+ATOM 9271 HA LEU M 219 -21.857 -33.783-105.814 1.00 0.00 H
+ATOM 9272 1HB LEU M 219 -23.078 -35.061-107.613 1.00 0.00 H
+ATOM 9273 2HB LEU M 219 -23.619 -36.186-106.364 1.00 0.00 H
+ATOM 9274 HG LEU M 219 -24.894 -34.443-105.273 1.00 0.00 H
+ATOM 9275 1HD1 LEU M 219 -25.025 -32.185-106.218 1.00 0.00 H
+ATOM 9276 2HD1 LEU M 219 -23.374 -32.576-105.683 1.00 0.00 H
+ATOM 9277 3HD1 LEU M 219 -23.780 -32.613-107.415 1.00 0.00 H
+ATOM 9278 1HD2 LEU M 219 -26.508 -33.979-107.074 1.00 0.00 H
+ATOM 9279 2HD2 LEU M 219 -25.289 -34.440-108.286 1.00 0.00 H
+ATOM 9280 3HD2 LEU M 219 -25.922 -35.658-107.154 1.00 0.00 H
+ATOM 9281 N LYS M 220 -22.207 -34.227-103.391 1.00 77.11 N
+ATOM 9282 CA LYS M 220 -22.390 -34.476-101.967 1.00 83.89 C
+ATOM 9283 C LYS M 220 -23.759 -35.086-101.699 1.00 85.21 C
+ATOM 9284 O LYS M 220 -24.732 -34.829-102.414 1.00 85.19 O
+ATOM 9285 CB LYS M 220 -22.221 -33.183-101.167 1.00 89.74 C
+ATOM 9286 CG LYS M 220 -20.804 -32.624-101.167 1.00 86.43 C
+ATOM 9287 CD LYS M 220 -20.710 -31.359-100.328 1.00 75.82 C
+ATOM 9288 CE LYS M 220 -19.297 -30.794-100.334 1.00 0.00 C
+ATOM 9289 NZ LYS M 220 -19.194 -29.542 -99.536 1.00 0.00 N
+ATOM 9290 H LYS M 220 -22.029 -33.284-103.707 1.00 0.00 H
+ATOM 9291 HA LYS M 220 -21.624 -35.179-101.637 1.00 0.00 H
+ATOM 9292 1HB LYS M 220 -22.883 -32.416-101.571 1.00 0.00 H
+ATOM 9293 2HB LYS M 220 -22.513 -33.355-100.131 1.00 0.00 H
+ATOM 9294 1HG LYS M 220 -20.119 -33.370-100.763 1.00 0.00 H
+ATOM 9295 2HG LYS M 220 -20.503 -32.396-102.189 1.00 0.00 H
+ATOM 9296 1HD LYS M 220 -21.395 -30.608-100.723 1.00 0.00 H
+ATOM 9297 2HD LYS M 220 -20.997 -31.582 -99.300 1.00 0.00 H
+ATOM 9298 1HE LYS M 220 -18.609 -31.531 -99.922 1.00 0.00 H
+ATOM 9299 2HE LYS M 220 -18.995 -30.581-101.359 1.00 0.00 H
+ATOM 9300 1HZ LYS M 220 -18.244 -29.200 -99.566 1.00 0.00 H
+ATOM 9301 2HZ LYS M 220 -19.816 -28.845 -99.921 1.00 0.00 H
+ATOM 9302 3HZ LYS M 220 -19.454 -29.731 -98.578 1.00 0.00 H
+ATOM 9303 N GLU M 221 -23.826 -35.902-100.645 1.00 76.87 N
+ATOM 9304 CA GLU M 221 -25.064 -36.593-100.307 1.00 97.46 C
+ATOM 9305 C GLU M 221 -26.183 -35.630 -99.938 1.00101.12 C
+ATOM 9306 O GLU M 221 -27.355 -36.016 -99.980 1.00114.08 O
+ATOM 9307 CB GLU M 221 -24.821 -37.588 -99.168 1.00122.66 C
+ATOM 9308 CG GLU M 221 -24.056 -37.025 -97.975 1.00143.97 C
+ATOM 9309 CD GLU M 221 -22.551 -36.992 -98.195 1.00157.65 C
+ATOM 9310 OE1 GLU M 221 -22.096 -37.374 -99.295 1.00152.20 O
+ATOM 9311 OE2 GLU M 221 -21.824 -36.579 -97.268 1.00169.00 O
+ATOM 9312 H GLU M 221 -23.009 -36.047-100.069 1.00 0.00 H
+ATOM 9313 HA GLU M 221 -25.405 -37.142-101.186 1.00 0.00 H
+ATOM 9314 1HB GLU M 221 -25.777 -37.961 -98.800 1.00 0.00 H
+ATOM 9315 2HB GLU M 221 -24.260 -38.443 -99.545 1.00 0.00 H
+ATOM 9316 1HG GLU M 221 -24.404 -36.011 -97.779 1.00 0.00 H
+ATOM 9317 2HG GLU M 221 -24.276 -37.631 -97.097 1.00 0.00 H
+ATOM 9318 N THR M 222 -25.853 -34.390 -99.579 1.00 95.30 N
+ATOM 9319 CA THR M 222 -26.864 -33.360 -99.371 1.00 92.57 C
+ATOM 9320 C THR M 222 -27.275 -32.673-100.667 1.00 87.67 C
+ATOM 9321 O THR M 222 -28.086 -31.741-100.623 1.00 95.29 O
+ATOM 9322 CB THR M 222 -26.364 -32.316 -98.366 1.00 90.07 C
+ATOM 9323 OG1 THR M 222 -25.069 -31.847 -98.761 1.00 92.77 O
+ATOM 9324 CG2 THR M 222 -26.277 -32.912 -96.969 1.00 87.20 C
+ATOM 9325 H THR M 222 -24.879 -34.157 -99.448 1.00 0.00 H
+ATOM 9326 HA THR M 222 -27.761 -33.832 -98.968 1.00 0.00 H
+ATOM 9327 HB THR M 222 -27.050 -31.469 -98.350 1.00 0.00 H
+ATOM 9328 HG1 THR M 222 -24.801 -32.291 -99.569 1.00 0.00 H
+ATOM 9329 1HG2 THR M 222 -25.921 -32.154 -96.272 1.00 0.00 H
+ATOM 9330 2HG2 THR M 222 -27.263 -33.256 -96.658 1.00 0.00 H
+ATOM 9331 3HG2 THR M 222 -25.585 -33.753 -96.975 1.00 0.00 H
+ATOM 9332 N LYS M 223 -26.736 -33.106-101.808 1.00 91.26 N
+ATOM 9333 CA LYS M 223 -27.079 -32.579-103.129 1.00 98.83 C
+ATOM 9334 C LYS M 223 -26.909 -31.066-103.219 1.00101.39 C
+ATOM 9335 O LYS M 223 -27.516 -30.421-104.080 1.00111.15 O
+ATOM 9336 CB LYS M 223 -28.516 -32.959-103.491 1.00 97.18 C
+ATOM 9337 CG LYS M 223 -28.778 -34.459-103.536 1.00 95.41 C
+ATOM 9338 CD LYS M 223 -30.203 -34.758-103.976 1.00 87.43 C
+ATOM 9339 CE LYS M 223 -30.477 -36.254-103.987 1.00 0.00 C
+ATOM 9340 NZ LYS M 223 -31.880 -36.560-104.376 1.00 0.00 N
+ATOM 9341 H LYS M 223 -26.050 -33.844-101.736 1.00 0.00 H
+ATOM 9342 HA LYS M 223 -26.392 -33.006-103.861 1.00 0.00 H
+ATOM 9343 1HB LYS M 223 -29.202 -32.521-102.765 1.00 0.00 H
+ATOM 9344 2HB LYS M 223 -28.766 -32.546-104.468 1.00 0.00 H
+ATOM 9345 1HG LYS M 223 -28.084 -34.928-104.234 1.00 0.00 H
+ATOM 9346 2HG LYS M 223 -28.615 -34.886-102.547 1.00 0.00 H
+ATOM 9347 1HD LYS M 223 -30.904 -34.273-103.296 1.00 0.00 H
+ATOM 9348 2HD LYS M 223 -30.364 -34.362-104.979 1.00 0.00 H
+ATOM 9349 1HE LYS M 223 -29.803 -36.743-104.690 1.00 0.00 H
+ATOM 9350 2HE LYS M 223 -30.291 -36.665-102.995 1.00 0.00 H
+ATOM 9351 1HZ LYS M 223 -32.021 -37.560-104.371 1.00 0.00 H
+ATOM 9352 2HZ LYS M 223 -32.515 -36.127-103.719 1.00 0.00 H
+ATOM 9353 3HZ LYS M 223 -32.059 -36.201-105.303 1.00 0.00 H
+ATOM 9354 N ASP M 224 -26.092 -30.476-102.347 1.00 93.79 N
+ATOM 9355 CA ASP M 224 -25.908 -29.032-102.325 1.00 98.92 C
+ATOM 9356 C ASP M 224 -24.490 -28.620-102.704 1.00 91.55 C
+ATOM 9357 O ASP M 224 -24.081 -27.492-102.417 1.00 90.30 O
+ATOM 9358 CB ASP M 224 -26.275 -28.469-100.951 1.00111.28 C
+ATOM 9359 CG ASP M 224 -25.310 -28.901 -99.865 1.00120.98 C
+ATOM 9360 OD1 ASP M 224 -24.685 -29.972-100.017 1.00130.21 O
+ATOM 9361 OD2 ASP M 224 -25.179 -28.168 -98.860 1.00116.68 O
+ATOM 9362 H ASP M 224 -25.587 -31.046-101.684 1.00 0.00 H
+ATOM 9363 HA ASP M 224 -26.567 -28.588-103.072 1.00 0.00 H
+ATOM 9364 1HB ASP M 224 -26.288 -27.380-100.996 1.00 0.00 H
+ATOM 9365 2HB ASP M 224 -27.279 -28.797-100.679 1.00 0.00 H
+ATOM 9366 N GLY M 225 -23.731 -29.508-103.342 1.00 75.19 N
+ATOM 9367 CA GLY M 225 -22.407 -29.139-103.800 1.00 71.94 C
+ATOM 9368 C GLY M 225 -21.554 -30.293-104.282 1.00 71.69 C
+ATOM 9369 O GLY M 225 -21.760 -31.440-103.876 1.00 71.02 O
+ATOM 9370 H GLY M 225 -24.068 -30.445-103.513 1.00 0.00 H
+ATOM 9371 1HA GLY M 225 -22.491 -28.424-104.618 1.00 0.00 H
+ATOM 9372 2HA GLY M 225 -21.869 -28.642-102.994 1.00 0.00 H
+ATOM 9373 N PHE M 226 -20.598 -30.003-105.158 1.00 79.11 N
+ATOM 9374 CA PHE M 226 -19.597 -30.970-105.580 1.00 83.54 C
+ATOM 9375 C PHE M 226 -18.335 -30.814-104.739 1.00 84.14 C
+ATOM 9376 O PHE M 226 -18.124 -29.795-104.077 1.00 93.02 O
+ATOM 9377 CB PHE M 226 -19.252 -30.801-107.061 1.00 89.05 C
+ATOM 9378 CG PHE M 226 -20.407 -31.037-107.990 1.00 94.74 C
+ATOM 9379 CD1 PHE M 226 -21.249 -29.998-108.345 1.00 96.59 C
+ATOM 9380 CD2 PHE M 226 -20.641 -32.293-108.521 1.00 90.17 C
+ATOM 9381 CE1 PHE M 226 -22.306 -30.211-109.209 1.00 85.21 C
+ATOM 9382 CE2 PHE M 226 -21.699 -32.511-109.385 1.00 75.89 C
+ATOM 9383 CZ PHE M 226 -22.531 -31.469-109.729 1.00 67.28 C
+ATOM 9384 H PHE M 226 -20.573 -29.069-105.542 1.00 0.00 H
+ATOM 9385 HA PHE M 226 -20.002 -31.973-105.436 1.00 0.00 H
+ATOM 9386 1HB PHE M 226 -18.880 -29.792-107.235 1.00 0.00 H
+ATOM 9387 2HB PHE M 226 -18.456 -31.494-107.330 1.00 0.00 H
+ATOM 9388 HD1 PHE M 226 -21.070 -29.004-107.935 1.00 0.00 H
+ATOM 9389 HD2 PHE M 226 -19.982 -33.118-108.248 1.00 0.00 H
+ATOM 9390 HE1 PHE M 226 -22.962 -29.385-109.480 1.00 0.00 H
+ATOM 9391 HE2 PHE M 226 -21.876 -33.506-109.793 1.00 0.00 H
+ATOM 9392 HZ PHE M 226 -23.365 -31.638-110.409 1.00 0.00 H
+ATOM 9393 N MET M 227 -17.486 -31.838-104.781 1.00 80.36 N
+ATOM 9394 CA MET M 227 -16.240 -31.819-104.030 1.00 79.94 C
+ATOM 9395 C MET M 227 -15.177 -32.603-104.785 1.00 86.53 C
+ATOM 9396 O MET M 227 -15.481 -33.564-105.497 1.00 88.95 O
+ATOM 9397 CB MET M 227 -16.423 -32.396-102.622 1.00 98.53 C
+ATOM 9398 CG MET M 227 -17.201 -33.707-102.575 1.00114.20 C
+ATOM 9399 SD MET M 227 -17.027 -34.573-100.997 1.00131.02 S
+ATOM 9400 CE MET M 227 -18.239 -35.881-101.175 1.00127.92 C
+ATOM 9401 H MET M 227 -17.708 -32.646-105.345 1.00 0.00 H
+ATOM 9402 HA MET M 227 -15.911 -30.785-103.933 1.00 0.00 H
+ATOM 9403 1HB MET M 227 -15.447 -32.570-102.171 1.00 0.00 H
+ATOM 9404 2HB MET M 227 -16.948 -31.672-101.997 1.00 0.00 H
+ATOM 9405 1HG MET M 227 -18.259 -33.508-102.742 1.00 0.00 H
+ATOM 9406 2HG MET M 227 -16.850 -34.367-103.368 1.00 0.00 H
+ATOM 9407 1HE MET M 227 -18.244 -36.497-100.276 1.00 0.00 H
+ATOM 9408 2HE MET M 227 -19.228 -35.444-101.322 1.00 0.00 H
+ATOM 9409 3HE MET M 227 -17.984 -36.499-102.037 1.00 0.00 H
+ATOM 9410 N PHE M 228 -13.926 -32.174-104.628 1.00 88.59 N
+ATOM 9411 CA PHE M 228 -12.771 -32.877-105.173 1.00 82.93 C
+ATOM 9412 C PHE M 228 -12.101 -33.650-104.045 1.00 92.78 C
+ATOM 9413 O PHE M 228 -11.707 -33.060-103.033 1.00 96.68 O
+ATOM 9414 CB PHE M 228 -11.777 -31.908-105.812 1.00 71.67 C
+ATOM 9415 CG PHE M 228 -12.296 -31.221-107.037 1.00 68.94 C
+ATOM 9416 CD1 PHE M 228 -12.547 -29.860-107.028 1.00 75.55 C
+ATOM 9417 CD2 PHE M 228 -12.520 -31.932-108.202 1.00 77.51 C
+ATOM 9418 CE1 PHE M 228 -13.018 -29.221-108.157 1.00 89.63 C
+ATOM 9419 CE2 PHE M 228 -12.991 -31.300-109.336 1.00 84.95 C
+ATOM 9420 CZ PHE M 228 -13.239 -29.943-109.315 1.00 89.79 C
+ATOM 9421 H PHE M 228 -13.782 -31.322-104.106 1.00 0.00 H
+ATOM 9422 HA PHE M 228 -13.118 -33.566-105.944 1.00 0.00 H
+ATOM 9423 1HB PHE M 228 -11.499 -31.143-105.088 1.00 0.00 H
+ATOM 9424 2HB PHE M 228 -10.870 -32.445-106.085 1.00 0.00 H
+ATOM 9425 HD1 PHE M 228 -12.368 -29.292-106.115 1.00 0.00 H
+ATOM 9426 HD2 PHE M 228 -12.324 -33.005-108.218 1.00 0.00 H
+ATOM 9427 HE1 PHE M 228 -13.214 -28.149-108.134 1.00 0.00 H
+ATOM 9428 HE2 PHE M 228 -13.168 -31.872-110.247 1.00 0.00 H
+ATOM 9429 HZ PHE M 228 -13.609 -29.442-110.208 1.00 0.00 H
+ATOM 9430 N LEU M 229 -11.959 -34.963-104.227 1.00 86.55 N
+ATOM 9431 CA LEU M 229 -11.492 -35.808-103.135 1.00 86.09 C
+ATOM 9432 C LEU M 229 -9.981 -35.739-102.946 1.00 94.29 C
+ATOM 9433 O LEU M 229 -9.498 -35.909-101.821 1.00112.73 O
+ATOM 9434 CB LEU M 229 -11.932 -37.256-103.362 1.00 86.16 C
+ATOM 9435 CG LEU M 229 -13.351 -37.602-102.893 1.00 91.45 C
+ATOM 9436 CD1 LEU M 229 -14.409 -37.050-103.839 1.00 92.73 C
+ATOM 9437 CD2 LEU M 229 -13.518 -39.104-102.710 1.00 98.19 C
+ATOM 9438 H LEU M 229 -12.172 -35.385-105.119 1.00 0.00 H
+ATOM 9439 HA LEU M 229 -11.934 -35.449-102.206 1.00 0.00 H
+ATOM 9440 1HB LEU M 229 -11.873 -37.474-104.427 1.00 0.00 H
+ATOM 9441 2HB LEU M 229 -11.240 -37.916-102.839 1.00 0.00 H
+ATOM 9442 HG LEU M 229 -13.549 -37.111-101.940 1.00 0.00 H
+ATOM 9443 1HD1 LEU M 229 -15.400 -37.316-103.472 1.00 0.00 H
+ATOM 9444 2HD1 LEU M 229 -14.321 -35.965-103.890 1.00 0.00 H
+ATOM 9445 3HD1 LEU M 229 -14.265 -37.473-104.832 1.00 0.00 H
+ATOM 9446 1HD2 LEU M 229 -14.534 -39.319-102.376 1.00 0.00 H
+ATOM 9447 2HD2 LEU M 229 -13.333 -39.609-103.658 1.00 0.00 H
+ATOM 9448 3HD2 LEU M 229 -12.808 -39.461-101.964 1.00 0.00 H
+ATOM 9449 N THR M 230 -9.222 -35.492-104.008 1.00 90.49 N
+ATOM 9450 CA THR M 230 -7.770 -35.451-103.913 1.00100.50 C
+ATOM 9451 C THR M 230 -7.230 -34.349-104.812 1.00101.32 C
+ATOM 9452 O THR M 230 -7.944 -33.784-105.645 1.00 95.60 O
+ATOM 9453 CB THR M 230 -7.137 -36.797-104.298 1.00100.69 C
+ATOM 9454 OG1 THR M 230 -7.799 -37.330-105.455 1.00102.42 O
+ATOM 9455 CG2 THR M 230 -7.227 -37.792-103.148 1.00 87.92 C
+ATOM 9456 H THR M 230 -9.661 -35.329-104.903 1.00 0.00 H
+ATOM 9457 HA THR M 230 -7.497 -35.232-102.880 1.00 0.00 H
+ATOM 9458 HB THR M 230 -6.088 -36.646-104.553 1.00 0.00 H
+ATOM 9459 HG1 THR M 230 -8.492 -36.726-105.733 1.00 0.00 H
+ATOM 9460 1HG2 THR M 230 -6.771 -38.736-103.447 1.00 0.00 H
+ATOM 9461 2HG2 THR M 230 -6.701 -37.394-102.280 1.00 0.00 H
+ATOM 9462 3HG2 THR M 230 -8.273 -37.959-102.893 1.00 0.00 H
+ATOM 9463 N ASP M 231 -5.944 -34.044-104.629 1.00102.01 N
+ATOM 9464 CA ASP M 231 -5.236 -33.172-105.555 1.00 99.17 C
+ATOM 9465 C ASP M 231 -5.118 -33.787-106.942 1.00102.96 C
+ATOM 9466 O ASP M 231 -4.779 -33.076-107.895 1.00108.51 O
+ATOM 9467 CB ASP M 231 -3.839 -32.851-105.018 1.00110.50 C
+ATOM 9468 CG ASP M 231 -3.867 -31.915-103.817 1.00114.64 C
+ATOM 9469 OD1 ASP M 231 -4.889 -31.316-103.578 1.00 0.00 O
+ATOM 9470 OD2 ASP M 231 -2.866 -31.809-103.149 1.00 0.00 O
+ATOM 9471 H ASP M 231 -5.449 -34.423-103.834 1.00 0.00 H
+ATOM 9472 HA ASP M 231 -5.800 -32.244-105.657 1.00 0.00 H
+ATOM 9473 1HB ASP M 231 -3.339 -33.775-104.728 1.00 0.00 H
+ATOM 9474 2HB ASP M 231 -3.244 -32.389-105.806 1.00 0.00 H
+ATOM 9475 N GLN M 232 -5.397 -35.085-107.075 1.00 96.59 N
+ATOM 9476 CA GLN M 232 -5.296 -35.801-108.338 1.00 98.07 C
+ATOM 9477 C GLN M 232 -6.663 -36.153-108.918 1.00 96.70 C
+ATOM 9478 O GLN M 232 -6.780 -37.118-109.678 1.00 97.87 O
+ATOM 9479 CB GLN M 232 -4.450 -37.061-108.159 1.00103.69 C
+ATOM 9480 CG GLN M 232 -3.034 -36.785-107.680 1.00112.25 C
+ATOM 9481 CD GLN M 232 -2.235 -38.051-107.457 1.00129.43 C
+ATOM 9482 OE1 GLN M 232 -2.796 -39.132-107.280 1.00126.91 O
+ATOM 9483 NE2 GLN M 232 -0.914 -37.924-107.476 1.00143.96 N
+ATOM 9484 H GLN M 232 -5.692 -35.585-106.248 1.00 0.00 H
+ATOM 9485 HA GLN M 232 -4.811 -35.151-109.066 1.00 0.00 H
+ATOM 9486 1HB GLN M 232 -4.931 -37.723-107.438 1.00 0.00 H
+ATOM 9487 2HB GLN M 232 -4.391 -37.597-109.106 1.00 0.00 H
+ATOM 9488 1HG GLN M 232 -2.518 -36.186-108.430 1.00 0.00 H
+ATOM 9489 2HG GLN M 232 -3.080 -36.242-106.736 1.00 0.00 H
+ATOM 9490 1HE2 GLN M 232 -0.332 -38.726-107.335 1.00 0.00 H
+ATOM 9491 2HE2 GLN M 232 -0.500 -37.027-107.632 1.00 0.00 H
+ATOM 9492 N SER M 233 -7.700 -35.397-108.564 1.00 99.82 N
+ATOM 9493 CA SER M 233 -9.007 -35.546-109.189 1.00 77.65 C
+ATOM 9494 C SER M 233 -9.165 -34.674-110.424 1.00 71.35 C
+ATOM 9495 O SER M 233 -10.173 -34.798-111.129 1.00 77.36 O
+ATOM 9496 CB SER M 233 -10.124 -35.212-108.191 1.00 70.99 C
+ATOM 9497 OG SER M 233 -10.207 -36.182-107.162 1.00 85.57 O
+ATOM 9498 H SER M 233 -7.576 -34.701-107.842 1.00 0.00 H
+ATOM 9499 HA SER M 233 -9.123 -36.583-109.506 1.00 0.00 H
+ATOM 9500 1HB SER M 233 -9.938 -34.233-107.751 1.00 0.00 H
+ATOM 9501 2HB SER M 233 -11.077 -35.159-108.716 1.00 0.00 H
+ATOM 9502 HG SER M 233 -9.522 -36.828-107.351 1.00 0.00 H
+ATOM 9503 N TYR M 234 -8.199 -33.802-110.703 1.00 78.77 N
+ATOM 9504 CA TYR M 234 -8.288 -32.885-111.826 1.00 85.04 C
+ATOM 9505 C TYR M 234 -6.924 -32.750-112.484 1.00 92.86 C
+ATOM 9506 O TYR M 234 -5.886 -32.799-111.819 1.00104.86 O
+ATOM 9507 CB TYR M 234 -8.801 -31.506-111.387 1.00 87.14 C
+ATOM 9508 CG TYR M 234 -8.067 -30.928-110.199 1.00 93.02 C
+ATOM 9509 CD1 TYR M 234 -8.541 -31.112-108.907 1.00 85.65 C
+ATOM 9510 CD2 TYR M 234 -6.902 -30.193-110.370 1.00105.51 C
+ATOM 9511 CE1 TYR M 234 -7.871 -30.584-107.819 1.00103.72 C
+ATOM 9512 CE2 TYR M 234 -6.226 -29.661-109.290 1.00111.76 C
+ATOM 9513 CZ TYR M 234 -6.712 -29.858-108.017 1.00107.83 C
+ATOM 9514 OH TYR M 234 -6.036 -29.330-106.940 1.00107.50 O
+ATOM 9515 H TYR M 234 -7.379 -33.780-110.113 1.00 0.00 H
+ATOM 9516 HA TYR M 234 -8.992 -33.294-112.552 1.00 0.00 H
+ATOM 9517 1HB TYR M 234 -8.711 -30.803-112.216 1.00 0.00 H
+ATOM 9518 2HB TYR M 234 -9.858 -31.576-111.131 1.00 0.00 H
+ATOM 9519 HD1 TYR M 234 -9.456 -31.681-108.738 1.00 0.00 H
+ATOM 9520 HD2 TYR M 234 -6.505 -30.026-111.371 1.00 0.00 H
+ATOM 9521 HE1 TYR M 234 -8.259 -30.739-106.813 1.00 0.00 H
+ATOM 9522 HE2 TYR M 234 -5.312 -29.087-109.448 1.00 0.00 H
+ATOM 9523 HH TYR M 234 -5.258 -28.861-107.251 1.00 0.00 H
+ATOM 9524 N ILE M 235 -6.945 -32.578-113.803 1.00 86.53 N
+ATOM 9525 CA ILE M 235 -5.748 -32.392-114.614 1.00 82.38 C
+ATOM 9526 C ILE M 235 -5.926 -31.106-115.404 1.00 96.94 C
+ATOM 9527 O ILE M 235 -6.886 -30.976-116.174 1.00107.27 O
+ATOM 9528 CB ILE M 235 -5.510 -33.574-115.564 1.00 79.40 C
+ATOM 9529 CG1 ILE M 235 -5.199 -34.844-114.777 1.00 73.94 C
+ATOM 9530 CG2 ILE M 235 -4.398 -33.253-116.543 1.00 85.86 C
+ATOM 9531 CD1 ILE M 235 -5.246 -36.090-115.623 1.00 71.65 C
+ATOM 9532 H ILE M 235 -7.849 -32.579-114.253 1.00 0.00 H
+ATOM 9533 HA ILE M 235 -4.888 -32.317-113.949 1.00 0.00 H
+ATOM 9534 HB ILE M 235 -6.423 -33.782-116.121 1.00 0.00 H
+ATOM 9535 1HG1 ILE M 235 -4.208 -34.762-114.332 1.00 0.00 H
+ATOM 9536 2HG1 ILE M 235 -5.915 -34.951-113.962 1.00 0.00 H
+ATOM 9537 1HG2 ILE M 235 -4.243 -34.102-117.208 1.00 0.00 H
+ATOM 9538 2HG2 ILE M 235 -4.672 -32.378-117.130 1.00 0.00 H
+ATOM 9539 3HG2 ILE M 235 -3.478 -33.049-115.995 1.00 0.00 H
+ATOM 9540 1HD1 ILE M 235 -5.016 -36.958-115.005 1.00 0.00 H
+ATOM 9541 2HD1 ILE M 235 -6.243 -36.202-116.051 1.00 0.00 H
+ATOM 9542 3HD1 ILE M 235 -4.513 -36.013-116.425 1.00 0.00 H
+ATOM 9543 N ASP M 236 -5.009 -30.164-115.224 1.00 94.01 N
+ATOM 9544 CA ASP M 236 -5.090 -28.867-115.876 1.00 99.38 C
+ATOM 9545 C ASP M 236 -3.970 -28.707-116.896 1.00 92.73 C
+ATOM 9546 O ASP M 236 -3.016 -29.486-116.946 1.00 97.02 O
+ATOM 9547 CB ASP M 236 -5.028 -27.734-114.845 1.00123.67 C
+ATOM 9548 CG ASP M 236 -6.190 -27.767-113.876 1.00136.11 C
+ATOM 9549 OD1 ASP M 236 -6.001 -27.394-112.699 1.00140.79 O
+ATOM 9550 OD2 ASP M 236 -7.295 -28.167-114.296 1.00136.35 O
+ATOM 9551 H ASP M 236 -4.230 -30.359-114.612 1.00 0.00 H
+ATOM 9552 HA ASP M 236 -6.043 -28.803-116.403 1.00 0.00 H
+ATOM 9553 1HB ASP M 236 -4.097 -27.805-114.281 1.00 0.00 H
+ATOM 9554 2HB ASP M 236 -5.026 -26.773-115.360 1.00 0.00 H
+ATOM 9555 N VAL M 237 -4.113 -27.683-117.718 1.00 92.53 N
+ATOM 9556 CA VAL M 237 -3.073 -27.254-118.642 1.00 88.85 C
+ATOM 9557 C VAL M 237 -2.226 -26.201-117.944 1.00104.42 C
+ATOM 9558 O VAL M 237 -2.748 -25.372-117.189 1.00117.69 O
+ATOM 9559 CB VAL M 237 -3.693 -26.711-119.945 1.00 80.90 C
+ATOM 9560 CG1 VAL M 237 -2.617 -26.236-120.899 1.00 83.56 C
+ATOM 9561 CG2 VAL M 237 -4.549 -27.780-120.603 1.00 76.51 C
+ATOM 9562 H VAL M 237 -4.989 -27.181-117.696 1.00 0.00 H
+ATOM 9563 HA VAL M 237 -2.450 -28.115-118.887 1.00 0.00 H
+ATOM 9564 HB VAL M 237 -4.313 -25.846-119.709 1.00 0.00 H
+ATOM 9565 1HG1 VAL M 237 -3.080 -25.857-121.811 1.00 0.00 H
+ATOM 9566 2HG1 VAL M 237 -2.039 -25.441-120.429 1.00 0.00 H
+ATOM 9567 3HG1 VAL M 237 -1.957 -27.067-121.147 1.00 0.00 H
+ATOM 9568 1HG2 VAL M 237 -4.982 -27.385-121.521 1.00 0.00 H
+ATOM 9569 2HG2 VAL M 237 -3.932 -28.648-120.836 1.00 0.00 H
+ATOM 9570 3HG2 VAL M 237 -5.348 -28.076-119.923 1.00 0.00 H
+ATOM 9571 N LEU M 238 -0.915 -26.243-118.176 1.00108.72 N
+ATOM 9572 CA LEU M 238 -0.016 -25.293-117.540 1.00118.76 C
+ATOM 9573 C LEU M 238 -0.388 -23.861-117.925 1.00120.43 C
+ATOM 9574 O LEU M 238 -0.860 -23.610-119.039 1.00122.58 O
+ATOM 9575 CB LEU M 238 1.434 -25.574-117.926 1.00119.55 C
+ATOM 9576 CG LEU M 238 2.090 -26.777-117.251 1.00110.83 C
+ATOM 9577 CD1 LEU M 238 3.593 -26.762-117.483 1.00106.70 C
+ATOM 9578 CD2 LEU M 238 1.767 -26.795-115.766 1.00103.85 C
+ATOM 9579 H LEU M 238 -0.533 -26.940-118.800 1.00 0.00 H
+ATOM 9580 HA LEU M 238 -0.112 -25.397-116.460 1.00 0.00 H
+ATOM 9581 1HB LEU M 238 1.482 -25.737-119.001 1.00 0.00 H
+ATOM 9582 2HB LEU M 238 2.034 -24.697-117.685 1.00 0.00 H
+ATOM 9583 HG LEU M 238 1.719 -27.696-117.705 1.00 0.00 H
+ATOM 9584 1HD1 LEU M 238 4.045 -27.626-116.996 1.00 0.00 H
+ATOM 9585 2HD1 LEU M 238 3.796 -26.803-118.553 1.00 0.00 H
+ATOM 9586 3HD1 LEU M 238 4.016 -25.848-117.067 1.00 0.00 H
+ATOM 9587 1HD2 LEU M 238 2.242 -27.659-115.301 1.00 0.00 H
+ATOM 9588 2HD2 LEU M 238 2.140 -25.882-115.301 1.00 0.00 H
+ATOM 9589 3HD2 LEU M 238 0.687 -26.857-115.629 1.00 0.00 H
+ATOM 9590 N PRO M 239 -0.190 -22.904-117.015 1.00111.87 N
+ATOM 9591 CA PRO M 239 -0.566 -21.514-117.318 1.00122.97 C
+ATOM 9592 C PRO M 239 0.134 -20.942-118.538 1.00138.52 C
+ATOM 9593 O PRO M 239 -0.426 -20.059-119.202 1.00146.25 O
+ATOM 9594 CB PRO M 239 -0.174 -20.764-116.038 1.00120.43 C
+ATOM 9595 CG PRO M 239 -0.211 -21.807-114.971 1.00114.84 C
+ATOM 9596 CD PRO M 239 0.263 -23.067-115.624 1.00103.39 C
+ATOM 9597 HA PRO M 239 -1.651 -21.462-117.488 1.00 0.00 H
+ATOM 9598 1HB PRO M 239 0.822 -20.312-116.157 1.00 0.00 H
+ATOM 9599 2HB PRO M 239 -0.880 -19.941-115.853 1.00 0.00 H
+ATOM 9600 1HG PRO M 239 0.431 -21.511-114.128 1.00 0.00 H
+ATOM 9601 2HG PRO M 239 -1.231 -21.907-114.573 1.00 0.00 H
+ATOM 9602 1HD PRO M 239 1.359 -23.126-115.555 1.00 0.00 H
+ATOM 9603 2HD PRO M 239 -0.204 -23.933-115.133 1.00 0.00 H
+ATOM 9604 N GLU M 240 1.340 -21.414-118.859 1.00135.32 N
+ATOM 9605 CA GLU M 240 2.026 -20.930-120.051 1.00133.23 C
+ATOM 9606 C GLU M 240 1.401 -21.466-121.332 1.00131.77 C
+ATOM 9607 O GLU M 240 1.588 -20.867-122.397 1.00133.14 O
+ATOM 9608 CB GLU M 240 3.506 -21.317-120.001 1.00129.95 C
+ATOM 9609 CG GLU M 240 4.300 -20.624-118.903 1.00 0.00 C
+ATOM 9610 CD GLU M 240 5.747 -21.033-118.881 1.00 0.00 C
+ATOM 9611 OE1 GLU M 240 6.114 -21.891-119.647 1.00 0.00 O
+ATOM 9612 OE2 GLU M 240 6.486 -20.486-118.096 1.00 0.00 O
+ATOM 9613 H GLU M 240 1.789 -22.110-118.281 1.00 0.00 H
+ATOM 9614 HA GLU M 240 1.939 -19.843-120.083 1.00 0.00 H
+ATOM 9615 1HB GLU M 240 3.595 -22.393-119.850 1.00 0.00 H
+ATOM 9616 2HB GLU M 240 3.976 -21.081-120.955 1.00 0.00 H
+ATOM 9617 1HG GLU M 240 4.241 -19.546-119.052 1.00 0.00 H
+ATOM 9618 2HG GLU M 240 3.847 -20.855-117.940 1.00 0.00 H
+ATOM 9619 N PHE M 241 0.655 -22.567-121.251 1.00130.09 N
+ATOM 9620 CA PHE M 241 0.072 -23.214-122.419 1.00123.54 C
+ATOM 9621 C PHE M 241 -1.439 -23.026-122.505 1.00118.78 C
+ATOM 9622 O PHE M 241 -2.094 -23.719-123.290 1.00115.11 O
+ATOM 9623 CB PHE M 241 0.413 -24.706-122.414 1.00110.97 C
+ATOM 9624 CG PHE M 241 1.886 -24.991-122.334 1.00111.64 C
+ATOM 9625 CD1 PHE M 241 2.354 -26.085-121.625 1.00112.30 C
+ATOM 9626 CD2 PHE M 241 2.802 -24.170-122.970 1.00118.74 C
+ATOM 9627 CE1 PHE M 241 3.708 -26.351-121.548 1.00118.82 C
+ATOM 9628 CE2 PHE M 241 4.157 -24.431-122.897 1.00129.90 C
+ATOM 9629 CZ PHE M 241 4.610 -25.524-122.185 1.00127.07 C
+ATOM 9630 H PHE M 241 0.492 -22.963-120.336 1.00 0.00 H
+ATOM 9631 HA PHE M 241 0.495 -22.758-123.315 1.00 0.00 H
+ATOM 9632 1HB PHE M 241 -0.073 -25.187-121.566 1.00 0.00 H
+ATOM 9633 2HB PHE M 241 0.026 -25.171-123.320 1.00 0.00 H
+ATOM 9634 HD1 PHE M 241 1.640 -26.740-121.125 1.00 0.00 H
+ATOM 9635 HD2 PHE M 241 2.443 -23.307-123.532 1.00 0.00 H
+ATOM 9636 HE1 PHE M 241 4.062 -27.214-120.984 1.00 0.00 H
+ATOM 9637 HE2 PHE M 241 4.868 -23.776-123.399 1.00 0.00 H
+ATOM 9638 HZ PHE M 241 5.677 -25.732-122.125 1.00 0.00 H
+ATOM 9639 N ARG M 242 -2.009 -22.109-121.718 1.00120.20 N
+ATOM 9640 CA ARG M 242 -3.453 -21.898-121.754 1.00112.81 C
+ATOM 9641 C ARG M 242 -3.910 -21.373-123.107 1.00115.32 C
+ATOM 9642 O ARG M 242 -5.047 -21.627-123.522 1.00114.40 O
+ATOM 9643 CB ARG M 242 -3.876 -20.919-120.669 1.00112.00 C
+ATOM 9644 CG ARG M 242 -3.380 -19.495-120.863 1.00 0.00 C
+ATOM 9645 CD ARG M 242 -3.753 -18.623-119.720 1.00 0.00 C
+ATOM 9646 NE ARG M 242 -3.310 -17.252-119.917 1.00 0.00 N
+ATOM 9647 CZ ARG M 242 -3.499 -16.252-119.033 1.00 0.00 C
+ATOM 9648 NH1 ARG M 242 -4.125 -16.486-117.901 1.00 0.00 N
+ATOM 9649 NH2 ARG M 242 -3.057 -15.037-119.306 1.00 0.00 N
+ATOM 9650 H ARG M 242 -1.446 -21.553-121.090 1.00 0.00 H
+ATOM 9651 HA ARG M 242 -3.947 -22.856-121.587 1.00 0.00 H
+ATOM 9652 1HB ARG M 242 -4.963 -20.884-120.615 1.00 0.00 H
+ATOM 9653 2HB ARG M 242 -3.511 -21.267-119.702 1.00 0.00 H
+ATOM 9654 1HG ARG M 242 -2.293 -19.498-120.951 1.00 0.00 H
+ATOM 9655 2HG ARG M 242 -3.816 -19.078-121.771 1.00 0.00 H
+ATOM 9656 1HD ARG M 242 -4.837 -18.617-119.606 1.00 0.00 H
+ATOM 9657 2HD ARG M 242 -3.295 -19.002-118.808 1.00 0.00 H
+ATOM 9658 HE ARG M 242 -2.824 -17.034-120.777 1.00 0.00 H
+ATOM 9659 1HH1 ARG M 242 -4.463 -17.415-117.693 1.00 0.00 H
+ATOM 9660 2HH1 ARG M 242 -4.267 -15.737-117.239 1.00 0.00 H
+ATOM 9661 1HH2 ARG M 242 -2.576 -14.858-120.177 1.00 0.00 H
+ATOM 9662 2HH2 ARG M 242 -3.199 -14.289-118.644 1.00 0.00 H
+ATOM 9663 N ASP M 243 -3.045 -20.642-123.804 1.00122.04 N
+ATOM 9664 CA ASP M 243 -3.352 -20.083-125.114 1.00125.03 C
+ATOM 9665 C ASP M 243 -2.753 -20.888-126.257 1.00125.10 C
+ATOM 9666 O ASP M 243 -3.421 -21.104-127.272 1.00125.09 O
+ATOM 9667 CB ASP M 243 -2.851 -18.638-125.191 1.00132.77 C
+ATOM 9668 CG ASP M 243 -1.487 -18.463-124.546 1.00142.87 C
+ATOM 9669 OD1 ASP M 243 -1.303 -18.929-123.401 1.00136.39 O
+ATOM 9670 OD2 ASP M 243 -0.598 -17.862-125.184 1.00155.26 O
+ATOM 9671 H ASP M 243 -2.136 -20.472-123.397 1.00 0.00 H
+ATOM 9672 HA ASP M 243 -4.434 -20.091-125.249 1.00 0.00 H
+ATOM 9673 1HB ASP M 243 -2.791 -18.329-126.235 1.00 0.00 H
+ATOM 9674 2HB ASP M 243 -3.564 -17.979-124.695 1.00 0.00 H
+ATOM 9675 N SER M 244 -1.508 -21.346-126.110 1.00127.65 N
+ATOM 9676 CA SER M 244 -0.832 -22.048-127.194 1.00131.70 C
+ATOM 9677 C SER M 244 -1.341 -23.470-127.382 1.00128.26 C
+ATOM 9678 O SER M 244 -1.155 -24.041-128.462 1.00130.49 O
+ATOM 9679 CB SER M 244 0.677 -22.076-126.944 1.00141.57 C
+ATOM 9680 OG SER M 244 0.979 -22.705-125.710 1.00142.19 O
+ATOM 9681 H SER M 244 -1.022 -21.207-125.236 1.00 0.00 H
+ATOM 9682 HA SER M 244 -1.024 -21.514-128.125 1.00 0.00 H
+ATOM 9683 1HB SER M 244 1.170 -22.609-127.756 1.00 0.00 H
+ATOM 9684 2HB SER M 244 1.064 -21.058-126.939 1.00 0.00 H
+ATOM 9685 HG SER M 244 0.135 -22.963-125.331 1.00 0.00 H
+ATOM 9686 N TYR M 245 -1.975 -24.053-126.366 1.00116.97 N
+ATOM 9687 CA TYR M 245 -2.429 -25.443-126.408 1.00101.54 C
+ATOM 9688 C TYR M 245 -3.913 -25.503-126.071 1.00 91.90 C
+ATOM 9689 O TYR M 245 -4.291 -25.776-124.923 1.00 88.53 O
+ATOM 9690 CB TYR M 245 -1.614 -26.316-125.454 1.00 93.10 C
+ATOM 9691 CG TYR M 245 -1.648 -27.784-125.799 1.00 94.06 C
+ATOM 9692 CD1 TYR M 245 -0.697 -28.337-126.642 1.00 83.05 C
+ATOM 9693 CD2 TYR M 245 -2.632 -28.616-125.285 1.00101.59 C
+ATOM 9694 CE1 TYR M 245 -0.723 -29.678-126.964 1.00 94.45 C
+ATOM 9695 CE2 TYR M 245 -2.666 -29.959-125.601 1.00102.45 C
+ATOM 9696 CZ TYR M 245 -1.710 -30.483-126.443 1.00 97.16 C
+ATOM 9697 OH TYR M 245 -1.737 -31.821-126.762 1.00 96.17 O
+ATOM 9698 H TYR M 245 -2.145 -23.505-125.535 1.00 0.00 H
+ATOM 9699 HA TYR M 245 -2.292 -25.821-127.421 1.00 0.00 H
+ATOM 9700 1HB TYR M 245 -0.574 -25.988-125.459 1.00 0.00 H
+ATOM 9701 2HB TYR M 245 -1.991 -26.195-124.439 1.00 0.00 H
+ATOM 9702 HD1 TYR M 245 0.089 -27.710-127.063 1.00 0.00 H
+ATOM 9703 HD2 TYR M 245 -3.396 -28.211-124.621 1.00 0.00 H
+ATOM 9704 HE1 TYR M 245 0.034 -30.093-127.629 1.00 0.00 H
+ATOM 9705 HE2 TYR M 245 -3.446 -30.597-125.186 1.00 0.00 H
+ATOM 9706 HH TYR M 245 -2.478 -32.240-126.318 1.00 0.00 H
+ATOM 9707 N PRO M 246 -4.782 -25.248-127.044 1.00 87.75 N
+ATOM 9708 CA PRO M 246 -6.218 -25.439-126.820 1.00 82.37 C
+ATOM 9709 C PRO M 246 -6.591 -26.908-126.897 1.00 81.39 C
+ATOM 9710 O PRO M 246 -5.954 -27.702-127.593 1.00105.29 O
+ATOM 9711 CB PRO M 246 -6.869 -24.645-127.962 1.00 75.88 C
+ATOM 9712 CG PRO M 246 -5.756 -23.843-128.590 1.00 84.39 C
+ATOM 9713 CD PRO M 246 -4.512 -24.629-128.350 1.00 87.79 C
+ATOM 9714 HA PRO M 246 -6.492 -25.012-125.844 1.00 0.00 H
+ATOM 9715 1HB PRO M 246 -7.338 -25.334-128.680 1.00 0.00 H
+ATOM 9716 2HB PRO M 246 -7.668 -24.002-127.565 1.00 0.00 H
+ATOM 9717 1HG PRO M 246 -5.952 -23.696-129.662 1.00 0.00 H
+ATOM 9718 2HG PRO M 246 -5.706 -22.842-128.136 1.00 0.00 H
+ATOM 9719 1HD PRO M 246 -4.392 -25.379-129.146 1.00 0.00 H
+ATOM 9720 2HD PRO M 246 -3.648 -23.949-128.323 1.00 0.00 H
+ATOM 9721 N ILE M 247 -7.641 -27.267-126.160 1.00 68.93 N
+ATOM 9722 CA ILE M 247 -8.141 -28.638-126.133 1.00 65.58 C
+ATOM 9723 C ILE M 247 -9.662 -28.593-126.210 1.00 66.00 C
+ATOM 9724 O ILE M 247 -10.316 -28.088-125.292 1.00 64.03 O
+ATOM 9725 CB ILE M 247 -7.700 -29.404-124.874 1.00 73.66 C
+ATOM 9726 CG1 ILE M 247 -6.175 -29.435-124.752 1.00 77.22 C
+ATOM 9727 CG2 ILE M 247 -8.260 -30.807-124.903 1.00 70.60 C
+ATOM 9728 CD1 ILE M 247 -5.670 -30.227-123.557 1.00 79.98 C
+ATOM 9729 H ILE M 247 -8.104 -26.563-125.602 1.00 0.00 H
+ATOM 9730 HA ILE M 247 -7.743 -29.168-126.997 1.00 0.00 H
+ATOM 9731 HB ILE M 247 -8.068 -28.889-123.987 1.00 0.00 H
+ATOM 9732 1HG1 ILE M 247 -5.747 -29.869-125.655 1.00 0.00 H
+ATOM 9733 2HG1 ILE M 247 -5.796 -28.416-124.669 1.00 0.00 H
+ATOM 9734 1HG2 ILE M 247 -7.943 -31.344-124.009 1.00 0.00 H
+ATOM 9735 2HG2 ILE M 247 -9.348 -30.764-124.934 1.00 0.00 H
+ATOM 9736 3HG2 ILE M 247 -7.893 -31.327-125.788 1.00 0.00 H
+ATOM 9737 1HD1 ILE M 247 -4.580 -30.202-123.538 1.00 0.00 H
+ATOM 9738 2HD1 ILE M 247 -6.059 -29.787-122.638 1.00 0.00 H
+ATOM 9739 3HD1 ILE M 247 -6.007 -31.259-123.636 1.00 0.00 H
+ATOM 9740 N LYS M 248 -10.226 -29.126-127.292 1.00 65.23 N
+ATOM 9741 CA LYS M 248 -11.671 -29.177-127.481 1.00 68.38 C
+ATOM 9742 C LYS M 248 -12.145 -30.616-127.332 1.00 64.25 C
+ATOM 9743 O LYS M 248 -11.675 -31.506-128.048 1.00 67.05 O
+ATOM 9744 CB LYS M 248 -12.073 -28.611-128.842 1.00 79.73 C
+ATOM 9745 CG LYS M 248 -12.424 -27.133-128.796 1.00 99.62 C
+ATOM 9746 CD LYS M 248 -13.090 -26.677-130.082 1.00113.08 C
+ATOM 9747 CE LYS M 248 -13.676 -25.283-129.923 1.00111.23 C
+ATOM 9748 NZ LYS M 248 -14.736 -25.251-128.877 1.00102.13 N
+ATOM 9749 H LYS M 248 -9.623 -29.508-128.006 1.00 0.00 H
+ATOM 9750 HA LYS M 248 -12.143 -28.571-126.706 1.00 0.00 H
+ATOM 9751 1HB LYS M 248 -11.256 -28.751-129.550 1.00 0.00 H
+ATOM 9752 2HB LYS M 248 -12.934 -29.159-129.224 1.00 0.00 H
+ATOM 9753 1HG LYS M 248 -13.102 -26.946-127.962 1.00 0.00 H
+ATOM 9754 2HG LYS M 248 -11.517 -26.549-128.642 1.00 0.00 H
+ATOM 9755 1HD LYS M 248 -12.356 -26.669-130.889 1.00 0.00 H
+ATOM 9756 2HD LYS M 248 -13.887 -27.373-130.346 1.00 0.00 H
+ATOM 9757 1HE LYS M 248 -12.886 -24.586-129.649 1.00 0.00 H
+ATOM 9758 2HE LYS M 248 -14.104 -24.958-130.871 1.00 0.00 H
+ATOM 9759 1HZ LYS M 248 -15.103 -24.313-128.798 1.00 0.00 H
+ATOM 9760 2HZ LYS M 248 -15.481 -25.884-129.133 1.00 0.00 H
+ATOM 9761 3HZ LYS M 248 -14.344 -25.534-127.991 1.00 0.00 H
+ATOM 9762 N TYR M 249 -13.083 -30.835-126.414 1.00 60.93 N
+ATOM 9763 CA TYR M 249 -13.523 -32.172-126.030 1.00 63.46 C
+ATOM 9764 C TYR M 249 -14.766 -32.539-126.836 1.00 68.49 C
+ATOM 9765 O TYR M 249 -15.833 -31.943-126.656 1.00 74.77 O
+ATOM 9766 CB TYR M 249 -13.780 -32.227-124.525 1.00 67.19 C
+ATOM 9767 CG TYR M 249 -12.542 -31.904-123.710 1.00 73.33 C
+ATOM 9768 CD1 TYR M 249 -12.212 -30.592-123.397 1.00 80.28 C
+ATOM 9769 CD2 TYR M 249 -11.694 -32.911-123.272 1.00 74.55 C
+ATOM 9770 CE1 TYR M 249 -11.076 -30.294-122.664 1.00 85.23 C
+ATOM 9771 CE2 TYR M 249 -10.556 -32.622-122.538 1.00 81.44 C
+ATOM 9772 CZ TYR M 249 -10.253 -31.313-122.235 1.00 85.69 C
+ATOM 9773 OH TYR M 249 -9.120 -31.020-121.507 1.00 88.04 O
+ATOM 9774 H TYR M 249 -13.503 -30.032-125.969 1.00 0.00 H
+ATOM 9775 HA TYR M 249 -12.733 -32.881-126.279 1.00 0.00 H
+ATOM 9776 1HB TYR M 249 -14.568 -31.519-124.264 1.00 0.00 H
+ATOM 9777 2HB TYR M 249 -14.131 -33.222-124.252 1.00 0.00 H
+ATOM 9778 HD1 TYR M 249 -12.852 -29.775-123.730 1.00 0.00 H
+ATOM 9779 HD2 TYR M 249 -11.918 -33.952-123.505 1.00 0.00 H
+ATOM 9780 HE1 TYR M 249 -10.835 -29.257-122.429 1.00 0.00 H
+ATOM 9781 HE2 TYR M 249 -9.904 -33.429-122.203 1.00 0.00 H
+ATOM 9782 HH TYR M 249 -8.659 -31.835-121.293 1.00 0.00 H
+ATOM 9783 N VAL M 250 -14.625 -33.526-127.717 1.00 65.88 N
+ATOM 9784 CA VAL M 250 -15.677 -33.863-128.674 1.00 60.30 C
+ATOM 9785 C VAL M 250 -16.685 -34.837-128.083 1.00 61.84 C
+ATOM 9786 O VAL M 250 -17.895 -34.605-128.142 1.00 73.11 O
+ATOM 9787 CB VAL M 250 -15.053 -34.428-129.966 1.00 56.98 C
+ATOM 9788 CG1 VAL M 250 -16.144 -34.767-130.966 1.00 54.64 C
+ATOM 9789 CG2 VAL M 250 -14.065 -33.439-130.553 1.00 58.77 C
+ATOM 9790 H VAL M 250 -13.766 -34.057-127.723 1.00 0.00 H
+ATOM 9791 HA VAL M 250 -16.228 -32.954-128.917 1.00 0.00 H
+ATOM 9792 HB VAL M 250 -14.535 -35.358-129.732 1.00 0.00 H
+ATOM 9793 1HG1 VAL M 250 -15.693 -35.166-131.875 1.00 0.00 H
+ATOM 9794 2HG1 VAL M 250 -16.813 -35.513-130.536 1.00 0.00 H
+ATOM 9795 3HG1 VAL M 250 -16.709 -33.867-131.207 1.00 0.00 H
+ATOM 9796 1HG2 VAL M 250 -13.633 -33.853-131.464 1.00 0.00 H
+ATOM 9797 2HG2 VAL M 250 -14.579 -32.506-130.786 1.00 0.00 H
+ATOM 9798 3HG2 VAL M 250 -13.271 -33.245-129.831 1.00 0.00 H
+ATOM 9799 N HIS M 251 -16.220 -35.951-127.523 1.00 55.87 N
+ATOM 9800 CA HIS M 251 -17.129 -36.969-127.015 1.00 55.84 C
+ATOM 9801 C HIS M 251 -16.599 -37.495-125.690 1.00 65.61 C
+ATOM 9802 O HIS M 251 -15.455 -37.241-125.308 1.00 80.35 O
+ATOM 9803 CB HIS M 251 -17.303 -38.114-128.023 1.00 60.23 C
+ATOM 9804 CG HIS M 251 -18.511 -38.968-127.778 1.00 67.80 C
+ATOM 9805 ND1 HIS M 251 -19.679 -38.474-127.238 1.00 80.29 N
+ATOM 9806 CD2 HIS M 251 -18.731 -40.285-128.007 1.00 60.23 C
+ATOM 9807 CE1 HIS M 251 -20.565 -39.450-127.143 1.00 74.23 C
+ATOM 9808 NE2 HIS M 251 -20.015 -40.559-127.603 1.00 61.93 N
+ATOM 9809 H HIS M 251 -15.224 -36.098-127.446 1.00 0.00 H
+ATOM 9810 HA HIS M 251 -18.110 -36.527-126.842 1.00 0.00 H
+ATOM 9811 1HB HIS M 251 -17.379 -37.704-129.031 1.00 0.00 H
+ATOM 9812 2HB HIS M 251 -16.424 -38.758-127.997 1.00 0.00 H
+ATOM 9813 HD2 HIS M 251 -18.021 -40.995-128.432 1.00 0.00 H
+ATOM 9814 HE1 HIS M 251 -21.578 -39.356-126.752 1.00 0.00 H
+ATOM 9815 HE2 HIS M 251 -20.462 -41.464-127.652 1.00 0.00 H
+ATOM 9816 N ALA M 252 -17.453 -38.231-124.981 1.00 50.50 N
+ATOM 9817 CA ALA M 252 -17.058 -38.877-123.737 1.00 51.74 C
+ATOM 9818 C ALA M 252 -18.032 -40.007-123.456 1.00 59.47 C
+ATOM 9819 O ALA M 252 -19.248 -39.805-123.529 1.00 75.01 O
+ATOM 9820 CB ALA M 252 -17.039 -37.881-122.572 1.00 52.85 C
+ATOM 9821 H ALA M 252 -18.399 -38.344-125.315 1.00 0.00 H
+ATOM 9822 HA ALA M 252 -16.051 -39.275-123.867 1.00 0.00 H
+ATOM 9823 1HB ALA M 252 -16.740 -38.395-121.658 1.00 0.00 H
+ATOM 9824 2HB ALA M 252 -16.329 -37.082-122.788 1.00 0.00 H
+ATOM 9825 3HB ALA M 252 -18.033 -37.457-122.440 1.00 0.00 H
+ATOM 9826 N PHE M 253 -17.503 -41.188-123.143 1.00 56.68 N
+ATOM 9827 CA PHE M 253 -18.349 -42.342-122.875 1.00 63.88 C
+ATOM 9828 C PHE M 253 -17.667 -43.242-121.855 1.00 69.89 C
+ATOM 9829 O PHE M 253 -16.498 -43.057-121.508 1.00 69.57 O
+ATOM 9830 CB PHE M 253 -18.671 -43.117-124.160 1.00 60.15 C
+ATOM 9831 CG PHE M 253 -17.461 -43.653-124.870 1.00 59.28 C
+ATOM 9832 CD1 PHE M 253 -17.033 -44.953-124.655 1.00 64.18 C
+ATOM 9833 CD2 PHE M 253 -16.751 -42.858-125.757 1.00 62.90 C
+ATOM 9834 CE1 PHE M 253 -15.917 -45.448-125.307 1.00 60.49 C
+ATOM 9835 CE2 PHE M 253 -15.636 -43.349-126.412 1.00 63.15 C
+ATOM 9836 CZ PHE M 253 -15.219 -44.644-126.187 1.00 58.42 C
+ATOM 9837 H PHE M 253 -16.500 -41.290-123.089 1.00 0.00 H
+ATOM 9838 HA PHE M 253 -19.289 -41.990-122.447 1.00 0.00 H
+ATOM 9839 1HB PHE M 253 -19.324 -43.956-123.924 1.00 0.00 H
+ATOM 9840 2HB PHE M 253 -19.208 -42.469-124.851 1.00 0.00 H
+ATOM 9841 HD1 PHE M 253 -17.587 -45.588-123.963 1.00 0.00 H
+ATOM 9842 HD2 PHE M 253 -17.080 -41.834-125.935 1.00 0.00 H
+ATOM 9843 HE1 PHE M 253 -15.590 -46.472-125.126 1.00 0.00 H
+ATOM 9844 HE2 PHE M 253 -15.086 -42.713-127.105 1.00 0.00 H
+ATOM 9845 HZ PHE M 253 -14.340 -45.031-126.701 1.00 0.00 H
+ATOM 9846 N GLU M 254 -18.419 -44.227-121.374 1.00 71.90 N
+ATOM 9847 CA GLU M 254 -17.933 -45.199-120.406 1.00 77.48 C
+ATOM 9848 C GLU M 254 -18.089 -46.596-120.986 1.00 79.51 C
+ATOM 9849 O GLU M 254 -19.152 -46.938-121.515 1.00 79.57 O
+ATOM 9850 CB GLU M 254 -18.687 -45.079-119.079 1.00 86.37 C
+ATOM 9851 CG GLU M 254 -18.245 -46.084-118.030 1.00114.04 C
+ATOM 9852 CD GLU M 254 -18.947 -45.887-116.702 1.00133.05 C
+ATOM 9853 OE1 GLU M 254 -19.738 -44.927-116.582 1.00137.66 O
+ATOM 9854 OE2 GLU M 254 -18.707 -46.693-115.778 1.00139.63 O
+ATOM 9855 H GLU M 254 -19.372 -44.294-121.703 1.00 0.00 H
+ATOM 9856 HA GLU M 254 -16.877 -45.003-120.220 1.00 0.00 H
+ATOM 9857 1HB GLU M 254 -18.548 -44.078-118.671 1.00 0.00 H
+ATOM 9858 2HB GLU M 254 -19.754 -45.216-119.253 1.00 0.00 H
+ATOM 9859 1HG GLU M 254 -18.453 -47.090-118.395 1.00 0.00 H
+ATOM 9860 2HG GLU M 254 -17.169 -45.994-117.887 1.00 0.00 H
+ATOM 9861 N SER M 255 -17.032 -47.398-120.890 1.00 85.81 N
+ATOM 9862 CA SER M 255 -17.058 -48.738-121.457 1.00 90.42 C
+ATOM 9863 C SER M 255 -16.011 -49.594-120.764 1.00 95.04 C
+ATOM 9864 O SER M 255 -14.897 -49.130-120.508 1.00 88.59 O
+ATOM 9865 CB SER M 255 -16.804 -48.707-122.970 1.00 83.44 C
+ATOM 9866 OG SER M 255 -16.783 -50.016-123.513 1.00 78.48 O
+ATOM 9867 H SER M 255 -16.197 -47.079-120.419 1.00 0.00 H
+ATOM 9868 HA SER M 255 -18.046 -49.168-121.285 1.00 0.00 H
+ATOM 9869 1HB SER M 255 -17.584 -48.122-123.458 1.00 0.00 H
+ATOM 9870 2HB SER M 255 -15.853 -48.215-123.169 1.00 0.00 H
+ATOM 9871 HG SER M 255 -16.938 -50.611-122.775 1.00 0.00 H
+ATOM 9872 N ASN M 256 -16.382 -50.842-120.468 1.00105.75 N
+ATOM 9873 CA ASN M 256 -15.472 -51.827-119.880 1.00118.71 C
+ATOM 9874 C ASN M 256 -14.829 -51.297-118.601 1.00119.61 C
+ATOM 9875 O ASN M 256 -13.642 -51.512-118.343 1.00126.64 O
+ATOM 9876 CB ASN M 256 -14.402 -52.260-120.885 1.00129.84 C
+ATOM 9877 CG ASN M 256 -14.993 -52.799-122.175 1.00137.00 C
+ATOM 9878 OD1 ASN M 256 -16.095 -52.422-122.575 1.00141.29 O
+ATOM 9879 ND2 ASN M 256 -14.260 -53.691-122.833 1.00135.11 N
+ATOM 9880 H ASN M 256 -17.337 -51.109-120.663 1.00 0.00 H
+ATOM 9881 HA ASN M 256 -16.051 -52.707-119.595 1.00 0.00 H
+ATOM 9882 1HB ASN M 256 -13.760 -51.411-121.122 1.00 0.00 H
+ATOM 9883 2HB ASN M 256 -13.774 -53.031-120.438 1.00 0.00 H
+ATOM 9884 1HD2 ASN M 256 -14.598 -54.082-123.690 1.00 0.00 H
+ATOM 9885 2HD2 ASN M 256 -13.371 -53.972-122.472 1.00 0.00 H
+ATOM 9886 N ASN M 257 -15.625 -50.589-117.797 1.00113.05 N
+ATOM 9887 CA ASN M 257 -15.162 -49.994-116.541 1.00104.43 C
+ATOM 9888 C ASN M 257 -14.009 -49.019-116.778 1.00 94.61 C
+ATOM 9889 O ASN M 257 -13.058 -48.947-115.996 1.00 98.96 O
+ATOM 9890 CB ASN M 257 -14.769 -51.074-115.530 1.00109.86 C
+ATOM 9891 CG ASN M 257 -15.868 -52.094-115.315 1.00115.30 C
+ATOM 9892 OD1 ASN M 257 -16.782 -51.882-114.517 1.00118.30 O
+ATOM 9893 ND2 ASN M 257 -15.786 -53.210-116.030 1.00115.40 N
+ATOM 9894 H ASN M 257 -16.588 -50.463-118.075 1.00 0.00 H
+ATOM 9895 HA ASN M 257 -15.977 -49.406-116.115 1.00 0.00 H
+ATOM 9896 1HB ASN M 257 -13.873 -51.589-115.878 1.00 0.00 H
+ATOM 9897 2HB ASN M 257 -14.529 -50.608-114.574 1.00 0.00 H
+ATOM 9898 1HD2 ASN M 257 -16.484 -53.920-115.930 1.00 0.00 H
+ATOM 9899 2HD2 ASN M 257 -15.027 -53.340-116.668 1.00 0.00 H
+ATOM 9900 N PHE M 258 -14.094 -48.266-117.873 1.00 84.01 N
+ATOM 9901 CA PHE M 258 -13.127 -47.228-118.199 1.00 75.00 C
+ATOM 9902 C PHE M 258 -13.877 -46.002-118.695 1.00 76.09 C
+ATOM 9903 O PHE M 258 -14.967 -46.113-119.266 1.00 77.79 O
+ATOM 9904 CB PHE M 258 -12.124 -47.675-119.275 1.00 73.13 C
+ATOM 9905 CG PHE M 258 -11.009 -48.539-118.756 1.00 85.33 C
+ATOM 9906 CD1 PHE M 258 -10.928 -49.877-119.111 1.00 74.24 C
+ATOM 9907 CD2 PHE M 258 -10.042 -48.014-117.913 1.00 92.32 C
+ATOM 9908 CE1 PHE M 258 -9.903 -50.673-118.639 1.00 72.83 C
+ATOM 9909 CE2 PHE M 258 -9.016 -48.807-117.434 1.00 86.78 C
+ATOM 9910 CZ PHE M 258 -8.947 -50.138-117.797 1.00 81.10 C
+ATOM 9911 H PHE M 258 -14.869 -48.431-118.500 1.00 0.00 H
+ATOM 9912 HA PHE M 258 -12.561 -46.987-117.298 1.00 0.00 H
+ATOM 9913 1HB PHE M 258 -12.647 -48.232-120.051 1.00 0.00 H
+ATOM 9914 2HB PHE M 258 -11.680 -46.798-119.744 1.00 0.00 H
+ATOM 9915 HD1 PHE M 258 -11.686 -50.299-119.772 1.00 0.00 H
+ATOM 9916 HD2 PHE M 258 -10.098 -46.963-117.627 1.00 0.00 H
+ATOM 9917 HE1 PHE M 258 -9.849 -51.721-118.931 1.00 0.00 H
+ATOM 9918 HE2 PHE M 258 -8.262 -48.384-116.770 1.00 0.00 H
+ATOM 9919 HZ PHE M 258 -8.141 -50.765-117.419 1.00 0.00 H
+ATOM 9920 N ILE M 259 -13.282 -44.830-118.480 1.00 66.80 N
+ATOM 9921 CA ILE M 259 -13.826 -43.568-118.969 1.00 59.92 C
+ATOM 9922 C ILE M 259 -12.980 -43.104-120.144 1.00 70.09 C
+ATOM 9923 O ILE M 259 -11.745 -43.060-120.050 1.00 84.61 O
+ATOM 9924 CB ILE M 259 -13.868 -42.496-117.868 1.00 74.93 C
+ATOM 9925 CG1 ILE M 259 -14.567 -43.035-116.618 1.00 75.25 C
+ATOM 9926 CG2 ILE M 259 -14.576 -41.249-118.377 1.00 79.84 C
+ATOM 9927 CD1 ILE M 259 -16.010 -43.425-116.849 1.00 71.63 C
+ATOM 9928 H ILE M 259 -12.419 -44.823-117.956 1.00 0.00 H
+ATOM 9929 HA ILE M 259 -14.847 -43.740-119.309 1.00 0.00 H
+ATOM 9930 HB ILE M 259 -12.851 -42.235-117.576 1.00 0.00 H
+ATOM 9931 1HG1 ILE M 259 -14.031 -43.909-116.250 1.00 0.00 H
+ATOM 9932 2HG1 ILE M 259 -14.539 -42.280-115.832 1.00 0.00 H
+ATOM 9933 1HG2 ILE M 259 -14.600 -40.497-117.589 1.00 0.00 H
+ATOM 9934 2HG2 ILE M 259 -14.041 -40.853-119.239 1.00 0.00 H
+ATOM 9935 3HG2 ILE M 259 -15.596 -41.503-118.668 1.00 0.00 H
+ATOM 9936 1HD1 ILE M 259 -16.440 -43.797-115.919 1.00 0.00 H
+ATOM 9937 2HD1 ILE M 259 -16.573 -42.554-117.186 1.00 0.00 H
+ATOM 9938 3HD1 ILE M 259 -16.059 -44.205-117.608 1.00 0.00 H
+ATOM 9939 N TYR M 260 -13.646 -42.755-121.244 1.00 64.95 N
+ATOM 9940 CA TYR M 260 -12.997 -42.326-122.474 1.00 56.70 C
+ATOM 9941 C TYR M 260 -13.485 -40.940-122.868 1.00 51.02 C
+ATOM 9942 O TYR M 260 -14.671 -40.619-122.724 1.00 59.75 O
+ATOM 9943 CB TYR M 260 -13.272 -43.303-123.618 1.00 64.79 C
+ATOM 9944 CG TYR M 260 -12.835 -44.724-123.351 1.00 68.43 C
+ATOM 9945 CD1 TYR M 260 -13.686 -45.623-122.726 1.00 62.81 C
+ATOM 9946 CD2 TYR M 260 -11.582 -45.173-123.744 1.00 66.31 C
+ATOM 9947 CE1 TYR M 260 -13.299 -46.924-122.486 1.00 62.90 C
+ATOM 9948 CE2 TYR M 260 -11.185 -46.476-123.508 1.00 65.62 C
+ATOM 9949 CZ TYR M 260 -12.049 -47.347-122.878 1.00 64.43 C
+ATOM 9950 OH TYR M 260 -11.667 -48.647-122.641 1.00 72.25 O
+ATOM 9951 H TYR M 260 -14.655 -42.795-121.208 1.00 0.00 H
+ATOM 9952 HA TYR M 260 -11.920 -42.294-122.304 1.00 0.00 H
+ATOM 9953 1HB TYR M 260 -14.341 -43.319-123.834 1.00 0.00 H
+ATOM 9954 2HB TYR M 260 -12.761 -42.962-124.518 1.00 0.00 H
+ATOM 9955 HD1 TYR M 260 -14.681 -45.305-122.415 1.00 0.00 H
+ATOM 9956 HD2 TYR M 260 -10.893 -44.494-124.247 1.00 0.00 H
+ATOM 9957 HE1 TYR M 260 -13.984 -47.614-121.993 1.00 0.00 H
+ATOM 9958 HE2 TYR M 260 -10.194 -46.809-123.819 1.00 0.00 H
+ATOM 9959 HH TYR M 260 -10.777 -48.784-122.974 1.00 0.00 H
+ATOM 9960 N PHE M 261 -12.559 -40.134-123.383 1.00 58.84 N
+ATOM 9961 CA PHE M 261 -12.821 -38.768-123.820 1.00 69.64 C
+ATOM 9962 C PHE M 261 -12.171 -38.582-125.182 1.00 71.36 C
+ATOM 9963 O PHE M 261 -10.943 -38.630-125.295 1.00 69.03 O
+ATOM 9964 CB PHE M 261 -12.264 -37.751-122.824 1.00 68.65 C
+ATOM 9965 CG PHE M 261 -13.261 -37.269-121.820 1.00 64.32 C
+ATOM 9966 CD1 PHE M 261 -13.531 -38.011-120.683 1.00 75.09 C
+ATOM 9967 CD2 PHE M 261 -13.909 -36.059-121.996 1.00 58.17 C
+ATOM 9968 CE1 PHE M 261 -14.440 -37.564-119.746 1.00 73.06 C
+ATOM 9969 CE2 PHE M 261 -14.821 -35.605-121.063 1.00 62.49 C
+ATOM 9970 CZ PHE M 261 -15.086 -36.359-119.936 1.00 65.92 C
+ATOM 9971 H PHE M 261 -11.624 -40.507-123.469 1.00 0.00 H
+ATOM 9972 HA PHE M 261 -13.901 -38.627-123.885 1.00 0.00 H
+ATOM 9973 1HB PHE M 261 -11.428 -38.192-122.283 1.00 0.00 H
+ATOM 9974 2HB PHE M 261 -11.884 -36.885-123.363 1.00 0.00 H
+ATOM 9975 HD1 PHE M 261 -13.015 -38.960-120.531 1.00 0.00 H
+ATOM 9976 HD2 PHE M 261 -13.699 -35.465-122.886 1.00 0.00 H
+ATOM 9977 HE1 PHE M 261 -14.646 -38.162-118.859 1.00 0.00 H
+ATOM 9978 HE2 PHE M 261 -15.332 -34.654-121.214 1.00 0.00 H
+ATOM 9979 HZ PHE M 261 -15.805 -36.003-119.200 1.00 0.00 H
+ATOM 9980 N LEU M 262 -12.982 -38.373-126.210 1.00 69.33 N
+ATOM 9981 CA LEU M 262 -12.472 -38.038-127.530 1.00 67.58 C
+ATOM 9982 C LEU M 262 -12.296 -36.529-127.618 1.00 58.70 C
+ATOM 9983 O LEU M 262 -13.240 -35.773-127.348 1.00 56.92 O
+ATOM 9984 CB LEU M 262 -13.427 -38.536-128.611 1.00 61.18 C
+ATOM 9985 CG LEU M 262 -13.717 -40.032-128.520 1.00 61.83 C
+ATOM 9986 CD1 LEU M 262 -14.756 -40.431-129.542 1.00 65.02 C
+ATOM 9987 CD2 LEU M 262 -12.438 -40.824-128.719 1.00 60.17 C
+ATOM 9988 H LEU M 262 -13.980 -38.448-126.073 1.00 0.00 H
+ATOM 9989 HA LEU M 262 -11.508 -38.528-127.663 1.00 0.00 H
+ATOM 9990 1HB LEU M 262 -14.364 -37.989-128.525 1.00 0.00 H
+ATOM 9991 2HB LEU M 262 -12.992 -38.319-129.586 1.00 0.00 H
+ATOM 9992 HG LEU M 262 -14.132 -40.263-127.539 1.00 0.00 H
+ATOM 9993 1HD1 LEU M 262 -14.951 -41.501-129.464 1.00 0.00 H
+ATOM 9994 2HD1 LEU M 262 -15.678 -39.880-129.357 1.00 0.00 H
+ATOM 9995 3HD1 LEU M 262 -14.389 -40.202-130.542 1.00 0.00 H
+ATOM 9996 1HD2 LEU M 262 -12.656 -41.890-128.651 1.00 0.00 H
+ATOM 9997 2HD2 LEU M 262 -12.021 -40.600-129.701 1.00 0.00 H
+ATOM 9998 3HD2 LEU M 262 -11.717 -40.551-127.948 1.00 0.00 H
+ATOM 9999 N THR M 263 -11.091 -36.097-127.994 1.00 52.76 N
+ATOM 10000 CA THR M 263 -10.744 -34.682-128.004 1.00 65.13 C
+ATOM 10001 C THR M 263 -9.884 -34.355-129.221 1.00 64.19 C
+ATOM 10002 O THR M 263 -9.302 -35.237-129.854 1.00 68.38 O
+ATOM 10003 CB THR M 263 -9.993 -34.282-126.732 1.00 70.53 C
+ATOM 10004 OG1 THR M 263 -9.864 -32.858-126.685 1.00 87.76 O
+ATOM 10005 CG2 THR M 263 -8.602 -34.902-126.733 1.00 56.37 C
+ATOM 10006 H THR M 263 -10.399 -36.775-128.280 1.00 0.00 H
+ATOM 10007 HA THR M 263 -11.665 -34.100-128.053 1.00 0.00 H
+ATOM 10008 HB THR M 263 -10.545 -34.630-125.859 1.00 0.00 H
+ATOM 10009 HG1 THR M 263 -10.278 -32.474-127.462 1.00 0.00 H
+ATOM 10010 1HG2 THR M 263 -8.074 -34.613-125.824 1.00 0.00 H
+ATOM 10011 2HG2 THR M 263 -8.688 -35.988-126.773 1.00 0.00 H
+ATOM 10012 3HG2 THR M 263 -8.047 -34.550-127.602 1.00 0.00 H
+ATOM 10013 N VAL M 264 -9.805 -33.062-129.532 1.00 60.15 N
+ATOM 10014 CA VAL M 264 -8.978 -32.541-130.618 1.00 70.54 C
+ATOM 10015 C VAL M 264 -7.967 -31.574-130.016 1.00 90.19 C
+ATOM 10016 O VAL M 264 -8.350 -30.544-129.445 1.00 95.39 O
+ATOM 10017 CB VAL M 264 -9.818 -31.842-131.698 1.00 72.01 C
+ATOM 10018 CG1 VAL M 264 -8.916 -31.139-132.699 1.00 61.53 C
+ATOM 10019 CG2 VAL M 264 -10.718 -32.839-132.400 1.00 78.67 C
+ATOM 10020 H VAL M 264 -10.352 -32.419-128.978 1.00 0.00 H
+ATOM 10021 HA VAL M 264 -8.457 -33.376-131.087 1.00 0.00 H
+ATOM 10022 HB VAL M 264 -10.432 -31.074-131.227 1.00 0.00 H
+ATOM 10023 1HG1 VAL M 264 -9.527 -30.648-133.457 1.00 0.00 H
+ATOM 10024 2HG1 VAL M 264 -8.311 -30.394-132.183 1.00 0.00 H
+ATOM 10025 3HG1 VAL M 264 -8.264 -31.870-133.177 1.00 0.00 H
+ATOM 10026 1HG2 VAL M 264 -11.306 -32.326-133.161 1.00 0.00 H
+ATOM 10027 2HG2 VAL M 264 -10.109 -33.611-132.871 1.00 0.00 H
+ATOM 10028 3HG2 VAL M 264 -11.388 -33.299-131.673 1.00 0.00 H
+ATOM 10029 N GLN M 265 -6.682 -31.897-130.149 1.00 90.25 N
+ATOM 10030 CA GLN M 265 -5.611 -31.097-129.567 1.00 85.21 C
+ATOM 10031 C GLN M 265 -4.559 -30.814-130.630 1.00 93.31 C
+ATOM 10032 O GLN M 265 -4.703 -31.190-131.797 1.00 95.04 O
+ATOM 10033 CB GLN M 265 -4.965 -31.808-128.370 1.00 80.35 C
+ATOM 10034 CG GLN M 265 -5.937 -32.436-127.390 1.00 89.82 C
+ATOM 10035 CD GLN M 265 -5.243 -33.354-126.400 1.00107.67 C
+ATOM 10036 OE1 GLN M 265 -4.134 -33.825-126.649 1.00119.14 O
+ATOM 10037 NE2 GLN M 265 -5.891 -33.607-125.269 1.00107.28 N
+ATOM 10038 H GLN M 265 -6.446 -32.728-130.673 1.00 0.00 H
+ATOM 10039 HA GLN M 265 -6.034 -30.156-129.215 1.00 0.00 H
+ATOM 10040 1HB GLN M 265 -4.306 -32.599-128.729 1.00 0.00 H
+ATOM 10041 2HB GLN M 265 -4.352 -31.099-127.813 1.00 0.00 H
+ATOM 10042 1HG GLN M 265 -6.437 -31.644-126.832 1.00 0.00 H
+ATOM 10043 2HG GLN M 265 -6.670 -33.021-127.946 1.00 0.00 H
+ATOM 10044 1HE2 GLN M 265 -5.481 -34.206-124.580 1.00 0.00 H
+ATOM 10045 2HE2 GLN M 265 -6.789 -33.199-125.105 1.00 0.00 H
+ATOM 10046 N ARG M 266 -3.490 -30.139-130.216 1.00 99.93 N
+ATOM 10047 CA ARG M 266 -2.302 -30.021-131.048 1.00 91.56 C
+ATOM 10048 C ARG M 266 -1.457 -31.277-130.901 1.00 93.49 C
+ATOM 10049 O ARG M 266 -1.377 -31.863-129.818 1.00101.72 O
+ATOM 10050 CB ARG M 266 -1.482 -28.799-130.662 1.00 85.82 C
+ATOM 10051 CG ARG M 266 -2.165 -27.464-130.913 1.00 93.95 C
+ATOM 10052 CD ARG M 266 -1.281 -26.321-130.568 1.00 87.23 C
+ATOM 10053 NE ARG M 266 -1.948 -25.043-130.760 1.00 88.68 N
+ATOM 10054 CZ ARG M 266 -1.988 -24.369-131.926 1.00 0.00 C
+ATOM 10055 NH1 ARG M 266 -1.397 -24.863-132.992 1.00 0.00 N
+ATOM 10056 NH2 ARG M 266 -2.621 -23.211-131.999 1.00 0.00 N
+ATOM 10057 H ARG M 266 -3.500 -29.699-129.307 1.00 0.00 H
+ATOM 10058 HA ARG M 266 -2.616 -29.915-132.087 1.00 0.00 H
+ATOM 10059 1HB ARG M 266 -1.234 -28.848-129.602 1.00 0.00 H
+ATOM 10060 2HB ARG M 266 -0.544 -28.800-131.218 1.00 0.00 H
+ATOM 10061 1HG ARG M 266 -2.432 -27.385-131.967 1.00 0.00 H
+ATOM 10062 2HG ARG M 266 -3.067 -27.397-130.304 1.00 0.00 H
+ATOM 10063 1HD ARG M 266 -0.982 -26.396-129.523 1.00 0.00 H
+ATOM 10064 2HD ARG M 266 -0.395 -26.342-131.202 1.00 0.00 H
+ATOM 10065 HE ARG M 266 -2.414 -24.632-129.963 1.00 0.00 H
+ATOM 10066 1HH1 ARG M 266 -0.913 -25.748-132.936 1.00 0.00 H
+ATOM 10067 2HH1 ARG M 266 -1.427 -24.358-133.865 1.00 0.00 H
+ATOM 10068 1HH2 ARG M 266 -3.076 -22.832-131.179 1.00 0.00 H
+ATOM 10069 2HH2 ARG M 266 -2.651 -22.706-132.872 1.00 0.00 H
+ATOM 10070 N GLU M 267 -0.834 -31.698-132.005 1.00 97.39 N
+ATOM 10071 CA GLU M 267 -0.031 -32.917-131.984 1.00103.85 C
+ATOM 10072 C GLU M 267 1.058 -32.838-130.922 1.00103.84 C
+ATOM 10073 O GLU M 267 1.175 -33.724-130.067 1.00 97.39 O
+ATOM 10074 CB GLU M 267 0.564 -33.175-133.370 1.00114.35 C
+ATOM 10075 CG GLU M 267 -0.468 -33.142-134.492 1.00118.44 C
+ATOM 10076 CD GLU M 267 0.027 -33.788-135.774 1.00127.06 C
+ATOM 10077 OE1 GLU M 267 0.785 -34.777-135.690 1.00126.78 O
+ATOM 10078 OE2 GLU M 267 -0.352 -33.314-136.865 1.00132.38 O
+ATOM 10079 H GLU M 267 -0.913 -31.176-132.866 1.00 0.00 H
+ATOM 10080 HA GLU M 267 -0.678 -33.753-131.716 1.00 0.00 H
+ATOM 10081 1HB GLU M 267 1.327 -32.426-133.584 1.00 0.00 H
+ATOM 10082 2HB GLU M 267 1.051 -34.150-133.381 1.00 0.00 H
+ATOM 10083 1HG GLU M 267 -1.366 -33.663-134.161 1.00 0.00 H
+ATOM 10084 2HG GLU M 267 -0.736 -32.106-134.694 1.00 0.00 H
+ATOM 10085 N THR M 268 1.861 -31.777-130.954 1.00112.74 N
+ATOM 10086 CA THR M 268 2.797 -31.494-129.873 1.00123.11 C
+ATOM 10087 C THR M 268 2.527 -30.096-129.336 1.00129.45 C
+ATOM 10088 O THR M 268 1.375 -29.653-129.306 1.00135.08 O
+ATOM 10089 CB THR M 268 4.246 -31.626-130.346 1.00134.19 C
+ATOM 10090 OG1 THR M 268 4.457 -30.792-131.492 1.00144.00 O
+ATOM 10091 CG2 THR M 268 4.562 -33.071-130.704 1.00128.57 C
+ATOM 10092 H THR M 268 1.821 -31.152-131.747 1.00 0.00 H
+ATOM 10093 HA THR M 268 2.631 -32.217-129.074 1.00 0.00 H
+ATOM 10094 HB THR M 268 4.919 -31.299-129.553 1.00 0.00 H
+ATOM 10095 HG1 THR M 268 3.641 -30.335-131.709 1.00 0.00 H
+ATOM 10096 1HG2 THR M 268 5.597 -33.145-131.038 1.00 0.00 H
+ATOM 10097 2HG2 THR M 268 4.417 -33.703-129.828 1.00 0.00 H
+ATOM 10098 3HG2 THR M 268 3.899 -33.401-131.503 1.00 0.00 H
+ATOM 10099 N LEU M 269 3.572 -29.387-128.919 1.00128.75 N
+ATOM 10100 CA LEU M 269 3.428 -28.030-128.410 1.00125.19 C
+ATOM 10101 C LEU M 269 3.941 -26.985-129.388 1.00140.20 C
+ATOM 10102 O LEU M 269 3.257 -25.990-129.645 1.00140.56 O
+ATOM 10103 CB LEU M 269 4.151 -27.883-127.063 1.00124.00 C
+ATOM 10104 CG LEU M 269 3.831 -28.894-125.960 1.00115.42 C
+ATOM 10105 CD1 LEU M 269 4.697 -30.135-126.112 1.00126.70 C
+ATOM 10106 CD2 LEU M 269 4.065 -28.271-124.600 1.00100.67 C
+ATOM 10107 H LEU M 269 4.491 -29.803-128.957 1.00 0.00 H
+ATOM 10108 HA LEU M 269 2.368 -27.827-128.261 1.00 0.00 H
+ATOM 10109 1HB LEU M 269 5.224 -27.945-127.236 1.00 0.00 H
+ATOM 10110 2HB LEU M 269 3.926 -26.898-126.654 1.00 0.00 H
+ATOM 10111 HG LEU M 269 2.787 -29.200-126.038 1.00 0.00 H
+ATOM 10112 1HD1 LEU M 269 4.458 -30.845-125.320 1.00 0.00 H
+ATOM 10113 2HD1 LEU M 269 4.506 -30.596-127.081 1.00 0.00 H
+ATOM 10114 3HD1 LEU M 269 5.748 -29.856-126.043 1.00 0.00 H
+ATOM 10115 1HD2 LEU M 269 3.834 -28.999-123.822 1.00 0.00 H
+ATOM 10116 2HD2 LEU M 269 5.108 -27.967-124.514 1.00 0.00 H
+ATOM 10117 3HD2 LEU M 269 3.422 -27.399-124.484 1.00 0.00 H
+ATOM 10118 N ASP M 270 5.134 -27.192-129.950 1.00147.65 N
+ATOM 10119 CA ASP M 270 5.711 -26.250-130.900 1.00158.78 C
+ATOM 10120 C ASP M 270 5.114 -26.368-132.297 1.00162.01 C
+ATOM 10121 O ASP M 270 5.327 -25.470-133.120 1.00166.72 O
+ATOM 10122 CB ASP M 270 7.226 -26.451-130.980 1.00164.33 C
+ATOM 10123 CG ASP M 270 7.948 -26.032-129.706 1.00 0.00 C
+ATOM 10124 OD1 ASP M 270 7.361 -25.329-128.918 1.00 0.00 O
+ATOM 10125 OD2 ASP M 270 9.079 -26.418-129.534 1.00 0.00 O
+ATOM 10126 H ASP M 270 5.650 -28.026-129.709 1.00 0.00 H
+ATOM 10127 HA ASP M 270 5.503 -25.237-130.553 1.00 0.00 H
+ATOM 10128 1HB ASP M 270 7.444 -27.502-131.174 1.00 0.00 H
+ATOM 10129 2HB ASP M 270 7.627 -25.874-131.814 1.00 0.00 H
+ATOM 10130 N ALA M 271 4.382 -27.439-132.584 1.00157.49 N
+ATOM 10131 CA ALA M 271 3.795 -27.623-133.900 1.00156.89 C
+ATOM 10132 C ALA M 271 2.475 -26.868-134.010 1.00142.97 C
+ATOM 10133 O ALA M 271 1.816 -26.561-133.013 1.00136.37 O
+ATOM 10134 CB ALA M 271 3.576 -29.108-134.191 1.00159.51 C
+ATOM 10135 H ALA M 271 4.229 -28.141-131.874 1.00 0.00 H
+ATOM 10136 HA ALA M 271 4.487 -27.220-134.639 1.00 0.00 H
+ATOM 10137 1HB ALA M 271 3.136 -29.224-135.181 1.00 0.00 H
+ATOM 10138 2HB ALA M 271 4.532 -29.631-134.156 1.00 0.00 H
+ATOM 10139 3HB ALA M 271 2.905 -29.530-133.444 1.00 0.00 H
+ATOM 10140 N GLN M 272 2.090 -26.572-135.251 1.00136.24 N
+ATOM 10141 CA GLN M 272 0.875 -25.822-135.530 1.00130.23 C
+ATOM 10142 C GLN M 272 -0.243 -26.676-136.111 1.00122.31 C
+ATOM 10143 O GLN M 272 -1.319 -26.145-136.404 1.00123.17 O
+ATOM 10144 CB GLN M 272 1.178 -24.659-136.481 1.00134.82 C
+ATOM 10145 CG GLN M 272 2.098 -23.604-135.893 1.00147.43 C
+ATOM 10146 CD GLN M 272 2.446 -22.516-136.889 1.00160.38 C
+ATOM 10147 OE1 GLN M 272 2.482 -22.754-138.096 1.00159.74 O
+ATOM 10148 NE2 GLN M 272 2.703 -21.314-136.387 1.00168.47 N
+ATOM 10149 H GLN M 272 2.665 -26.881-136.022 1.00 0.00 H
+ATOM 10150 HA GLN M 272 0.495 -25.418-134.592 1.00 0.00 H
+ATOM 10151 1HB GLN M 272 1.641 -25.043-137.390 1.00 0.00 H
+ATOM 10152 2HB GLN M 272 0.246 -24.173-136.769 1.00 0.00 H
+ATOM 10153 1HG GLN M 272 1.603 -23.140-135.040 1.00 0.00 H
+ATOM 10154 2HG GLN M 272 3.024 -24.082-135.573 1.00 0.00 H
+ATOM 10155 1HE2 GLN M 272 2.939 -20.556-136.997 1.00 0.00 H
+ATOM 10156 2HE2 GLN M 272 2.661 -21.165-135.399 1.00 0.00 H
+ATOM 10157 N THR M 273 -0.025 -27.976-136.284 1.00111.06 N
+ATOM 10158 CA THR M 273 -1.041 -28.865-136.828 1.00 99.63 C
+ATOM 10159 C THR M 273 -1.813 -29.551-135.707 1.00 92.18 C
+ATOM 10160 O THR M 273 -1.288 -29.779-134.614 1.00 98.04 O
+ATOM 10161 CB THR M 273 -0.406 -29.913-137.743 1.00 98.80 C
+ATOM 10162 OG1 THR M 273 0.710 -30.517-137.077 1.00 95.73 O
+ATOM 10163 CG2 THR M 273 0.074 -29.268-139.034 1.00113.34 C
+ATOM 10164 H THR M 273 0.875 -28.356-136.029 1.00 0.00 H
+ATOM 10165 HA THR M 273 -1.742 -28.271-137.415 1.00 0.00 H
+ATOM 10166 HB THR M 273 -1.140 -30.684-137.978 1.00 0.00 H
+ATOM 10167 HG1 THR M 273 0.810 -30.128-136.204 1.00 0.00 H
+ATOM 10168 1HG2 THR M 273 0.523 -30.027-139.675 1.00 0.00 H
+ATOM 10169 2HG2 THR M 273 -0.771 -28.812-139.549 1.00 0.00 H
+ATOM 10170 3HG2 THR M 273 0.815 -28.503-138.805 1.00 0.00 H
+ATOM 10171 N PHE M 274 -3.069 -29.887-135.991 1.00 88.56 N
+ATOM 10172 CA PHE M 274 -3.975 -30.460-135.006 1.00 89.91 C
+ATOM 10173 C PHE M 274 -4.295 -31.911-135.341 1.00 86.33 C
+ATOM 10174 O PHE M 274 -4.189 -32.348-136.489 1.00 98.91 O
+ATOM 10175 CB PHE M 274 -5.275 -29.652-134.926 1.00 90.27 C
+ATOM 10176 CG PHE M 274 -5.129 -28.338-134.216 1.00 91.48 C
+ATOM 10177 CD1 PHE M 274 -4.535 -27.260-134.849 1.00 95.91 C
+ATOM 10178 CD2 PHE M 274 -5.589 -28.179-132.921 1.00 92.52 C
+ATOM 10179 CE1 PHE M 274 -4.398 -26.050-134.204 1.00 96.68 C
+ATOM 10180 CE2 PHE M 274 -5.456 -26.969-132.270 1.00 98.83 C
+ATOM 10181 CZ PHE M 274 -4.859 -25.903-132.913 1.00 99.09 C
+ATOM 10182 H PHE M 274 -3.399 -29.734-136.933 1.00 0.00 H
+ATOM 10183 HA PHE M 274 -3.489 -30.430-134.030 1.00 0.00 H
+ATOM 10184 1HB PHE M 274 -5.643 -29.456-135.932 1.00 0.00 H
+ATOM 10185 2HB PHE M 274 -6.035 -30.236-134.408 1.00 0.00 H
+ATOM 10186 HD1 PHE M 274 -4.174 -27.376-135.871 1.00 0.00 H
+ATOM 10187 HD2 PHE M 274 -6.060 -29.022-132.414 1.00 0.00 H
+ATOM 10188 HE1 PHE M 274 -3.926 -25.211-134.715 1.00 0.00 H
+ATOM 10189 HE2 PHE M 274 -5.821 -26.854-131.249 1.00 0.00 H
+ATOM 10190 HZ PHE M 274 -4.751 -24.948-132.400 1.00 0.00 H
+ATOM 10191 N HIS M 275 -4.697 -32.657-134.313 1.00 75.31 N
+ATOM 10192 CA HIS M 275 -5.103 -34.045-134.484 1.00 75.39 C
+ATOM 10193 C HIS M 275 -6.091 -34.415-133.382 1.00 73.44 C
+ATOM 10194 O HIS M 275 -6.438 -33.598-132.521 1.00 66.09 O
+ATOM 10195 CB HIS M 275 -3.888 -34.981-134.498 1.00 95.19 C
+ATOM 10196 CG HIS M 275 -3.333 -35.286-133.141 1.00106.04 C
+ATOM 10197 ND1 HIS M 275 -3.236 -34.340-132.143 1.00119.28 N
+ATOM 10198 CD2 HIS M 275 -2.831 -36.432-132.623 1.00104.84 C
+ATOM 10199 CE1 HIS M 275 -2.708 -34.893-131.065 1.00121.89 C
+ATOM 10200 NE2 HIS M 275 -2.451 -36.161-131.331 1.00118.56 N
+ATOM 10201 H HIS M 275 -4.720 -32.248-133.390 1.00 0.00 H
+ATOM 10202 HA HIS M 275 -5.621 -34.158-135.436 1.00 0.00 H
+ATOM 10203 1HB HIS M 275 -4.161 -35.925-134.970 1.00 0.00 H
+ATOM 10204 2HB HIS M 275 -3.092 -34.535-135.094 1.00 0.00 H
+ATOM 10205 HD2 HIS M 275 -2.746 -37.391-133.135 1.00 0.00 H
+ATOM 10206 HE1 HIS M 275 -2.518 -34.389-130.118 1.00 0.00 H
+ATOM 10207 HE2 HIS M 275 -2.042 -36.828-130.692 1.00 0.00 H
+ATOM 10208 N THR M 276 -6.547 -35.662-133.422 1.00 70.43 N
+ATOM 10209 CA THR M 276 -7.529 -36.185-132.485 1.00 68.97 C
+ATOM 10210 C THR M 276 -6.877 -37.221-131.580 1.00 72.36 C
+ATOM 10211 O THR M 276 -6.102 -38.065-132.044 1.00 78.77 O
+ATOM 10212 CB THR M 276 -8.716 -36.809-133.232 1.00 67.61 C
+ATOM 10213 OG1 THR M 276 -9.430 -35.788-133.937 1.00 81.67 O
+ATOM 10214 CG2 THR M 276 -9.663 -37.511-132.275 1.00 55.21 C
+ATOM 10215 H THR M 276 -6.185 -36.268-134.145 1.00 0.00 H
+ATOM 10216 HA THR M 276 -7.899 -35.360-131.875 1.00 0.00 H
+ATOM 10217 HB THR M 276 -8.349 -37.535-133.957 1.00 0.00 H
+ATOM 10218 HG1 THR M 276 -9.007 -34.939-133.785 1.00 0.00 H
+ATOM 10219 1HG2 THR M 276 -10.492 -37.942-132.835 1.00 0.00 H
+ATOM 10220 2HG2 THR M 276 -9.129 -38.302-131.750 1.00 0.00 H
+ATOM 10221 3HG2 THR M 276 -10.048 -36.793-131.553 1.00 0.00 H
+ATOM 10222 N ARG M 277 -7.180 -37.143-130.288 1.00 67.76 N
+ATOM 10223 CA ARG M 277 -6.749 -38.134-129.317 1.00 62.40 C
+ATOM 10224 C ARG M 277 -7.960 -38.738-128.621 1.00 67.19 C
+ATOM 10225 O ARG M 277 -9.010 -38.097-128.482 1.00 75.92 O
+ATOM 10226 CB ARG M 277 -5.808 -37.531-128.266 1.00 59.56 C
+ATOM 10227 CG ARG M 277 -4.391 -37.267-128.748 1.00 68.90 C
+ATOM 10228 CD ARG M 277 -3.444 -37.108-127.562 1.00 84.27 C
+ATOM 10229 NE ARG M 277 -2.916 -35.752-127.426 1.00 90.74 N
+ATOM 10230 CZ ARG M 277 -1.643 -35.422-127.618 1.00 93.02 C
+ATOM 10231 NH1 ARG M 277 -0.757 -36.349-127.956 1.00 96.41 N
+ATOM 10232 NH2 ARG M 277 -1.254 -34.164-127.469 1.00 89.48 N
+ATOM 10233 H ARG M 277 -7.734 -36.358-129.977 1.00 0.00 H
+ATOM 10234 HA ARG M 277 -6.207 -38.921-129.843 1.00 0.00 H
+ATOM 10235 1HB ARG M 277 -6.216 -36.585-127.913 1.00 0.00 H
+ATOM 10236 2HB ARG M 277 -5.744 -38.201-127.408 1.00 0.00 H
+ATOM 10237 1HG ARG M 277 -4.053 -38.103-129.361 1.00 0.00 H
+ATOM 10238 2HG ARG M 277 -4.373 -36.352-129.341 1.00 0.00 H
+ATOM 10239 1HD ARG M 277 -3.972 -37.350-126.640 1.00 0.00 H
+ATOM 10240 2HD ARG M 277 -2.596 -37.781-127.681 1.00 0.00 H
+ATOM 10241 HE ARG M 277 -3.564 -35.019-127.169 1.00 0.00 H
+ATOM 10242 1HH1 ARG M 277 -1.049 -37.310-128.068 1.00 0.00 H
+ATOM 10243 2HH1 ARG M 277 0.209 -36.095-128.101 1.00 0.00 H
+ATOM 10244 1HH2 ARG M 277 -1.926 -33.455-127.209 1.00 0.00 H
+ATOM 10245 2HH2 ARG M 277 -0.287 -33.914-127.615 1.00 0.00 H
+ATOM 10246 N ILE M 278 -7.805 -39.990-128.203 1.00 61.06 N
+ATOM 10247 CA ILE M 278 -8.725 -40.655-127.293 1.00 75.86 C
+ATOM 10248 C ILE M 278 -8.037 -40.769-125.940 1.00 77.02 C
+ATOM 10249 O ILE M 278 -6.850 -41.107-125.856 1.00 70.08 O
+ATOM 10250 CB ILE M 278 -9.162 -42.037-127.820 1.00 66.64 C
+ATOM 10251 CG1 ILE M 278 -10.113 -42.714-126.831 1.00 73.84 C
+ATOM 10252 CG2 ILE M 278 -7.961 -42.918-128.081 1.00 63.26 C
+ATOM 10253 CD1 ILE M 278 -10.729 -43.986-127.355 1.00 68.70 C
+ATOM 10254 H ILE M 278 -7.000 -40.495-128.544 1.00 0.00 H
+ATOM 10255 HA ILE M 278 -9.617 -40.038-127.192 1.00 0.00 H
+ATOM 10256 HB ILE M 278 -9.715 -41.913-128.751 1.00 0.00 H
+ATOM 10257 1HG1 ILE M 278 -9.576 -42.947-125.912 1.00 0.00 H
+ATOM 10258 2HG1 ILE M 278 -10.919 -42.027-126.572 1.00 0.00 H
+ATOM 10259 1HG2 ILE M 278 -8.294 -43.887-128.451 1.00 0.00 H
+ATOM 10260 2HG2 ILE M 278 -7.319 -42.447-128.824 1.00 0.00 H
+ATOM 10261 3HG2 ILE M 278 -7.403 -43.056-127.155 1.00 0.00 H
+ATOM 10262 1HD1 ILE M 278 -11.391 -44.408-126.599 1.00 0.00 H
+ATOM 10263 2HD1 ILE M 278 -11.301 -43.768-128.258 1.00 0.00 H
+ATOM 10264 3HD1 ILE M 278 -9.942 -44.702-127.588 1.00 0.00 H
+ATOM 10265 N ILE M 279 -8.783 -40.469-124.883 1.00 75.06 N
+ATOM 10266 CA ILE M 279 -8.255 -40.380-123.530 1.00 79.72 C
+ATOM 10267 C ILE M 279 -8.942 -41.447-122.694 1.00 75.89 C
+ATOM 10268 O ILE M 279 -10.175 -41.476-122.609 1.00 72.79 O
+ATOM 10269 CB ILE M 279 -8.482 -38.984-122.932 1.00 74.06 C
+ATOM 10270 CG1 ILE M 279 -7.781 -37.922-123.780 1.00 70.84 C
+ATOM 10271 CG2 ILE M 279 -8.010 -38.945-121.502 1.00 75.80 C
+ATOM 10272 CD1 ILE M 279 -7.910 -36.519-123.232 1.00 73.31 C
+ATOM 10273 H ILE M 279 -9.766 -40.296-125.040 1.00 0.00 H
+ATOM 10274 HA ILE M 279 -7.182 -40.565-123.565 1.00 0.00 H
+ATOM 10275 HB ILE M 279 -9.544 -38.744-122.962 1.00 0.00 H
+ATOM 10276 1HG1 ILE M 279 -6.721 -38.161-123.859 1.00 0.00 H
+ATOM 10277 2HG1 ILE M 279 -8.193 -37.932-124.789 1.00 0.00 H
+ATOM 10278 1HG2 ILE M 279 -8.176 -37.950-121.091 1.00 0.00 H
+ATOM 10279 2HG2 ILE M 279 -8.565 -39.677-120.916 1.00 0.00 H
+ATOM 10280 3HG2 ILE M 279 -6.946 -39.180-121.463 1.00 0.00 H
+ATOM 10281 1HD1 ILE M 279 -7.388 -35.822-123.888 1.00 0.00 H
+ATOM 10282 2HD1 ILE M 279 -8.964 -36.245-123.178 1.00 0.00 H
+ATOM 10283 3HD1 ILE M 279 -7.472 -36.476-122.236 1.00 0.00 H
+ATOM 10284 N ARG M 280 -8.155 -42.325-122.083 1.00 57.41 N
+ATOM 10285 CA ARG M 280 -8.686 -43.397-121.254 1.00 64.92 C
+ATOM 10286 C ARG M 280 -8.164 -43.238-119.836 1.00 75.14 C
+ATOM 10287 O ARG M 280 -6.962 -43.027-119.634 1.00 91.60 O
+ATOM 10288 CB ARG M 280 -8.301 -44.771-121.807 1.00 68.50 C
+ATOM 10289 CG ARG M 280 -8.709 -45.938-120.918 1.00 75.64 C
+ATOM 10290 CD ARG M 280 -8.188 -47.254-121.471 1.00 77.33 C
+ATOM 10291 NE ARG M 280 -7.400 -47.987-120.483 1.00 80.12 N
+ATOM 10292 CZ ARG M 280 -6.724 -49.100-120.746 1.00 98.89 C
+ATOM 10293 NH1 ARG M 280 -6.746 -49.618-121.965 1.00106.58 N
+ATOM 10294 NH2 ARG M 280 -6.028 -49.700-119.790 1.00114.98 N
+ATOM 10295 H ARG M 280 -7.155 -42.243-122.200 1.00 0.00 H
+ATOM 10296 HA ARG M 280 -9.774 -43.324-121.249 1.00 0.00 H
+ATOM 10297 1HB ARG M 280 -8.764 -44.913-122.782 1.00 0.00 H
+ATOM 10298 2HB ARG M 280 -7.221 -44.817-121.948 1.00 0.00 H
+ATOM 10299 1HG ARG M 280 -8.300 -45.794-119.918 1.00 0.00 H
+ATOM 10300 2HG ARG M 280 -9.797 -45.990-120.862 1.00 0.00 H
+ATOM 10301 1HD ARG M 280 -9.028 -47.881-121.770 1.00 0.00 H
+ATOM 10302 2HD ARG M 280 -7.555 -47.060-122.336 1.00 0.00 H
+ATOM 10303 HE ARG M 280 -7.370 -47.621-119.541 1.00 0.00 H
+ATOM 10304 1HH1 ARG M 280 -7.277 -49.167-122.696 1.00 0.00 H
+ATOM 10305 2HH1 ARG M 280 -6.232 -50.464-122.163 1.00 0.00 H
+ATOM 10306 1HH2 ARG M 280 -6.011 -49.311-118.857 1.00 0.00 H
+ATOM 10307 2HH2 ARG M 280 -5.516 -50.545-119.994 1.00 0.00 H
+ATOM 10308 N PHE M 281 -9.063 -43.331-118.858 1.00 76.12 N
+ATOM 10309 CA PHE M 281 -8.638 -43.331-117.468 1.00 71.59 C
+ATOM 10310 C PHE M 281 -9.634 -44.109-116.619 1.00 68.74 C
+ATOM 10311 O PHE M 281 -10.746 -44.429-117.051 1.00 61.82 O
+ATOM 10312 CB PHE M 281 -8.439 -41.904-116.935 1.00 80.44 C
+ATOM 10313 CG PHE M 281 -9.665 -41.038-117.004 1.00 76.87 C
+ATOM 10314 CD1 PHE M 281 -10.603 -41.054-115.985 1.00 79.45 C
+ATOM 10315 CD2 PHE M 281 -9.862 -40.181-118.073 1.00 73.48 C
+ATOM 10316 CE1 PHE M 281 -11.724 -40.248-116.044 1.00 79.73 C
+ATOM 10317 CE2 PHE M 281 -10.981 -39.373-118.137 1.00 74.91 C
+ATOM 10318 CZ PHE M 281 -11.911 -39.405-117.122 1.00 77.60 C
+ATOM 10319 H PHE M 281 -10.048 -43.402-119.071 1.00 0.00 H
+ATOM 10320 HA PHE M 281 -7.683 -43.854-117.398 1.00 0.00 H
+ATOM 10321 1HB PHE M 281 -8.118 -41.946-115.895 1.00 0.00 H
+ATOM 10322 2HB PHE M 281 -7.650 -41.411-117.501 1.00 0.00 H
+ATOM 10323 HD1 PHE M 281 -10.448 -41.712-115.129 1.00 0.00 H
+ATOM 10324 HD2 PHE M 281 -9.125 -40.156-118.877 1.00 0.00 H
+ATOM 10325 HE1 PHE M 281 -12.459 -40.278-115.240 1.00 0.00 H
+ATOM 10326 HE2 PHE M 281 -11.129 -38.711-118.990 1.00 0.00 H
+ATOM 10327 HZ PHE M 281 -12.793 -38.768-117.170 1.00 0.00 H
+ATOM 10328 N CYS M 282 -9.202 -44.419-115.401 1.00 85.64 N
+ATOM 10329 CA CYS M 282 -9.981 -45.131-114.402 1.00 98.76 C
+ATOM 10330 C CYS M 282 -10.423 -44.158-113.318 1.00 94.99 C
+ATOM 10331 O CYS M 282 -9.839 -43.086-113.144 1.00104.15 O
+ATOM 10332 CB CYS M 282 -9.154 -46.265-113.788 1.00123.18 C
+ATOM 10333 SG CYS M 282 -10.062 -47.764-113.373 1.00151.39 S
+ATOM 10334 H CYS M 282 -8.261 -44.129-115.176 1.00 0.00 H
+ATOM 10335 HA CYS M 282 -10.857 -45.561-114.888 1.00 0.00 H
+ATOM 10336 1HB CYS M 282 -8.361 -46.552-114.479 1.00 0.00 H
+ATOM 10337 2HB CYS M 282 -8.679 -45.914-112.872 1.00 0.00 H
+ATOM 10338 N SER M 283 -11.460 -44.540-112.575 1.00 97.93 N
+ATOM 10339 CA SER M 283 -11.979 -43.691-111.500 1.00104.30 C
+ATOM 10340 C SER M 283 -12.311 -44.571-110.299 1.00101.26 C
+ATOM 10341 O SER M 283 -13.342 -45.250-110.286 1.00102.32 O
+ATOM 10342 CB SER M 283 -13.210 -42.933-111.956 1.00107.01 C
+ATOM 10343 OG SER M 283 -13.719 -42.134-110.923 1.00 0.00 O
+ATOM 10344 H SER M 283 -11.900 -45.432-112.753 1.00 0.00 H
+ATOM 10345 HA SER M 283 -11.200 -42.984-111.211 1.00 0.00 H
+ATOM 10346 1HB SER M 283 -12.957 -42.308-112.812 1.00 0.00 H
+ATOM 10347 2HB SER M 283 -13.973 -43.640-112.281 1.00 0.00 H
+ATOM 10348 HG SER M 283 -13.406 -41.243-111.100 1.00 0.00 H
+ATOM 10349 N ILE M 284 -11.439 -44.554-109.296 1.00102.33 N
+ATOM 10350 CA ILE M 284 -11.630 -45.310-108.064 1.00110.48 C
+ATOM 10351 C ILE M 284 -11.776 -44.310-106.926 1.00120.18 C
+ATOM 10352 O ILE M 284 -10.853 -43.529-106.660 1.00119.32 O
+ATOM 10353 CB ILE M 284 -10.456 -46.267-107.789 1.00 99.52 C
+ATOM 10354 CG1 ILE M 284 -10.304 -47.270-108.936 1.00 0.00 C
+ATOM 10355 CG2 ILE M 284 -10.658 -46.991-106.467 1.00 0.00 C
+ATOM 10356 CD1 ILE M 284 -9.052 -48.112-108.850 1.00 0.00 C
+ATOM 10357 H ILE M 284 -10.609 -43.988-109.402 1.00 0.00 H
+ATOM 10358 HA ILE M 284 -12.544 -45.895-108.156 1.00 0.00 H
+ATOM 10359 HB ILE M 284 -9.527 -45.699-107.743 1.00 0.00 H
+ATOM 10360 1HG1 ILE M 284 -11.165 -47.938-108.950 1.00 0.00 H
+ATOM 10361 2HG1 ILE M 284 -10.291 -46.736-109.887 1.00 0.00 H
+ATOM 10362 1HG2 ILE M 284 -9.819 -47.664-106.289 1.00 0.00 H
+ATOM 10363 2HG2 ILE M 284 -10.717 -46.264-105.659 1.00 0.00 H
+ATOM 10364 3HG2 ILE M 284 -11.583 -47.567-106.506 1.00 0.00 H
+ATOM 10365 1HD1 ILE M 284 -9.015 -48.797-109.697 1.00 0.00 H
+ATOM 10366 2HD1 ILE M 284 -8.175 -47.463-108.870 1.00 0.00 H
+ATOM 10367 3HD1 ILE M 284 -9.060 -48.682-107.922 1.00 0.00 H
+ATOM 10368 N ASN M 285 -12.932 -44.335-106.261 1.00121.62 N
+ATOM 10369 CA ASN M 285 -13.256 -43.396-105.186 1.00120.02 C
+ATOM 10370 C ASN M 285 -13.082 -41.952-105.655 1.00113.12 C
+ATOM 10371 O ASN M 285 -12.475 -41.117-104.981 1.00110.32 O
+ATOM 10372 CB ASN M 285 -12.403 -43.668-103.960 1.00105.93 C
+ATOM 10373 CG ASN M 285 -12.941 -43.003-102.723 1.00 0.00 C
+ATOM 10374 OD1 ASN M 285 -14.157 -42.848-102.566 1.00 0.00 O
+ATOM 10375 ND2 ASN M 285 -12.058 -42.607-101.843 1.00 0.00 N
+ATOM 10376 H ASN M 285 -13.608 -45.039-106.520 1.00 0.00 H
+ATOM 10377 HA ASN M 285 -14.310 -43.515-104.928 1.00 0.00 H
+ATOM 10378 1HB ASN M 285 -12.349 -44.743-103.786 1.00 0.00 H
+ATOM 10379 2HB ASN M 285 -11.388 -43.313-104.137 1.00 0.00 H
+ATOM 10380 1HD2 ASN M 285 -12.358 -42.158-101.000 1.00 0.00 H
+ATOM 10381 2HD2 ASN M 285 -11.083 -42.753-102.012 1.00 0.00 H
+ATOM 10382 N SER M 286 -13.624 -41.668-106.842 1.00111.27 N
+ATOM 10383 CA SER M 286 -13.591 -40.342-107.461 1.00106.88 C
+ATOM 10384 C SER M 286 -12.152 -39.827-107.580 1.00 98.86 C
+ATOM 10385 O SER M 286 -11.732 -38.879-106.914 1.00100.83 O
+ATOM 10386 CB SER M 286 -14.470 -39.355-106.685 1.00113.21 C
+ATOM 10387 OG SER M 286 -14.369 -38.052-107.232 1.00119.59 O
+ATOM 10388 H SER M 286 -14.080 -42.427-107.328 1.00 0.00 H
+ATOM 10389 HA SER M 286 -13.979 -40.425-108.477 1.00 0.00 H
+ATOM 10390 1HB SER M 286 -15.507 -39.688-106.717 1.00 0.00 H
+ATOM 10391 2HB SER M 286 -14.164 -39.340-105.640 1.00 0.00 H
+ATOM 10392 HG SER M 286 -13.759 -38.121-107.970 1.00 0.00 H
+ATOM 10393 N GLY M 287 -11.404 -40.489-108.464 1.00 95.08 N
+ATOM 10394 CA GLY M 287 -10.034 -40.107-108.728 1.00 79.76 C
+ATOM 10395 C GLY M 287 -9.705 -40.291-110.195 1.00 95.81 C
+ATOM 10396 O GLY M 287 -10.464 -40.900-110.952 1.00103.83 O
+ATOM 10397 H GLY M 287 -11.800 -41.274-108.961 1.00 0.00 H
+ATOM 10398 1HA GLY M 287 -9.884 -39.067-108.439 1.00 0.00 H
+ATOM 10399 2HA GLY M 287 -9.364 -40.710-108.116 1.00 0.00 H
+ATOM 10400 N LEU M 288 -8.557 -39.747-110.585 1.00 91.88 N
+ATOM 10401 CA LEU M 288 -8.056 -39.847-111.955 1.00 84.50 C
+ATOM 10402 C LEU M 288 -6.812 -40.730-111.940 1.00 81.24 C
+ATOM 10403 O LEU M 288 -5.713 -40.264-111.624 1.00 79.44 O
+ATOM 10404 CB LEU M 288 -7.758 -38.465-112.526 1.00 78.27 C
+ATOM 10405 CG LEU M 288 -8.704 -37.988-113.627 1.00 79.40 C
+ATOM 10406 CD1 LEU M 288 -10.155 -38.264-113.269 1.00 70.93 C
+ATOM 10407 CD2 LEU M 288 -8.483 -36.512-113.926 1.00 90.22 C
+ATOM 10408 H LEU M 288 -8.014 -39.244-109.898 1.00 0.00 H
+ATOM 10409 HA LEU M 288 -8.823 -40.316-112.570 1.00 0.00 H
+ATOM 10410 1HB LEU M 288 -7.798 -37.739-111.716 1.00 0.00 H
+ATOM 10411 2HB LEU M 288 -6.747 -38.468-112.934 1.00 0.00 H
+ATOM 10412 HG LEU M 288 -8.523 -38.562-114.536 1.00 0.00 H
+ATOM 10413 1HD1 LEU M 288 -10.801 -37.913-114.073 1.00 0.00 H
+ATOM 10414 2HD1 LEU M 288 -10.298 -39.336-113.131 1.00 0.00 H
+ATOM 10415 3HD1 LEU M 288 -10.408 -37.742-112.347 1.00 0.00 H
+ATOM 10416 1HD2 LEU M 288 -9.167 -36.194-114.714 1.00 0.00 H
+ATOM 10417 2HD2 LEU M 288 -8.669 -35.926-113.025 1.00 0.00 H
+ATOM 10418 3HD2 LEU M 288 -7.455 -36.357-114.254 1.00 0.00 H
+ATOM 10419 N HIS M 289 -6.988 -42.001-112.290 1.00 74.60 N
+ATOM 10420 CA HIS M 289 -5.917 -42.982-112.228 1.00 90.39 C
+ATOM 10421 C HIS M 289 -5.703 -43.617-113.593 1.00100.57 C
+ATOM 10422 O HIS M 289 -6.650 -43.807-114.362 1.00 98.55 O
+ATOM 10423 CB HIS M 289 -6.228 -44.066-111.196 1.00 93.37 C
+ATOM 10424 CG HIS M 289 -6.772 -43.527-109.913 1.00 94.66 C
+ATOM 10425 ND1 HIS M 289 -5.986 -42.868-108.991 1.00106.07 N
+ATOM 10426 CD2 HIS M 289 -8.024 -43.545-109.399 1.00 86.92 C
+ATOM 10427 CE1 HIS M 289 -6.732 -42.502-107.964 1.00106.57 C
+ATOM 10428 NE2 HIS M 289 -7.972 -42.901-108.186 1.00103.88 N
+ATOM 10429 H HIS M 289 -7.902 -42.290-112.610 1.00 0.00 H
+ATOM 10430 HA HIS M 289 -4.991 -42.491-111.930 1.00 0.00 H
+ATOM 10431 1HB HIS M 289 -6.955 -44.766-111.611 1.00 0.00 H
+ATOM 10432 2HB HIS M 289 -5.321 -44.629-110.975 1.00 0.00 H
+ATOM 10433 HD2 HIS M 289 -8.908 -43.987-109.859 1.00 0.00 H
+ATOM 10434 HE1 HIS M 289 -6.384 -41.962-107.084 1.00 0.00 H
+ATOM 10435 HE2 HIS M 289 -8.758 -42.758-107.568 1.00 0.00 H
+ATOM 10436 N SER M 290 -4.441 -43.949-113.878 1.00100.80 N
+ATOM 10437 CA SER M 290 -4.054 -44.578-115.140 1.00 95.27 C
+ATOM 10438 C SER M 290 -4.508 -43.735-116.330 1.00 91.06 C
+ATOM 10439 O SER M 290 -5.014 -44.247-117.331 1.00 69.74 O
+ATOM 10440 CB SER M 290 -4.594 -46.006-115.226 1.00 91.44 C
+ATOM 10441 OG SER M 290 -4.141 -46.767-114.119 1.00 92.50 O
+ATOM 10442 H SER M 290 -3.730 -43.754-113.187 1.00 0.00 H
+ATOM 10443 HA SER M 290 -2.965 -44.618-115.187 1.00 0.00 H
+ATOM 10444 1HB SER M 290 -5.683 -45.983-115.243 1.00 0.00 H
+ATOM 10445 2HB SER M 290 -4.262 -46.465-116.156 1.00 0.00 H
+ATOM 10446 HG SER M 290 -3.601 -46.173-113.593 1.00 0.00 H
+ATOM 10447 N TYR M 291 -4.331 -42.423-116.207 1.00 86.98 N
+ATOM 10448 CA TYR M 291 -4.699 -41.502-117.270 1.00 74.60 C
+ATOM 10449 C TYR M 291 -3.735 -41.648-118.438 1.00 75.63 C
+ATOM 10450 O TYR M 291 -2.515 -41.577-118.260 1.00 89.00 O
+ATOM 10451 CB TYR M 291 -4.683 -40.071-116.739 1.00 69.96 C
+ATOM 10452 CG TYR M 291 -5.078 -39.011-117.739 1.00 70.34 C
+ATOM 10453 CD1 TYR M 291 -6.376 -38.525-117.786 1.00 71.16 C
+ATOM 10454 CD2 TYR M 291 -4.151 -38.486-118.631 1.00 68.64 C
+ATOM 10455 CE1 TYR M 291 -6.739 -37.545-118.688 1.00 72.67 C
+ATOM 10456 CE2 TYR M 291 -4.508 -37.514-119.543 1.00 70.52 C
+ATOM 10457 CZ TYR M 291 -5.801 -37.045-119.566 1.00 76.27 C
+ATOM 10458 OH TYR M 291 -6.155 -36.074-120.473 1.00 91.96 O
+ATOM 10459 H TYR M 291 -3.931 -42.056-115.355 1.00 0.00 H
+ATOM 10460 HA TYR M 291 -5.708 -41.746-117.605 1.00 0.00 H
+ATOM 10461 1HB TYR M 291 -5.363 -39.990-115.890 1.00 0.00 H
+ATOM 10462 2HB TYR M 291 -3.683 -39.827-116.381 1.00 0.00 H
+ATOM 10463 HD1 TYR M 291 -7.130 -38.917-117.103 1.00 0.00 H
+ATOM 10464 HD2 TYR M 291 -3.121 -38.842-118.619 1.00 0.00 H
+ATOM 10465 HE1 TYR M 291 -7.764 -37.177-118.709 1.00 0.00 H
+ATOM 10466 HE2 TYR M 291 -3.767 -37.123-120.241 1.00 0.00 H
+ATOM 10467 HH TYR M 291 -5.391 -35.841-121.005 1.00 0.00 H
+ATOM 10468 N MET M 292 -4.281 -41.855-119.635 1.00 80.76 N
+ATOM 10469 CA MET M 292 -3.477 -41.998-120.841 1.00 75.77 C
+ATOM 10470 C MET M 292 -4.170 -41.314-122.011 1.00 87.10 C
+ATOM 10471 O MET M 292 -5.395 -41.395-122.154 1.00 87.90 O
+ATOM 10472 CB MET M 292 -3.227 -43.474-121.185 1.00 68.73 C
+ATOM 10473 CG MET M 292 -2.478 -44.254-120.118 1.00 92.68 C
+ATOM 10474 SD MET M 292 -2.135 -45.961-120.590 1.00106.44 S
+ATOM 10475 CE MET M 292 -1.307 -46.568-119.120 1.00113.68 C
+ATOM 10476 H MET M 292 -5.287 -41.914-119.704 1.00 0.00 H
+ATOM 10477 HA MET M 292 -2.511 -41.523-120.671 1.00 0.00 H
+ATOM 10478 1HB MET M 292 -4.179 -43.974-121.355 1.00 0.00 H
+ATOM 10479 2HB MET M 292 -2.653 -43.540-122.110 1.00 0.00 H
+ATOM 10480 1HG MET M 292 -1.528 -43.763-119.908 1.00 0.00 H
+ATOM 10481 2HG MET M 292 -3.064 -44.269-119.199 1.00 0.00 H
+ATOM 10482 1HE MET M 292 -1.033 -47.614-119.262 1.00 0.00 H
+ATOM 10483 2HE MET M 292 -0.407 -45.978-118.939 1.00 0.00 H
+ATOM 10484 3HE MET M 292 -1.976 -46.481-118.263 1.00 0.00 H
+ATOM 10485 N GLU M 293 -3.379 -40.642-122.843 1.00 86.98 N
+ATOM 10486 CA GLU M 293 -3.846 -40.057-124.092 1.00 77.80 C
+ATOM 10487 C GLU M 293 -3.175 -40.775-125.255 1.00 85.91 C
+ATOM 10488 O GLU M 293 -1.956 -40.970-125.246 1.00109.49 O
+ATOM 10489 CB GLU M 293 -3.542 -38.559-124.154 1.00 81.25 C
+ATOM 10490 CG GLU M 293 -4.265 -37.720-123.116 1.00 93.80 C
+ATOM 10491 CD GLU M 293 -4.150 -36.232-123.395 1.00104.19 C
+ATOM 10492 OE1 GLU M 293 -3.434 -35.861-124.351 1.00104.96 O
+ATOM 10493 OE2 GLU M 293 -4.783 -35.436-122.666 1.00106.98 O
+ATOM 10494 H GLU M 293 -2.408 -40.539-122.584 1.00 0.00 H
+ATOM 10495 HA GLU M 293 -4.927 -40.188-124.153 1.00 0.00 H
+ATOM 10496 1HB GLU M 293 -2.472 -38.399-124.022 1.00 0.00 H
+ATOM 10497 2HB GLU M 293 -3.812 -38.173-125.137 1.00 0.00 H
+ATOM 10498 1HG GLU M 293 -5.318 -38.001-123.106 1.00 0.00 H
+ATOM 10499 2HG GLU M 293 -3.849 -37.939-122.133 1.00 0.00 H
+ATOM 10500 N MET M 294 -3.968 -41.160-126.252 1.00 86.61 N
+ATOM 10501 CA MET M 294 -3.464 -41.885-127.409 1.00 85.99 C
+ATOM 10502 C MET M 294 -4.029 -41.260-128.678 1.00 74.75 C
+ATOM 10503 O MET M 294 -5.249 -41.072-128.781 1.00 66.27 O
+ATOM 10504 CB MET M 294 -3.847 -43.365-127.327 1.00 93.98 C
+ATOM 10505 CG MET M 294 -3.463 -44.178-128.541 1.00100.45 C
+ATOM 10506 SD MET M 294 -3.990 -45.886-128.357 1.00110.31 S
+ATOM 10507 CE MET M 294 -5.767 -45.692-128.348 1.00 89.39 C
+ATOM 10508 H MET M 294 -4.952 -40.940-126.200 1.00 0.00 H
+ATOM 10509 HA MET M 294 -2.377 -41.808-127.419 1.00 0.00 H
+ATOM 10510 1HB MET M 294 -3.370 -43.816-126.458 1.00 0.00 H
+ATOM 10511 2HB MET M 294 -4.926 -43.455-127.192 1.00 0.00 H
+ATOM 10512 1HG MET M 294 -3.928 -43.749-129.428 1.00 0.00 H
+ATOM 10513 2HG MET M 294 -2.382 -44.145-128.674 1.00 0.00 H
+ATOM 10514 1HE MET M 294 -6.239 -46.669-128.240 1.00 0.00 H
+ATOM 10515 2HE MET M 294 -6.059 -45.052-127.514 1.00 0.00 H
+ATOM 10516 3HE MET M 294 -6.088 -45.235-129.285 1.00 0.00 H
+ATOM 10517 N PRO M 295 -3.194 -40.931-129.659 1.00 84.19 N
+ATOM 10518 CA PRO M 295 -3.717 -40.325-130.892 1.00 83.64 C
+ATOM 10519 C PRO M 295 -4.431 -41.339-131.780 1.00 79.67 C
+ATOM 10520 O PRO M 295 -4.019 -42.497-131.900 1.00 99.44 O
+ATOM 10521 CB PRO M 295 -2.461 -39.766-131.571 1.00 84.82 C
+ATOM 10522 CG PRO M 295 -1.337 -40.593-131.028 1.00 88.60 C
+ATOM 10523 CD PRO M 295 -1.722 -40.942-129.619 1.00 86.79 C
+ATOM 10524 HA PRO M 295 -4.413 -39.515-130.630 1.00 0.00 H
+ATOM 10525 1HB PRO M 295 -2.556 -39.847-132.664 1.00 0.00 H
+ATOM 10526 2HB PRO M 295 -2.351 -38.697-131.337 1.00 0.00 H
+ATOM 10527 1HG PRO M 295 -1.193 -41.491-131.647 1.00 0.00 H
+ATOM 10528 2HG PRO M 295 -0.395 -40.026-131.066 1.00 0.00 H
+ATOM 10529 1HD PRO M 295 -1.331 -41.939-129.368 1.00 0.00 H
+ATOM 10530 2HD PRO M 295 -1.322 -40.183-128.930 1.00 0.00 H
+ATOM 10531 N LEU M 296 -5.520 -40.887-132.400 1.00 73.51 N
+ATOM 10532 CA LEU M 296 -6.277 -41.669-133.369 1.00 69.25 C
+ATOM 10533 C LEU M 296 -6.056 -41.111-134.767 1.00 78.33 C
+ATOM 10534 O LEU M 296 -5.956 -39.894-134.950 1.00 83.85 O
+ATOM 10535 CB LEU M 296 -7.776 -41.657-133.056 1.00 64.03 C
+ATOM 10536 CG LEU M 296 -8.266 -42.430-131.834 1.00 65.17 C
+ATOM 10537 CD1 LEU M 296 -9.790 -42.461-131.807 1.00 62.79 C
+ATOM 10538 CD2 LEU M 296 -7.697 -43.837-131.831 1.00 71.52 C
+ATOM 10539 H LEU M 296 -5.826 -39.951-132.177 1.00 0.00 H
+ATOM 10540 HA LEU M 296 -5.931 -42.701-133.326 1.00 0.00 H
+ATOM 10541 1HB LEU M 296 -8.093 -40.625-132.913 1.00 0.00 H
+ATOM 10542 2HB LEU M 296 -8.313 -42.065-133.912 1.00 0.00 H
+ATOM 10543 HG LEU M 296 -7.946 -41.917-130.927 1.00 0.00 H
+ATOM 10544 1HD1 LEU M 296 -10.127 -43.015-130.931 1.00 0.00 H
+ATOM 10545 2HD1 LEU M 296 -10.174 -41.442-131.761 1.00 0.00 H
+ATOM 10546 3HD1 LEU M 296 -10.160 -42.948-132.708 1.00 0.00 H
+ATOM 10547 1HD2 LEU M 296 -8.056 -44.373-130.952 1.00 0.00 H
+ATOM 10548 2HD2 LEU M 296 -8.017 -44.361-132.732 1.00 0.00 H
+ATOM 10549 3HD2 LEU M 296 -6.608 -43.789-131.807 1.00 0.00 H
+ATOM 10550 N GLU M 297 -5.991 -42.000-135.755 1.00 95.69 N
+ATOM 10551 CA GLU M 297 -5.796 -41.589-137.140 1.00 95.26 C
+ATOM 10552 C GLU M 297 -6.751 -42.358-138.040 1.00 87.11 C
+ATOM 10553 O GLU M 297 -6.782 -43.593-138.014 1.00 91.33 O
+ATOM 10554 CB GLU M 297 -4.349 -41.824-137.580 1.00 90.70 C
+ATOM 10555 CG GLU M 297 -3.321 -40.988-136.832 1.00 0.00 C
+ATOM 10556 CD GLU M 297 -3.356 -39.535-137.217 1.00 0.00 C
+ATOM 10557 OE1 GLU M 297 -3.386 -39.252-138.391 1.00 0.00 O
+ATOM 10558 OE2 GLU M 297 -3.352 -38.708-136.337 1.00 0.00 O
+ATOM 10559 H GLU M 297 -6.079 -42.983-135.541 1.00 0.00 H
+ATOM 10560 HA GLU M 297 -6.019 -40.524-137.220 1.00 0.00 H
+ATOM 10561 1HB GLU M 297 -4.093 -42.874-137.440 1.00 0.00 H
+ATOM 10562 2HB GLU M 297 -4.252 -41.602-138.643 1.00 0.00 H
+ATOM 10563 1HG GLU M 297 -3.508 -41.073-135.762 1.00 0.00 H
+ATOM 10564 2HG GLU M 297 -2.328 -41.388-137.032 1.00 0.00 H
+ATOM 10565 N CYS M 298 -7.531 -41.621-138.827 1.00 87.00 N
+ATOM 10566 CA CYS M 298 -8.468 -42.187-139.793 1.00 87.37 C
+ATOM 10567 C CYS M 298 -7.980 -41.819-141.190 1.00 89.34 C
+ATOM 10568 O CYS M 298 -8.091 -40.660-141.608 1.00 90.43 O
+ATOM 10569 CB CYS M 298 -9.882 -41.669-139.535 1.00 85.99 C
+ATOM 10570 SG CYS M 298 -11.187 -42.375-140.572 1.00101.76 S
+ATOM 10571 H CYS M 298 -7.460 -40.617-138.740 1.00 0.00 H
+ATOM 10572 HA CYS M 298 -8.469 -43.271-139.680 1.00 0.00 H
+ATOM 10573 1HB CYS M 298 -10.158 -41.864-138.498 1.00 0.00 H
+ATOM 10574 2HB CYS M 298 -9.907 -40.589-139.682 1.00 0.00 H
+ATOM 10575 N ILE M 299 -7.441 -42.800-141.910 1.00 85.46 N
+ATOM 10576 CA ILE M 299 -6.779 -42.546-143.181 1.00 96.62 C
+ATOM 10577 C ILE M 299 -7.650 -43.041-144.328 1.00102.28 C
+ATOM 10578 O ILE M 299 -8.502 -43.923-144.174 1.00 88.36 O
+ATOM 10579 CB ILE M 299 -5.401 -43.230-143.238 1.00100.56 C
+ATOM 10580 CG1 ILE M 299 -5.553 -44.748-143.115 1.00 92.90 C
+ATOM 10581 CG2 ILE M 299 -4.494 -42.692-142.142 1.00 99.25 C
+ATOM 10582 CD1 ILE M 299 -4.277 -45.513-143.383 1.00 0.00 C
+ATOM 10583 H ILE M 299 -7.494 -43.747-141.563 1.00 0.00 H
+ATOM 10584 HA ILE M 299 -6.650 -41.470-143.295 1.00 0.00 H
+ATOM 10585 HB ILE M 299 -4.939 -43.037-144.206 1.00 0.00 H
+ATOM 10586 1HG1 ILE M 299 -5.897 -44.999-142.112 1.00 0.00 H
+ATOM 10587 2HG1 ILE M 299 -6.311 -45.096-143.816 1.00 0.00 H
+ATOM 10588 1HG2 ILE M 299 -3.525 -43.186-142.196 1.00 0.00 H
+ATOM 10589 2HG2 ILE M 299 -4.362 -41.619-142.274 1.00 0.00 H
+ATOM 10590 3HG2 ILE M 299 -4.946 -42.885-141.169 1.00 0.00 H
+ATOM 10591 1HD1 ILE M 299 -4.464 -46.582-143.277 1.00 0.00 H
+ATOM 10592 2HD1 ILE M 299 -3.933 -45.304-144.396 1.00 0.00 H
+ATOM 10593 3HD1 ILE M 299 -3.513 -45.207-142.670 1.00 0.00 H
+ATOM 10594 N LEU M 300 -7.416 -42.456-145.500 1.00105.65 N
+ATOM 10595 CA LEU M 300 -8.016 -42.900-146.753 1.00 99.72 C
+ATOM 10596 C LEU M 300 -6.876 -43.252-147.697 1.00106.29 C
+ATOM 10597 O LEU M 300 -6.211 -42.359-148.232 1.00104.22 O
+ATOM 10598 CB LEU M 300 -8.916 -41.823-147.352 1.00 98.52 C
+ATOM 10599 CG LEU M 300 -9.548 -42.193-148.695 1.00 99.97 C
+ATOM 10600 CD1 LEU M 300 -10.441 -43.418-148.539 1.00 84.08 C
+ATOM 10601 CD2 LEU M 300 -10.320 -41.015-149.272 1.00105.79 C
+ATOM 10602 H LEU M 300 -6.789 -41.665-145.508 1.00 0.00 H
+ATOM 10603 HA LEU M 300 -8.626 -43.780-146.551 1.00 0.00 H
+ATOM 10604 1HB LEU M 300 -9.717 -41.608-146.646 1.00 0.00 H
+ATOM 10605 2HB LEU M 300 -8.328 -40.916-147.490 1.00 0.00 H
+ATOM 10606 HG LEU M 300 -8.766 -42.479-149.399 1.00 0.00 H
+ATOM 10607 1HD1 LEU M 300 -10.884 -43.670-149.502 1.00 0.00 H
+ATOM 10608 2HD1 LEU M 300 -9.846 -44.259-148.183 1.00 0.00 H
+ATOM 10609 3HD1 LEU M 300 -11.232 -43.202-147.822 1.00 0.00 H
+ATOM 10610 1HD2 LEU M 300 -10.760 -41.301-150.228 1.00 0.00 H
+ATOM 10611 2HD2 LEU M 300 -11.111 -40.725-148.580 1.00 0.00 H
+ATOM 10612 3HD2 LEU M 300 -9.643 -40.174-149.422 1.00 0.00 H
+ATOM 10613 N THR M 301 -6.654 -44.552-147.900 1.00118.68 N
+ATOM 10614 CA THR M 301 -5.511 -45.023-148.674 1.00132.16 C
+ATOM 10615 C THR M 301 -5.601 -44.684-150.158 1.00132.58 C
+ATOM 10616 O THR M 301 -4.630 -44.921-150.884 1.00131.65 O
+ATOM 10617 CB THR M 301 -5.352 -46.536-148.493 1.00130.66 C
+ATOM 10618 OG1 THR M 301 -6.621 -47.179-148.672 1.00126.99 O
+ATOM 10619 CG2 THR M 301 -4.819 -46.855-147.103 1.00120.03 C
+ATOM 10620 H THR M 301 -7.294 -45.227-147.507 1.00 0.00 H
+ATOM 10621 HA THR M 301 -4.614 -44.525-148.305 1.00 0.00 H
+ATOM 10622 HB THR M 301 -4.657 -46.921-149.239 1.00 0.00 H
+ATOM 10623 HG1 THR M 301 -7.290 -46.518-148.866 1.00 0.00 H
+ATOM 10624 1HG2 THR M 301 -4.712 -47.934-146.993 1.00 0.00 H
+ATOM 10625 2HG2 THR M 301 -3.848 -46.378-146.967 1.00 0.00 H
+ATOM 10626 3HG2 THR M 301 -5.514 -46.481-146.352 1.00 0.00 H
+ATOM 10627 N GLU M 302 -6.722 -44.136-150.622 1.00132.45 N
+ATOM 10628 CA GLU M 302 -6.881 -43.774-152.028 1.00139.15 C
+ATOM 10629 C GLU M 302 -6.369 -42.362-152.299 1.00137.05 C
+ATOM 10630 O GLU M 302 -7.100 -41.513-152.810 1.00129.05 O
+ATOM 10631 CB GLU M 302 -8.350 -43.882-152.443 1.00136.09 C
+ATOM 10632 CG GLU M 302 -8.927 -45.287-152.352 1.00 0.00 C
+ATOM 10633 CD GLU M 302 -10.368 -45.357-152.777 1.00 0.00 C
+ATOM 10634 OE1 GLU M 302 -10.934 -44.328-153.059 1.00 0.00 O
+ATOM 10635 OE2 GLU M 302 -10.902 -46.440-152.820 1.00 0.00 O
+ATOM 10636 H GLU M 302 -7.484 -43.966-149.981 1.00 0.00 H
+ATOM 10637 HA GLU M 302 -6.291 -44.464-152.632 1.00 0.00 H
+ATOM 10638 1HB GLU M 302 -8.955 -43.231-151.812 1.00 0.00 H
+ATOM 10639 2HB GLU M 302 -8.464 -43.539-153.471 1.00 0.00 H
+ATOM 10640 1HG GLU M 302 -8.341 -45.951-152.987 1.00 0.00 H
+ATOM 10641 2HG GLU M 302 -8.839 -45.640-151.326 1.00 0.00 H
+ATOM 10642 N LYS M 310 0.065 -39.676-150.980 1.00165.01 N
+ATOM 10643 CA LYS M 310 -0.246 -41.093-150.837 1.00150.83 C
+ATOM 10644 C LYS M 310 -1.570 -41.289-150.108 1.00134.13 C
+ATOM 10645 O LYS M 310 -2.632 -41.368-150.730 1.00120.42 O
+ATOM 10646 CB LYS M 310 0.878 -41.817-150.094 1.00142.52 C
+ATOM 10647 CG LYS M 310 0.675 -43.321-149.959 1.00 0.00 C
+ATOM 10648 CD LYS M 310 1.865 -43.979-149.276 1.00 0.00 C
+ATOM 10649 CE LYS M 310 1.657 -45.479-149.124 1.00 0.00 C
+ATOM 10650 NZ LYS M 310 2.813 -46.136-148.457 1.00 0.00 N
+ATOM 10651 H LYS M 310 1.001 -39.355-150.777 1.00 0.00 H
+ATOM 10652 HA LYS M 310 -0.338 -41.529-151.832 1.00 0.00 H
+ATOM 10653 1HB LYS M 310 1.822 -41.652-150.613 1.00 0.00 H
+ATOM 10654 2HB LYS M 310 0.979 -41.402-149.092 1.00 0.00 H
+ATOM 10655 1HG LYS M 310 -0.223 -43.516-149.372 1.00 0.00 H
+ATOM 10656 2HG LYS M 310 0.545 -43.761-150.947 1.00 0.00 H
+ATOM 10657 1HD LYS M 310 2.766 -43.804-149.866 1.00 0.00 H
+ATOM 10658 2HD LYS M 310 2.007 -43.540-148.289 1.00 0.00 H
+ATOM 10659 1HE LYS M 310 0.760 -45.663-148.534 1.00 0.00 H
+ATOM 10660 2HE LYS M 310 1.516 -45.928-150.107 1.00 0.00 H
+ATOM 10661 1HZ LYS M 310 2.636 -47.128-148.376 1.00 0.00 H
+ATOM 10662 2HZ LYS M 310 3.648 -45.988-149.007 1.00 0.00 H
+ATOM 10663 3HZ LYS M 310 2.941 -45.741-147.537 1.00 0.00 H
+ATOM 10664 N LYS M 311 -1.497 -41.364-148.784 1.00132.54 N
+ATOM 10665 CA LYS M 311 -2.658 -41.587-147.933 1.00122.58 C
+ATOM 10666 C LYS M 311 -2.963 -40.304-147.173 1.00123.60 C
+ATOM 10667 O LYS M 311 -2.111 -39.801-146.434 1.00119.83 O
+ATOM 10668 CB LYS M 311 -2.419 -42.746-146.964 1.00113.69 C
+ATOM 10669 CG LYS M 311 -3.607 -43.074-146.070 1.00 0.00 C
+ATOM 10670 CD LYS M 311 -3.375 -44.361-145.293 1.00 0.00 C
+ATOM 10671 CE LYS M 311 -2.319 -44.175-144.214 1.00 0.00 C
+ATOM 10672 NZ LYS M 311 -2.176 -45.385-143.359 1.00 0.00 N
+ATOM 10673 H LYS M 311 -0.587 -41.260-148.358 1.00 0.00 H
+ATOM 10674 HA LYS M 311 -3.507 -41.845-148.567 1.00 0.00 H
+ATOM 10675 1HB LYS M 311 -2.165 -43.645-147.527 1.00 0.00 H
+ATOM 10676 2HB LYS M 311 -1.570 -42.513-146.320 1.00 0.00 H
+ATOM 10677 1HG LYS M 311 -3.768 -42.258-145.365 1.00 0.00 H
+ATOM 10678 2HG LYS M 311 -4.502 -43.185-146.681 1.00 0.00 H
+ATOM 10679 1HD LYS M 311 -4.308 -44.678-144.825 1.00 0.00 H
+ATOM 10680 2HD LYS M 311 -3.048 -45.145-145.976 1.00 0.00 H
+ATOM 10681 1HE LYS M 311 -1.358 -43.958-144.679 1.00 0.00 H
+ATOM 10682 2HE LYS M 311 -2.590 -43.330-143.581 1.00 0.00 H
+ATOM 10683 1HZ LYS M 311 -1.468 -45.221-142.658 1.00 0.00 H
+ATOM 10684 2HZ LYS M 311 -3.058 -45.585-142.908 1.00 0.00 H
+ATOM 10685 3HZ LYS M 311 -1.906 -46.172-143.932 1.00 0.00 H
+ATOM 10686 N GLU M 312 -4.171 -39.779-147.360 1.00128.33 N
+ATOM 10687 CA GLU M 312 -4.615 -38.589-146.650 1.00128.75 C
+ATOM 10688 C GLU M 312 -5.239 -38.971-145.314 1.00116.37 C
+ATOM 10689 O GLU M 312 -5.870 -40.023-145.177 1.00106.36 O
+ATOM 10690 CB GLU M 312 -5.620 -37.796-147.490 1.00134.01 C
+ATOM 10691 CG GLU M 312 -5.003 -37.068-148.673 1.00147.78 C
+ATOM 10692 CD GLU M 312 -5.961 -36.086-149.320 1.00159.09 C
+ATOM 10693 OE1 GLU M 312 -6.561 -35.268-148.591 1.00163.10 O
+ATOM 10694 OE2 GLU M 312 -6.113 -36.131-150.559 1.00161.90 O
+ATOM 10695 H GLU M 312 -4.797 -40.223-148.016 1.00 0.00 H
+ATOM 10696 HA GLU M 312 -3.748 -37.956-146.460 1.00 0.00 H
+ATOM 10697 1HB GLU M 312 -6.387 -38.470-147.872 1.00 0.00 H
+ATOM 10698 2HB GLU M 312 -6.117 -37.057-146.861 1.00 0.00 H
+ATOM 10699 1HG GLU M 312 -4.119 -36.529-148.334 1.00 0.00 H
+ATOM 10700 2HG GLU M 312 -4.685 -37.802-149.412 1.00 0.00 H
+ATOM 10701 N VAL M 313 -5.056 -38.103-144.323 1.00117.33 N
+ATOM 10702 CA VAL M 313 -5.557 -38.327-142.973 1.00109.92 C
+ATOM 10703 C VAL M 313 -6.620 -37.285-142.660 1.00 93.70 C
+ATOM 10704 O VAL M 313 -6.471 -36.103-142.992 1.00 97.36 O
+ATOM 10705 CB VAL M 313 -4.423 -38.287-141.928 1.00114.12 C
+ATOM 10706 CG1 VAL M 313 -3.453 -39.429-142.164 1.00125.51 C
+ATOM 10707 CG2 VAL M 313 -3.697 -36.950-141.964 1.00116.94 C
+ATOM 10708 H VAL M 313 -4.546 -37.254-144.524 1.00 0.00 H
+ATOM 10709 HA VAL M 313 -6.017 -39.315-142.934 1.00 0.00 H
+ATOM 10710 HB VAL M 313 -4.851 -38.432-140.936 1.00 0.00 H
+ATOM 10711 1HG1 VAL M 313 -2.657 -39.390-141.420 1.00 0.00 H
+ATOM 10712 2HG1 VAL M 313 -3.981 -40.378-142.080 1.00 0.00 H
+ATOM 10713 3HG1 VAL M 313 -3.021 -39.340-143.161 1.00 0.00 H
+ATOM 10714 1HG2 VAL M 313 -2.903 -36.947-141.218 1.00 0.00 H
+ATOM 10715 2HG2 VAL M 313 -3.266 -36.796-142.954 1.00 0.00 H
+ATOM 10716 3HG2 VAL M 313 -4.402 -36.147-141.747 1.00 0.00 H
+ATOM 10717 N PHE M 314 -7.699 -37.731-142.031 1.00 80.50 N
+ATOM 10718 CA PHE M 314 -8.771 -36.861-141.559 1.00 82.89 C
+ATOM 10719 C PHE M 314 -8.611 -36.772-140.045 1.00 79.20 C
+ATOM 10720 O PHE M 314 -9.052 -37.659-139.308 1.00 79.99 O
+ATOM 10721 CB PHE M 314 -10.137 -37.403-141.973 1.00 94.14 C
+ATOM 10722 CG PHE M 314 -10.303 -37.565-143.464 1.00101.83 C
+ATOM 10723 CD1 PHE M 314 -10.903 -36.571-144.219 1.00105.74 C
+ATOM 10724 CD2 PHE M 314 -9.855 -38.708-144.110 1.00100.03 C
+ATOM 10725 CE1 PHE M 314 -11.057 -36.713-145.587 1.00100.79 C
+ATOM 10726 CE2 PHE M 314 -10.006 -38.856-145.478 1.00 94.31 C
+ATOM 10727 CZ PHE M 314 -10.608 -37.857-146.216 1.00 97.30 C
+ATOM 10728 H PHE M 314 -7.770 -38.727-141.877 1.00 0.00 H
+ATOM 10729 HA PHE M 314 -8.641 -35.876-142.009 1.00 0.00 H
+ATOM 10730 1HB PHE M 314 -10.300 -38.373-141.506 1.00 0.00 H
+ATOM 10731 2HB PHE M 314 -10.918 -36.733-141.615 1.00 0.00 H
+ATOM 10732 HD1 PHE M 314 -11.256 -35.666-143.724 1.00 0.00 H
+ATOM 10733 HD2 PHE M 314 -9.380 -39.497-143.526 1.00 0.00 H
+ATOM 10734 HE1 PHE M 314 -11.532 -35.922-146.166 1.00 0.00 H
+ATOM 10735 HE2 PHE M 314 -9.651 -39.760-145.973 1.00 0.00 H
+ATOM 10736 HZ PHE M 314 -10.730 -37.972-147.292 1.00 0.00 H
+ATOM 10737 N ASN M 315 -7.975 -35.694-139.584 1.00 77.20 N
+ATOM 10738 CA ASN M 315 -7.422 -35.629-138.239 1.00 84.59 C
+ATOM 10739 C ASN M 315 -8.260 -34.789-137.280 1.00 79.50 C
+ATOM 10740 O ASN M 315 -7.749 -34.363-136.240 1.00 91.20 O
+ATOM 10741 CB ASN M 315 -5.999 -35.075-138.295 1.00 97.08 C
+ATOM 10742 CG ASN M 315 -5.929 -33.721-138.977 1.00102.63 C
+ATOM 10743 OD1 ASN M 315 -6.836 -33.335-139.716 1.00 70.30 O
+ATOM 10744 ND2 ASN M 315 -4.844 -32.993-138.734 1.00105.98 N
+ATOM 10745 H ASN M 315 -7.877 -34.896-140.195 1.00 0.00 H
+ATOM 10746 HA ASN M 315 -7.395 -36.639-137.827 1.00 0.00 H
+ATOM 10747 1HB ASN M 315 -5.605 -34.981-137.282 1.00 0.00 H
+ATOM 10748 2HB ASN M 315 -5.357 -35.774-138.832 1.00 0.00 H
+ATOM 10749 1HD2 ASN M 315 -4.742 -32.092-139.156 1.00 0.00 H
+ATOM 10750 2HD2 ASN M 315 -4.130 -33.346-138.130 1.00 0.00 H
+ATOM 10751 N ILE M 316 -9.526 -34.533-137.599 1.00 65.28 N
+ATOM 10752 CA ILE M 316 -10.380 -33.713-136.745 1.00 67.40 C
+ATOM 10753 C ILE M 316 -11.730 -34.404-136.608 1.00 72.23 C
+ATOM 10754 O ILE M 316 -12.519 -34.430-137.561 1.00 75.88 O
+ATOM 10755 CB ILE M 316 -10.555 -32.285-137.277 1.00 67.50 C
+ATOM 10756 CG1 ILE M 316 -9.219 -31.545-137.238 1.00 66.21 C
+ATOM 10757 CG2 ILE M 316 -11.603 -31.535-136.467 1.00 69.04 C
+ATOM 10758 CD1 ILE M 316 -9.317 -30.130-137.698 1.00 75.86 C
+ATOM 10759 H ILE M 316 -9.906 -34.915-138.453 1.00 0.00 H
+ATOM 10760 HA ILE M 316 -9.919 -33.642-135.761 1.00 0.00 H
+ATOM 10761 HB ILE M 316 -10.874 -32.321-138.318 1.00 0.00 H
+ATOM 10762 1HG1 ILE M 316 -8.828 -31.553-136.221 1.00 0.00 H
+ATOM 10763 2HG1 ILE M 316 -8.497 -32.064-137.869 1.00 0.00 H
+ATOM 10764 1HG2 ILE M 316 -11.712 -30.524-136.860 1.00 0.00 H
+ATOM 10765 2HG2 ILE M 316 -12.557 -32.056-136.536 1.00 0.00 H
+ATOM 10766 3HG2 ILE M 316 -11.291 -31.487-135.424 1.00 0.00 H
+ATOM 10767 1HD1 ILE M 316 -8.334 -29.662-137.646 1.00 0.00 H
+ATOM 10768 2HD1 ILE M 316 -9.677 -30.106-138.727 1.00 0.00 H
+ATOM 10769 3HD1 ILE M 316 -10.011 -29.587-137.058 1.00 0.00 H
+ATOM 10770 N LEU M 317 -12.001 -34.949-135.426 1.00 56.64 N
+ATOM 10771 CA LEU M 317 -13.258 -35.638-135.180 1.00 62.15 C
+ATOM 10772 C LEU M 317 -14.395 -34.631-135.057 1.00 65.56 C
+ATOM 10773 O LEU M 317 -14.277 -33.627-134.349 1.00 77.56 O
+ATOM 10774 CB LEU M 317 -13.148 -36.483-133.912 1.00 67.96 C
+ATOM 10775 CG LEU M 317 -14.368 -37.306-133.507 1.00 72.75 C
+ATOM 10776 CD1 LEU M 317 -14.621 -38.406-134.520 1.00 68.03 C
+ATOM 10777 CD2 LEU M 317 -14.163 -37.891-132.119 1.00 75.81 C
+ATOM 10778 H LEU M 317 -11.321 -34.885-134.682 1.00 0.00 H
+ATOM 10779 HA LEU M 317 -13.464 -36.294-136.025 1.00 0.00 H
+ATOM 10780 1HB LEU M 317 -12.322 -37.183-134.031 1.00 0.00 H
+ATOM 10781 2HB LEU M 317 -12.920 -35.824-133.074 1.00 0.00 H
+ATOM 10782 HG LEU M 317 -15.252 -36.667-133.500 1.00 0.00 H
+ATOM 10783 1HD1 LEU M 317 -15.494 -38.985-134.218 1.00 0.00 H
+ATOM 10784 2HD1 LEU M 317 -14.801 -37.964-135.500 1.00 0.00 H
+ATOM 10785 3HD1 LEU M 317 -13.752 -39.061-134.570 1.00 0.00 H
+ATOM 10786 1HD2 LEU M 317 -15.039 -38.476-131.838 1.00 0.00 H
+ATOM 10787 2HD2 LEU M 317 -13.283 -38.534-132.121 1.00 0.00 H
+ATOM 10788 3HD2 LEU M 317 -14.020 -37.083-131.401 1.00 0.00 H
+ATOM 10789 N GLN M 318 -15.495 -34.896-135.756 1.00 61.39 N
+ATOM 10790 CA GLN M 318 -16.661 -34.024-135.723 1.00 55.47 C
+ATOM 10791 C GLN M 318 -17.795 -34.575-134.875 1.00 57.56 C
+ATOM 10792 O GLN M 318 -18.597 -33.792-134.356 1.00 63.95 O
+ATOM 10793 CB GLN M 318 -17.181 -33.776-137.144 1.00 54.43 C
+ATOM 10794 CG GLN M 318 -16.176 -33.125-138.074 1.00 65.71 C
+ATOM 10795 CD GLN M 318 -15.869 -31.691-137.689 1.00 72.84 C
+ATOM 10796 OE1 GLN M 318 -14.707 -31.287-137.632 1.00 75.49 O
+ATOM 10797 NE2 GLN M 318 -16.915 -30.909-137.434 1.00 62.66 N
+ATOM 10798 H GLN M 318 -15.520 -35.729-136.327 1.00 0.00 H
+ATOM 10799 HA GLN M 318 -16.367 -33.070-135.287 1.00 0.00 H
+ATOM 10800 1HB GLN M 318 -17.485 -34.723-137.590 1.00 0.00 H
+ATOM 10801 2HB GLN M 318 -18.062 -33.136-137.102 1.00 0.00 H
+ATOM 10802 1HG GLN M 318 -15.246 -33.692-138.042 1.00 0.00 H
+ATOM 10803 2HG GLN M 318 -16.579 -33.126-139.087 1.00 0.00 H
+ATOM 10804 1HE2 GLN M 318 -16.774 -29.953-137.175 1.00 0.00 H
+ATOM 10805 2HE2 GLN M 318 -17.843 -31.276-137.501 1.00 0.00 H
+ATOM 10806 N ALA M 319 -17.881 -35.895-134.730 1.00 53.70 N
+ATOM 10807 CA ALA M 319 -18.929 -36.544-133.954 1.00 55.04 C
+ATOM 10808 C ALA M 319 -18.594 -38.024-133.847 1.00 61.65 C
+ATOM 10809 O ALA M 319 -17.878 -38.579-134.688 1.00 63.19 O
+ATOM 10810 CB ALA M 319 -20.312 -36.351-134.585 1.00 53.22 C
+ATOM 10811 H ALA M 319 -17.181 -36.464-135.184 1.00 0.00 H
+ATOM 10812 HA ALA M 319 -18.943 -36.094-132.961 1.00 0.00 H
+ATOM 10813 1HB ALA M 319 -21.064 -36.851-133.974 1.00 0.00 H
+ATOM 10814 2HB ALA M 319 -20.540 -35.287-134.642 1.00 0.00 H
+ATOM 10815 3HB ALA M 319 -20.317 -36.777-135.587 1.00 0.00 H
+ATOM 10816 N ALA M 320 -19.130 -38.658-132.807 1.00 60.61 N
+ATOM 10817 CA ALA M 320 -18.894 -40.075-132.580 1.00 54.38 C
+ATOM 10818 C ALA M 320 -20.123 -40.697-131.935 1.00 46.89 C
+ATOM 10819 O ALA M 320 -21.038 -40.004-131.483 1.00 54.51 O
+ATOM 10820 CB ALA M 320 -17.656 -40.302-131.710 1.00 46.55 C
+ATOM 10821 H ALA M 320 -19.713 -38.147-132.160 1.00 0.00 H
+ATOM 10822 HA ALA M 320 -18.727 -40.550-133.547 1.00 0.00 H
+ATOM 10823 1HB ALA M 320 -17.508 -41.371-131.560 1.00 0.00 H
+ATOM 10824 2HB ALA M 320 -16.781 -39.881-132.205 1.00 0.00 H
+ATOM 10825 3HB ALA M 320 -17.795 -39.816-130.746 1.00 0.00 H
+ATOM 10826 N TYR M 321 -20.125 -42.028-131.886 1.00 51.55 N
+ATOM 10827 CA TYR M 321 -21.227 -42.782-131.302 1.00 50.09 C
+ATOM 10828 C TYR M 321 -20.775 -44.211-131.040 1.00 55.70 C
+ATOM 10829 O TYR M 321 -20.273 -44.880-131.950 1.00 61.46 O
+ATOM 10830 CB TYR M 321 -22.443 -42.755-132.229 1.00 48.41 C
+ATOM 10831 CG TYR M 321 -23.700 -43.367-131.658 1.00 57.96 C
+ATOM 10832 CD1 TYR M 321 -24.619 -42.592-130.961 1.00 70.66 C
+ATOM 10833 CD2 TYR M 321 -23.973 -44.715-131.821 1.00 61.93 C
+ATOM 10834 CE1 TYR M 321 -25.774 -43.146-130.443 1.00 70.14 C
+ATOM 10835 CE2 TYR M 321 -25.119 -45.277-131.304 1.00 68.62 C
+ATOM 10836 CZ TYR M 321 -26.017 -44.489-130.616 1.00 63.87 C
+ATOM 10837 OH TYR M 321 -27.161 -45.055-130.103 1.00 65.53 O
+ATOM 10838 H TYR M 321 -19.335 -42.528-132.267 1.00 0.00 H
+ATOM 10839 HA TYR M 321 -21.500 -42.317-130.354 1.00 0.00 H
+ATOM 10840 1HB TYR M 321 -22.674 -41.723-132.497 1.00 0.00 H
+ATOM 10841 2HB TYR M 321 -22.210 -43.288-133.150 1.00 0.00 H
+ATOM 10842 HD1 TYR M 321 -24.435 -41.527-130.815 1.00 0.00 H
+ATOM 10843 HD2 TYR M 321 -23.275 -45.351-132.365 1.00 0.00 H
+ATOM 10844 HE1 TYR M 321 -26.482 -42.521-129.899 1.00 0.00 H
+ATOM 10845 HE2 TYR M 321 -25.313 -46.341-131.439 1.00 0.00 H
+ATOM 10846 HH TYR M 321 -27.175 -45.992-130.312 1.00 0.00 H
+ATOM 10847 N VAL M 322 -20.933 -44.689-129.811 1.00 53.23 N
+ATOM 10848 CA VAL M 322 -20.545 -46.051-129.471 1.00 51.99 C
+ATOM 10849 C VAL M 322 -21.771 -46.943-129.585 1.00 56.86 C
+ATOM 10850 O VAL M 322 -22.860 -46.580-129.126 1.00 66.47 O
+ATOM 10851 CB VAL M 322 -19.930 -46.120-128.066 1.00 57.78 C
+ATOM 10852 CG1 VAL M 322 -19.319 -47.493-127.828 1.00 52.20 C
+ATOM 10853 CG2 VAL M 322 -18.886 -45.028-127.891 1.00 58.65 C
+ATOM 10854 H VAL M 322 -21.330 -44.097-129.095 1.00 0.00 H
+ATOM 10855 HA VAL M 322 -19.796 -46.387-130.189 1.00 0.00 H
+ATOM 10856 HB VAL M 322 -20.720 -45.985-127.327 1.00 0.00 H
+ATOM 10857 1HG1 VAL M 322 -18.886 -47.530-126.828 1.00 0.00 H
+ATOM 10858 2HG1 VAL M 322 -20.092 -48.256-127.917 1.00 0.00 H
+ATOM 10859 3HG1 VAL M 322 -18.540 -47.677-128.567 1.00 0.00 H
+ATOM 10860 1HG2 VAL M 322 -18.460 -45.089-126.890 1.00 0.00 H
+ATOM 10861 2HG2 VAL M 322 -18.096 -45.158-128.631 1.00 0.00 H
+ATOM 10862 3HG2 VAL M 322 -19.353 -44.053-128.027 1.00 0.00 H
+ATOM 10863 N SER M 323 -21.599 -48.101-130.217 1.00 61.96 N
+ATOM 10864 CA SER M 323 -22.718 -48.983-130.515 1.00 65.11 C
+ATOM 10865 C SER M 323 -22.194 -50.397-130.696 1.00 59.45 C
+ATOM 10866 O SER M 323 -20.996 -50.615-130.889 1.00 65.11 O
+ATOM 10867 CB SER M 323 -23.470 -48.521-131.770 1.00 79.40 C
+ATOM 10868 OG SER M 323 -24.303 -49.547-132.282 1.00 93.41 O
+ATOM 10869 H SER M 323 -20.668 -48.375-130.497 1.00 0.00 H
+ATOM 10870 HA SER M 323 -23.411 -48.960-129.673 1.00 0.00 H
+ATOM 10871 1HB SER M 323 -24.076 -47.648-131.530 1.00 0.00 H
+ATOM 10872 2HB SER M 323 -22.753 -48.222-132.534 1.00 0.00 H
+ATOM 10873 HG SER M 323 -24.186 -50.300-131.697 1.00 0.00 H
+ATOM 10874 N LYS M 324 -23.094 -51.342-130.628 1.00 60.76 N
+ATOM 10875 CA LYS M 324 -22.615 -52.667-130.984 1.00 67.19 C
+ATOM 10876 C LYS M 324 -22.884 -52.945-132.463 1.00 69.02 C
+ATOM 10877 O LYS M 324 -23.832 -52.405-133.041 1.00 69.19 O
+ATOM 10878 CB LYS M 324 -23.277 -53.733-130.109 1.00 69.22 C
+ATOM 10879 CG LYS M 324 -22.927 -53.638-128.630 1.00 66.16 C
+ATOM 10880 CD LYS M 324 -23.605 -54.741-127.830 1.00 67.27 C
+ATOM 10881 CE LYS M 324 -23.203 -54.689-126.363 1.00 0.00 C
+ATOM 10882 NZ LYS M 324 -23.695 -53.454-125.695 1.00 0.00 N
+ATOM 10883 H LYS M 324 -24.060 -51.224-130.357 1.00 0.00 H
+ATOM 10884 HA LYS M 324 -21.538 -52.703-130.815 1.00 0.00 H
+ATOM 10885 1HB LYS M 324 -24.361 -53.658-130.202 1.00 0.00 H
+ATOM 10886 2HB LYS M 324 -22.985 -54.723-130.459 1.00 0.00 H
+ATOM 10887 1HG LYS M 324 -21.847 -53.722-128.505 1.00 0.00 H
+ATOM 10888 2HG LYS M 324 -23.246 -52.671-128.242 1.00 0.00 H
+ATOM 10889 1HD LYS M 324 -24.688 -54.632-127.906 1.00 0.00 H
+ATOM 10890 2HD LYS M 324 -23.326 -55.711-128.239 1.00 0.00 H
+ATOM 10891 1HE LYS M 324 -23.611 -55.555-125.844 1.00 0.00 H
+ATOM 10892 2HE LYS M 324 -22.117 -54.722-126.283 1.00 0.00 H
+ATOM 10893 1HZ LYS M 324 -23.408 -53.458-124.726 1.00 0.00 H
+ATOM 10894 2HZ LYS M 324 -23.308 -52.643-126.157 1.00 0.00 H
+ATOM 10895 3HZ LYS M 324 -24.703 -53.421-125.746 1.00 0.00 H
+ATOM 10896 N PRO M 325 -22.058 -53.758-133.115 1.00 66.92 N
+ATOM 10897 CA PRO M 325 -22.173 -53.930-134.564 1.00 57.42 C
+ATOM 10898 C PRO M 325 -23.164 -55.016-134.958 1.00 65.42 C
+ATOM 10899 O PRO M 325 -23.495 -55.915-134.182 1.00 75.87 O
+ATOM 10900 CB PRO M 325 -20.749 -54.337-134.965 1.00 67.51 C
+ATOM 10901 CG PRO M 325 -20.272 -55.118-133.793 1.00 58.33 C
+ATOM 10902 CD PRO M 325 -20.894 -54.482-132.571 1.00 63.89 C
+ATOM 10903 HA PRO M 325 -22.456 -52.970-135.021 1.00 0.00 H
+ATOM 10904 1HB PRO M 325 -20.773 -54.922-135.896 1.00 0.00 H
+ATOM 10905 2HB PRO M 325 -20.144 -53.441-135.165 1.00 0.00 H
+ATOM 10906 1HG PRO M 325 -20.566 -56.173-133.894 1.00 0.00 H
+ATOM 10907 2HG PRO M 325 -19.173 -55.098-133.745 1.00 0.00 H
+ATOM 10908 1HD PRO M 325 -21.202 -55.267-131.865 1.00 0.00 H
+ATOM 10909 2HD PRO M 325 -20.169 -53.801-132.102 1.00 0.00 H
+ATOM 10910 N GLY M 326 -23.645 -54.902-136.200 1.00 70.66 N
+ATOM 10911 CA GLY M 326 -24.347 -56.001-136.823 1.00 75.78 C
+ATOM 10912 C GLY M 326 -23.391 -57.092-137.264 1.00 81.80 C
+ATOM 10913 O GLY M 326 -22.183 -56.884-137.351 1.00 84.61 O
+ATOM 10914 H GLY M 326 -23.521 -54.042-136.715 1.00 0.00 H
+ATOM 10915 1HA GLY M 326 -25.073 -56.413-136.122 1.00 0.00 H
+ATOM 10916 2HA GLY M 326 -24.905 -55.635-137.684 1.00 0.00 H
+ATOM 10917 N ALA M 327 -23.957 -58.266-137.557 1.00 78.70 N
+ATOM 10918 CA ALA M 327 -23.142 -59.461-137.769 1.00 77.85 C
+ATOM 10919 C ALA M 327 -22.126 -59.264-138.891 1.00 87.36 C
+ATOM 10920 O ALA M 327 -20.947 -59.614-138.744 1.00 93.55 O
+ATOM 10921 CB ALA M 327 -24.044 -60.658-138.062 1.00 82.20 C
+ATOM 10922 H ALA M 327 -24.962 -58.336-137.635 1.00 0.00 H
+ATOM 10923 HA ALA M 327 -22.578 -59.653-136.856 1.00 0.00 H
+ATOM 10924 1HB ALA M 327 -23.431 -61.546-138.219 1.00 0.00 H
+ATOM 10925 2HB ALA M 327 -24.714 -60.824-137.218 1.00 0.00 H
+ATOM 10926 3HB ALA M 327 -24.631 -60.460-138.957 1.00 0.00 H
+ATOM 10927 N GLN M 328 -22.564 -58.697-140.017 1.00 86.09 N
+ATOM 10928 CA GLN M 328 -21.682 -58.539-141.171 1.00 79.25 C
+ATOM 10929 C GLN M 328 -20.472 -57.675-140.826 1.00 80.00 C
+ATOM 10930 O GLN M 328 -19.322 -58.130-140.886 1.00 85.86 O
+ATOM 10931 CB GLN M 328 -22.461 -57.935-142.340 1.00 70.09 C
+ATOM 10932 CG GLN M 328 -21.715 -57.969-143.659 1.00 84.14 C
+ATOM 10933 CD GLN M 328 -22.353 -57.086-144.711 1.00 95.84 C
+ATOM 10934 OE1 GLN M 328 -23.166 -56.217-144.400 1.00101.86 O
+ATOM 10935 NE2 GLN M 328 -21.995 -57.314-145.969 1.00 99.31 N
+ATOM 10936 H GLN M 328 -23.518 -58.370-140.078 1.00 0.00 H
+ATOM 10937 HA GLN M 328 -21.313 -59.523-141.462 1.00 0.00 H
+ATOM 10938 1HB GLN M 328 -23.400 -58.473-142.468 1.00 0.00 H
+ATOM 10939 2HB GLN M 328 -22.706 -56.897-142.116 1.00 0.00 H
+ATOM 10940 1HG GLN M 328 -20.695 -57.622-143.497 1.00 0.00 H
+ATOM 10941 2HG GLN M 328 -21.706 -58.993-144.033 1.00 0.00 H
+ATOM 10942 1HE2 GLN M 328 -22.383 -56.762-146.708 1.00 0.00 H
+ATOM 10943 2HE2 GLN M 328 -21.337 -58.037-146.179 1.00 0.00 H
+ATOM 10944 N LEU M 329 -20.717 -56.415-140.458 1.00 65.44 N
+ATOM 10945 CA LEU M 329 -19.618 -55.539-140.071 1.00 64.92 C
+ATOM 10946 C LEU M 329 -18.802 -56.133-138.930 1.00 77.21 C
+ATOM 10947 O LEU M 329 -17.581 -55.946-138.879 1.00 70.04 O
+ATOM 10948 CB LEU M 329 -20.156 -54.160-139.685 1.00 59.66 C
+ATOM 10949 CG LEU M 329 -19.127 -53.166-139.148 1.00 66.30 C
+ATOM 10950 CD1 LEU M 329 -18.038 -52.900-140.175 1.00 58.37 C
+ATOM 10951 CD2 LEU M 329 -19.802 -51.873-138.729 1.00 71.27 C
+ATOM 10952 H LEU M 329 -21.661 -56.056-140.443 1.00 0.00 H
+ATOM 10953 HA LEU M 329 -18.947 -55.429-140.922 1.00 0.00 H
+ATOM 10954 1HB LEU M 329 -20.620 -53.711-140.561 1.00 0.00 H
+ATOM 10955 2HB LEU M 329 -20.921 -54.287-138.919 1.00 0.00 H
+ATOM 10956 HG LEU M 329 -18.622 -53.597-138.283 1.00 0.00 H
+ATOM 10957 1HD1 LEU M 329 -17.319 -52.190-139.767 1.00 0.00 H
+ATOM 10958 2HD1 LEU M 329 -17.528 -53.833-140.415 1.00 0.00 H
+ATOM 10959 3HD1 LEU M 329 -18.484 -52.486-141.079 1.00 0.00 H
+ATOM 10960 1HD2 LEU M 329 -19.053 -51.178-138.349 1.00 0.00 H
+ATOM 10961 2HD2 LEU M 329 -20.305 -51.430-139.589 1.00 0.00 H
+ATOM 10962 3HD2 LEU M 329 -20.534 -52.081-137.948 1.00 0.00 H
+ATOM 10963 N ALA M 330 -19.453 -56.866-138.020 1.00 83.03 N
+ATOM 10964 CA ALA M 330 -18.741 -57.469-136.896 1.00 72.03 C
+ATOM 10965 C ALA M 330 -17.679 -58.445-137.379 1.00 73.52 C
+ATOM 10966 O ALA M 330 -16.519 -58.375-136.959 1.00 76.30 O
+ATOM 10967 CB ALA M 330 -19.726 -58.169-135.960 1.00 68.89 C
+ATOM 10968 H ALA M 330 -20.449 -57.009-138.105 1.00 0.00 H
+ATOM 10969 HA ALA M 330 -18.237 -56.673-136.348 1.00 0.00 H
+ATOM 10970 1HB ALA M 330 -19.182 -58.614-135.127 1.00 0.00 H
+ATOM 10971 2HB ALA M 330 -20.444 -57.443-135.578 1.00 0.00 H
+ATOM 10972 3HB ALA M 330 -20.254 -58.949-136.506 1.00 0.00 H
+ATOM 10973 N ARG M 331 -18.057 -59.369-138.267 1.00 78.38 N
+ATOM 10974 CA ARG M 331 -17.061 -60.276-138.823 1.00 86.64 C
+ATOM 10975 C ARG M 331 -16.093 -59.556-139.754 1.00 82.07 C
+ATOM 10976 O ARG M 331 -15.026 -60.101-140.057 1.00 88.17 O
+ATOM 10977 CB ARG M 331 -17.743 -61.434-139.558 1.00 91.48 C
+ATOM 10978 CG ARG M 331 -18.235 -61.091-140.952 1.00 98.00 C
+ATOM 10979 CD ARG M 331 -19.354 -62.019-141.393 1.00102.41 C
+ATOM 10980 NE ARG M 331 -20.056 -61.495-142.562 1.00109.84 N
+ATOM 10981 CZ ARG M 331 -21.235 -61.937-142.987 1.00118.38 C
+ATOM 10982 NH1 ARG M 331 -21.855 -62.909-142.332 1.00125.61 N
+ATOM 10983 NH2 ARG M 331 -21.798 -61.402-144.063 1.00112.40 N
+ATOM 10984 H ARG M 331 -19.019 -59.454-138.563 1.00 0.00 H
+ATOM 10985 HA ARG M 331 -16.468 -60.684-138.003 1.00 0.00 H
+ATOM 10986 1HB ARG M 331 -17.049 -62.268-139.645 1.00 0.00 H
+ATOM 10987 2HB ARG M 331 -18.599 -61.780-138.978 1.00 0.00 H
+ATOM 10988 1HG ARG M 331 -18.612 -60.068-140.964 1.00 0.00 H
+ATOM 10989 2HG ARG M 331 -17.412 -61.183-141.661 1.00 0.00 H
+ATOM 10990 1HD ARG M 331 -18.939 -62.993-141.649 1.00 0.00 H
+ATOM 10991 2HD ARG M 331 -20.073 -62.133-140.582 1.00 0.00 H
+ATOM 10992 HE ARG M 331 -19.614 -60.747-143.080 1.00 0.00 H
+ATOM 10993 1HH1 ARG M 331 -21.431 -63.314-141.509 1.00 0.00 H
+ATOM 10994 2HH1 ARG M 331 -22.751 -63.244-142.655 1.00 0.00 H
+ATOM 10995 1HH2 ARG M 331 -21.330 -60.657-144.561 1.00 0.00 H
+ATOM 10996 2HH2 ARG M 331 -22.693 -61.739-144.384 1.00 0.00 H
+ATOM 10997 N GLN M 332 -16.433 -58.343-140.204 1.00 79.05 N
+ATOM 10998 CA GLN M 332 -15.536 -57.583-141.071 1.00 81.54 C
+ATOM 10999 C GLN M 332 -14.461 -56.816-140.305 1.00 86.35 C
+ATOM 11000 O GLN M 332 -13.477 -56.389-140.917 1.00 91.08 O
+ATOM 11001 CB GLN M 332 -16.338 -56.603-141.933 1.00 88.96 C
+ATOM 11002 CG GLN M 332 -17.110 -57.250-143.074 1.00 96.06 C
+ATOM 11003 CD GLN M 332 -17.936 -56.252-143.863 1.00101.73 C
+ATOM 11004 OE1 GLN M 332 -17.498 -55.736-144.891 1.00104.59 O
+ATOM 11005 NE2 GLN M 332 -19.139 -55.971-143.381 1.00107.98 N
+ATOM 11006 H GLN M 332 -17.322 -57.942-139.943 1.00 0.00 H
+ATOM 11007 HA GLN M 332 -15.015 -58.281-141.726 1.00 0.00 H
+ATOM 11008 1HB GLN M 332 -17.053 -56.069-141.307 1.00 0.00 H
+ATOM 11009 2HB GLN M 332 -15.665 -55.863-142.364 1.00 0.00 H
+ATOM 11010 1HG GLN M 332 -16.403 -57.720-143.757 1.00 0.00 H
+ATOM 11011 2HG GLN M 332 -17.786 -58.000-142.663 1.00 0.00 H
+ATOM 11012 1HE2 GLN M 332 -19.730 -55.319-143.858 1.00 0.00 H
+ATOM 11013 2HE2 GLN M 332 -19.456 -56.410-142.540 1.00 0.00 H
+ATOM 11014 N ILE M 333 -14.621 -56.618-138.997 1.00 83.44 N
+ATOM 11015 CA ILE M 333 -13.642 -55.879-138.211 1.00 83.31 C
+ATOM 11016 C ILE M 333 -13.099 -56.716-137.054 1.00 88.56 C
+ATOM 11017 O ILE M 333 -12.559 -56.171-136.096 1.00 77.30 O
+ATOM 11018 CB ILE M 333 -14.223 -54.546-137.701 1.00 76.43 C
+ATOM 11019 CG1 ILE M 333 -15.417 -54.799-136.781 1.00 80.37 C
+ATOM 11020 CG2 ILE M 333 -14.628 -53.660-138.867 1.00 65.63 C
+ATOM 11021 CD1 ILE M 333 -16.057 -53.533-136.268 1.00 73.68 C
+ATOM 11022 H ILE M 333 -15.441 -56.989-138.539 1.00 0.00 H
+ATOM 11023 HA ILE M 333 -12.786 -55.656-138.846 1.00 0.00 H
+ATOM 11024 HB ILE M 333 -13.473 -54.026-137.106 1.00 0.00 H
+ATOM 11025 1HG1 ILE M 333 -16.172 -55.376-137.315 1.00 0.00 H
+ATOM 11026 2HG1 ILE M 333 -15.097 -55.394-135.925 1.00 0.00 H
+ATOM 11027 1HG2 ILE M 333 -15.037 -52.724-138.488 1.00 0.00 H
+ATOM 11028 2HG2 ILE M 333 -13.756 -53.451-139.485 1.00 0.00 H
+ATOM 11029 3HG2 ILE M 333 -15.383 -54.169-139.466 1.00 0.00 H
+ATOM 11030 1HD1 ILE M 333 -16.897 -53.786-135.621 1.00 0.00 H
+ATOM 11031 2HD1 ILE M 333 -15.324 -52.958-135.702 1.00 0.00 H
+ATOM 11032 3HD1 ILE M 333 -16.413 -52.939-137.109 1.00 0.00 H
+ATOM 11033 N GLY M 334 -13.235 -58.037-137.135 1.00103.11 N
+ATOM 11034 CA GLY M 334 -12.696 -58.911-136.107 1.00104.75 C
+ATOM 11035 C GLY M 334 -13.323 -58.725-134.745 1.00 97.94 C
+ATOM 11036 O GLY M 334 -12.652 -58.921-133.726 1.00101.41 O
+ATOM 11037 H GLY M 334 -13.720 -58.444-137.922 1.00 0.00 H
+ATOM 11038 1HA GLY M 334 -12.833 -59.951-136.405 1.00 0.00 H
+ATOM 11039 2HA GLY M 334 -11.624 -58.743-136.012 1.00 0.00 H
+ATOM 11040 N ALA M 335 -14.595 -58.348-134.697 1.00 85.79 N
+ATOM 11041 CA ALA M 335 -15.291 -58.111-133.444 1.00 80.46 C
+ATOM 11042 C ALA M 335 -16.384 -59.151-133.240 1.00 88.36 C
+ATOM 11043 O ALA M 335 -16.724 -59.927-134.137 1.00 93.99 O
+ATOM 11044 CB ALA M 335 -15.886 -56.698-133.411 1.00 72.23 C
+ATOM 11045 H ALA M 335 -15.092 -58.223-135.567 1.00 0.00 H
+ATOM 11046 HA ALA M 335 -14.569 -58.205-132.633 1.00 0.00 H
+ATOM 11047 1HB ALA M 335 -16.402 -56.543-132.464 1.00 0.00 H
+ATOM 11048 2HB ALA M 335 -15.087 -55.964-133.513 1.00 0.00 H
+ATOM 11049 3HB ALA M 335 -16.592 -56.582-134.232 1.00 0.00 H
+ATOM 11050 N SER M 336 -16.925 -59.159-132.029 1.00 93.10 N
+ATOM 11051 CA SER M 336 -18.045 -60.011-131.669 1.00 99.70 C
+ATOM 11052 C SER M 336 -19.322 -59.182-131.591 1.00 90.74 C
+ATOM 11053 O SER M 336 -19.297 -57.949-131.602 1.00 82.44 O
+ATOM 11054 CB SER M 336 -17.777 -60.722-130.338 1.00113.20 C
+ATOM 11055 OG SER M 336 -16.570 -61.465-130.389 1.00119.31 O
+ATOM 11056 H SER M 336 -16.533 -58.541-131.333 1.00 0.00 H
+ATOM 11057 HA SER M 336 -18.170 -60.766-132.447 1.00 0.00 H
+ATOM 11058 1HB SER M 336 -17.719 -59.985-129.537 1.00 0.00 H
+ATOM 11059 2HB SER M 336 -18.607 -61.389-130.109 1.00 0.00 H
+ATOM 11060 HG SER M 336 -16.214 -61.332-131.271 1.00 0.00 H
+ATOM 11061 N LEU M 337 -20.454 -59.882-131.509 1.00 93.88 N
+ATOM 11062 CA LEU M 337 -21.743 -59.202-131.554 1.00 89.62 C
+ATOM 11063 C LEU M 337 -21.985 -58.352-130.314 1.00107.75 C
+ATOM 11064 O LEU M 337 -22.729 -57.368-130.378 1.00112.89 O
+ATOM 11065 CB LEU M 337 -22.867 -60.221-131.724 1.00 78.43 C
+ATOM 11066 CG LEU M 337 -23.045 -60.765-133.140 1.00 76.55 C
+ATOM 11067 CD1 LEU M 337 -24.022 -61.929-133.153 1.00 78.95 C
+ATOM 11068 CD2 LEU M 337 -23.507 -59.659-134.069 1.00 70.04 C
+ATOM 11069 H LEU M 337 -20.431 -60.887-131.415 1.00 0.00 H
+ATOM 11070 HA LEU M 337 -21.748 -58.527-132.409 1.00 0.00 H
+ATOM 11071 1HB LEU M 337 -22.674 -61.064-131.063 1.00 0.00 H
+ATOM 11072 2HB LEU M 337 -23.806 -59.757-131.422 1.00 0.00 H
+ATOM 11073 HG LEU M 337 -22.095 -61.161-133.500 1.00 0.00 H
+ATOM 11074 1HD1 LEU M 337 -24.133 -62.300-134.172 1.00 0.00 H
+ATOM 11075 2HD1 LEU M 337 -23.644 -62.729-132.516 1.00 0.00 H
+ATOM 11076 3HD1 LEU M 337 -24.990 -61.595-132.782 1.00 0.00 H
+ATOM 11077 1HD2 LEU M 337 -23.630 -60.058-135.077 1.00 0.00 H
+ATOM 11078 2HD2 LEU M 337 -24.459 -59.262-133.717 1.00 0.00 H
+ATOM 11079 3HD2 LEU M 337 -22.764 -58.861-134.083 1.00 0.00 H
+ATOM 11080 N ASN M 338 -21.369 -58.706-129.187 1.00113.19 N
+ATOM 11081 CA ASN M 338 -21.578 -57.997-127.933 1.00109.08 C
+ATOM 11082 C ASN M 338 -20.524 -56.932-127.665 1.00 97.85 C
+ATOM 11083 O ASN M 338 -20.632 -56.215-126.666 1.00 99.52 O
+ATOM 11084 CB ASN M 338 -21.613 -58.992-126.771 1.00117.78 C
+ATOM 11085 CG ASN M 338 -22.600 -60.117-127.002 1.00133.64 C
+ATOM 11086 OD1 ASN M 338 -22.258 -61.147-127.585 1.00136.80 O
+ATOM 11087 ND2 ASN M 338 -23.833 -59.926-126.547 1.00141.45 N
+ATOM 11088 H ASN M 338 -20.737 -59.493-129.208 1.00 0.00 H
+ATOM 11089 HA ASN M 338 -22.537 -57.479-127.984 1.00 0.00 H
+ATOM 11090 1HB ASN M 338 -20.619 -59.418-126.626 1.00 0.00 H
+ATOM 11091 2HB ASN M 338 -21.882 -58.470-125.853 1.00 0.00 H
+ATOM 11092 1HD2 ASN M 338 -24.528 -60.635-126.671 1.00 0.00 H
+ATOM 11093 2HD2 ASN M 338 -24.067 -59.074-126.080 1.00 0.00 H
+ATOM 11094 N ASP M 339 -19.522 -56.804-128.530 1.00 87.05 N
+ATOM 11095 CA ASP M 339 -18.447 -55.849-128.311 1.00 91.54 C
+ATOM 11096 C ASP M 339 -18.893 -54.429-128.641 1.00 88.17 C
+ATOM 11097 O ASP M 339 -19.714 -54.200-129.532 1.00 92.84 O
+ATOM 11098 CB ASP M 339 -17.224 -56.220-129.150 1.00 94.34 C
+ATOM 11099 CG ASP M 339 -16.795 -57.660-128.949 1.00112.88 C
+ATOM 11100 OD1 ASP M 339 -17.102 -58.229-127.880 1.00121.41 O
+ATOM 11101 OD2 ASP M 339 -16.149 -58.226-129.856 1.00118.42 O
+ATOM 11102 H ASP M 339 -19.505 -57.382-129.358 1.00 0.00 H
+ATOM 11103 HA ASP M 339 -18.169 -55.877-127.257 1.00 0.00 H
+ATOM 11104 1HB ASP M 339 -17.446 -56.063-130.206 1.00 0.00 H
+ATOM 11105 2HB ASP M 339 -16.392 -55.565-128.890 1.00 0.00 H
+ATOM 11106 N ASP M 340 -18.340 -53.470-127.903 1.00 86.71 N
+ATOM 11107 CA ASP M 340 -18.610 -52.060-128.136 1.00 76.93 C
+ATOM 11108 C ASP M 340 -17.657 -51.522-129.193 1.00 74.00 C
+ATOM 11109 O ASP M 340 -16.438 -51.694-129.085 1.00 79.84 O
+ATOM 11110 CB ASP M 340 -18.466 -51.253-126.845 1.00 81.50 C
+ATOM 11111 CG ASP M 340 -19.618 -51.472-125.888 1.00101.13 C
+ATOM 11112 OD1 ASP M 340 -20.732 -51.789-126.358 1.00105.56 O
+ATOM 11113 OD2 ASP M 340 -19.412 -51.315-124.666 1.00113.15 O
+ATOM 11114 H ASP M 340 -17.712 -53.734-127.157 1.00 0.00 H
+ATOM 11115 HA ASP M 340 -19.635 -51.958-128.492 1.00 0.00 H
+ATOM 11116 1HB ASP M 340 -17.537 -51.529-126.345 1.00 0.00 H
+ATOM 11117 2HB ASP M 340 -18.406 -50.191-127.084 1.00 0.00 H
+ATOM 11118 N ILE M 341 -18.218 -50.872-130.209 1.00 70.06 N
+ATOM 11119 CA ILE M 341 -17.454 -50.241-131.278 1.00 75.55 C
+ATOM 11120 C ILE M 341 -17.665 -48.735-131.191 1.00 66.75 C
+ATOM 11121 O ILE M 341 -18.783 -48.267-130.947 1.00 52.02 O
+ATOM 11122 CB ILE M 341 -17.858 -50.777-132.669 1.00 72.56 C
+ATOM 11123 CG1 ILE M 341 -17.122 -52.079-132.992 1.00 74.73 C
+ATOM 11124 CG2 ILE M 341 -17.552 -49.760-133.752 1.00 66.41 C
+ATOM 11125 CD1 ILE M 341 -17.587 -53.273-132.210 1.00 80.69 C
+ATOM 11126 H ILE M 341 -19.226 -50.821-130.229 1.00 0.00 H
+ATOM 11127 HA ILE M 341 -16.398 -50.463-131.126 1.00 0.00 H
+ATOM 11128 HB ILE M 341 -18.927 -50.989-132.681 1.00 0.00 H
+ATOM 11129 1HG1 ILE M 341 -17.237 -52.309-134.051 1.00 0.00 H
+ATOM 11130 2HG1 ILE M 341 -16.056 -51.952-132.800 1.00 0.00 H
+ATOM 11131 1HG2 ILE M 341 -17.845 -50.162-134.722 1.00 0.00 H
+ATOM 11132 2HG2 ILE M 341 -18.106 -48.843-133.557 1.00 0.00 H
+ATOM 11133 3HG2 ILE M 341 -16.483 -49.544-133.757 1.00 0.00 H
+ATOM 11134 1HD1 ILE M 341 -17.009 -54.149-132.505 1.00 0.00 H
+ATOM 11135 2HD1 ILE M 341 -17.446 -53.088-131.145 1.00 0.00 H
+ATOM 11136 3HD1 ILE M 341 -18.642 -53.451-132.412 1.00 0.00 H
+ATOM 11137 N LEU M 342 -16.584 -47.982-131.375 1.00 66.43 N
+ATOM 11138 CA LEU M 342 -16.625 -46.527-131.432 1.00 61.25 C
+ATOM 11139 C LEU M 342 -16.671 -46.105-132.896 1.00 61.03 C
+ATOM 11140 O LEU M 342 -15.686 -46.261-133.623 1.00 65.29 O
+ATOM 11141 CB LEU M 342 -15.411 -45.920-130.734 1.00 60.90 C
+ATOM 11142 CG LEU M 342 -15.230 -44.415-130.941 1.00 56.90 C
+ATOM 11143 CD1 LEU M 342 -16.351 -43.642-130.265 1.00 71.40 C
+ATOM 11144 CD2 LEU M 342 -13.873 -43.954-130.447 1.00 48.28 C
+ATOM 11145 H LEU M 342 -15.697 -48.454-131.479 1.00 0.00 H
+ATOM 11146 HA LEU M 342 -17.524 -46.186-130.919 1.00 0.00 H
+ATOM 11147 1HB LEU M 342 -15.497 -46.105-129.665 1.00 0.00 H
+ATOM 11148 2HB LEU M 342 -14.514 -46.421-131.098 1.00 0.00 H
+ATOM 11149 HG LEU M 342 -15.311 -44.181-132.003 1.00 0.00 H
+ATOM 11150 1HD1 LEU M 342 -16.204 -42.574-130.424 1.00 0.00 H
+ATOM 11151 2HD1 LEU M 342 -17.308 -43.943-130.690 1.00 0.00 H
+ATOM 11152 3HD1 LEU M 342 -16.345 -43.853-129.196 1.00 0.00 H
+ATOM 11153 1HD2 LEU M 342 -13.773 -42.880-130.608 1.00 0.00 H
+ATOM 11154 2HD2 LEU M 342 -13.780 -44.172-129.383 1.00 0.00 H
+ATOM 11155 3HD2 LEU M 342 -13.089 -44.478-130.994 1.00 0.00 H
+ATOM 11156 N PHE M 343 -17.808 -45.571-133.327 1.00 61.45 N
+ATOM 11157 CA PHE M 343 -17.942 -45.044-134.678 1.00 50.22 C
+ATOM 11158 C PHE M 343 -17.617 -43.555-134.677 1.00 63.75 C
+ATOM 11159 O PHE M 343 -18.181 -42.791-133.888 1.00 74.21 O
+ATOM 11160 CB PHE M 343 -19.352 -45.284-135.211 1.00 49.70 C
+ATOM 11161 CG PHE M 343 -19.713 -46.735-135.338 1.00 59.06 C
+ATOM 11162 CD1 PHE M 343 -20.568 -47.332-134.426 1.00 55.45 C
+ATOM 11163 CD2 PHE M 343 -19.203 -47.501-136.375 1.00 70.35 C
+ATOM 11164 CE1 PHE M 343 -20.904 -48.667-134.542 1.00 63.76 C
+ATOM 11165 CE2 PHE M 343 -19.537 -48.837-136.502 1.00 70.12 C
+ATOM 11166 CZ PHE M 343 -20.390 -49.421-135.583 1.00 74.29 C
+ATOM 11167 H PHE M 343 -18.600 -45.529-132.702 1.00 0.00 H
+ATOM 11168 HA PHE M 343 -17.233 -45.564-135.324 1.00 0.00 H
+ATOM 11169 1HB PHE M 343 -20.076 -44.810-134.550 1.00 0.00 H
+ATOM 11170 2HB PHE M 343 -19.454 -44.822-136.192 1.00 0.00 H
+ATOM 11171 HD1 PHE M 343 -20.977 -46.735-133.610 1.00 0.00 H
+ATOM 11172 HD2 PHE M 343 -18.530 -47.036-137.097 1.00 0.00 H
+ATOM 11173 HE1 PHE M 343 -21.573 -49.125-133.814 1.00 0.00 H
+ATOM 11174 HE2 PHE M 343 -19.131 -49.430-137.321 1.00 0.00 H
+ATOM 11175 HZ PHE M 343 -20.655 -50.473-135.678 1.00 0.00 H
+ATOM 11176 N GLY M 344 -16.711 -43.151-135.549 1.00 67.73 N
+ATOM 11177 CA GLY M 344 -16.248 -41.773-135.584 1.00 72.91 C
+ATOM 11178 C GLY M 344 -16.311 -41.183-136.974 1.00 77.93 C
+ATOM 11179 O GLY M 344 -16.009 -41.853-137.962 1.00 92.64 O
+ATOM 11180 H GLY M 344 -16.330 -43.815-136.208 1.00 0.00 H
+ATOM 11181 1HA GLY M 344 -16.855 -41.168-134.911 1.00 0.00 H
+ATOM 11182 2HA GLY M 344 -15.222 -41.725-135.221 1.00 0.00 H
+ATOM 11183 N VAL M 345 -16.706 -39.914-137.039 1.00 77.38 N
+ATOM 11184 CA VAL M 345 -16.761 -39.160-138.286 1.00 69.10 C
+ATOM 11185 C VAL M 345 -15.675 -38.094-138.241 1.00 76.63 C
+ATOM 11186 O VAL M 345 -15.705 -37.202-137.384 1.00 83.13 O
+ATOM 11187 CB VAL M 345 -18.142 -38.530-138.505 1.00 68.53 C
+ATOM 11188 CG1 VAL M 345 -18.037 -37.392-139.491 1.00 86.03 C
+ATOM 11189 CG2 VAL M 345 -19.118 -39.579-139.007 1.00 64.75 C
+ATOM 11190 H VAL M 345 -16.978 -39.462-136.178 1.00 0.00 H
+ATOM 11191 HA VAL M 345 -16.566 -39.844-139.113 1.00 0.00 H
+ATOM 11192 HB VAL M 345 -18.500 -38.124-137.559 1.00 0.00 H
+ATOM 11193 1HG1 VAL M 345 -19.022 -36.949-139.642 1.00 0.00 H
+ATOM 11194 2HG1 VAL M 345 -17.355 -36.636-139.103 1.00 0.00 H
+ATOM 11195 3HG1 VAL M 345 -17.660 -37.768-140.442 1.00 0.00 H
+ATOM 11196 1HG2 VAL M 345 -20.096 -39.123-139.159 1.00 0.00 H
+ATOM 11197 2HG2 VAL M 345 -18.758 -39.989-139.951 1.00 0.00 H
+ATOM 11198 3HG2 VAL M 345 -19.202 -40.380-138.272 1.00 0.00 H
+ATOM 11199 N PHE M 346 -14.724 -38.179-139.165 1.00 74.76 N
+ATOM 11200 CA PHE M 346 -13.563 -37.304-139.183 1.00 70.27 C
+ATOM 11201 C PHE M 346 -13.593 -36.382-140.395 1.00 69.36 C
+ATOM 11202 O PHE M 346 -14.334 -36.600-141.357 1.00 64.65 O
+ATOM 11203 CB PHE M 346 -12.268 -38.120-139.183 1.00 63.48 C
+ATOM 11204 CG PHE M 346 -12.067 -38.941-137.944 1.00 63.42 C
+ATOM 11205 CD1 PHE M 346 -11.362 -38.430-136.868 1.00 69.99 C
+ATOM 11206 CD2 PHE M 346 -12.602 -40.214-137.845 1.00 69.95 C
+ATOM 11207 CE1 PHE M 346 -11.175 -39.182-135.725 1.00 71.80 C
+ATOM 11208 CE2 PHE M 346 -12.421 -40.970-136.703 1.00 68.42 C
+ATOM 11209 CZ PHE M 346 -11.704 -40.455-135.644 1.00 68.90 C
+ATOM 11210 H PHE M 346 -14.820 -38.884-139.882 1.00 0.00 H
+ATOM 11211 HA PHE M 346 -13.582 -36.685-138.285 1.00 0.00 H
+ATOM 11212 1HB PHE M 346 -12.262 -38.792-140.040 1.00 0.00 H
+ATOM 11213 2HB PHE M 346 -11.416 -37.450-139.287 1.00 0.00 H
+ATOM 11214 HD1 PHE M 346 -10.953 -37.421-136.930 1.00 0.00 H
+ATOM 11215 HD2 PHE M 346 -13.169 -40.621-138.683 1.00 0.00 H
+ATOM 11216 HE1 PHE M 346 -10.611 -38.770-134.889 1.00 0.00 H
+ATOM 11217 HE2 PHE M 346 -12.843 -41.973-136.638 1.00 0.00 H
+ATOM 11218 HZ PHE M 346 -11.554 -41.052-134.746 1.00 0.00 H
+ATOM 11219 N ALA M 347 -12.766 -35.340-140.331 1.00 67.79 N
+ATOM 11220 CA ALA M 347 -12.646 -34.366-141.405 1.00 74.06 C
+ATOM 11221 C ALA M 347 -11.193 -33.929-141.521 1.00 78.61 C
+ATOM 11222 O ALA M 347 -10.396 -34.098-140.595 1.00 87.87 O
+ATOM 11223 CB ALA M 347 -13.549 -33.148-141.171 1.00 61.96 C
+ATOM 11224 H ALA M 347 -12.203 -35.228-139.500 1.00 0.00 H
+ATOM 11225 HA ALA M 347 -12.955 -34.846-142.334 1.00 0.00 H
+ATOM 11226 1HB ALA M 347 -13.431 -32.444-141.995 1.00 0.00 H
+ATOM 11227 2HB ALA M 347 -14.589 -33.471-141.116 1.00 0.00 H
+ATOM 11228 3HB ALA M 347 -13.270 -32.663-140.237 1.00 0.00 H
+ATOM 11229 N GLN M 348 -10.853 -33.360-142.675 1.00 78.30 N
+ATOM 11230 CA GLN M 348 -9.491 -32.921-142.938 1.00 86.92 C
+ATOM 11231 C GLN M 348 -9.325 -31.453-142.565 1.00 86.59 C
+ATOM 11232 O GLN M 348 -10.192 -30.624-142.850 1.00 87.28 O
+ATOM 11233 CB GLN M 348 -9.128 -33.134-144.407 1.00 98.16 C
+ATOM 11234 CG GLN M 348 -7.668 -32.862-144.710 1.00106.41 C
+ATOM 11235 CD GLN M 348 -7.363 -32.914-146.187 1.00103.87 C
+ATOM 11236 OE1 GLN M 348 -8.207 -33.302-146.995 1.00107.16 O
+ATOM 11237 NE2 GLN M 348 -6.149 -32.521-146.553 1.00109.48 N
+ATOM 11238 H GLN M 348 -11.558 -33.229-143.386 1.00 0.00 H
+ATOM 11239 HA GLN M 348 -8.812 -33.513-142.324 1.00 0.00 H
+ATOM 11240 1HB GLN M 348 -9.354 -34.162-144.692 1.00 0.00 H
+ATOM 11241 2HB GLN M 348 -9.737 -32.480-145.031 1.00 0.00 H
+ATOM 11242 1HG GLN M 348 -7.411 -31.868-144.344 1.00 0.00 H
+ATOM 11243 2HG GLN M 348 -7.058 -33.614-144.210 1.00 0.00 H
+ATOM 11244 1HE2 GLN M 348 -5.889 -32.533-147.519 1.00 0.00 H
+ATOM 11245 2HE2 GLN M 348 -5.494 -32.212-145.863 1.00 0.00 H
+ATOM 11246 N SER M 349 -8.199 -31.140-141.931 1.00 85.55 N
+ATOM 11247 CA SER M 349 -7.966 -29.803-141.407 1.00 94.60 C
+ATOM 11248 C SER M 349 -7.438 -28.869-142.486 1.00103.52 C
+ATOM 11249 O SER M 349 -6.617 -29.260-143.321 1.00100.70 O
+ATOM 11250 CB SER M 349 -6.964 -29.852-140.254 1.00 99.47 C
+ATOM 11251 OG SER M 349 -5.699 -30.297-140.708 1.00115.32 O
+ATOM 11252 H SER M 349 -7.488 -31.847-141.810 1.00 0.00 H
+ATOM 11253 HA SER M 349 -8.912 -29.408-141.033 1.00 0.00 H
+ATOM 11254 1HB SER M 349 -6.869 -28.861-139.812 1.00 0.00 H
+ATOM 11255 2HB SER M 349 -7.334 -30.522-139.479 1.00 0.00 H
+ATOM 11256 HG SER M 349 -5.797 -30.458-141.649 1.00 0.00 H
+ATOM 11257 N LYS M 350 -7.912 -27.628-142.462 1.00109.11 N
+ATOM 11258 CA LYS M 350 -7.230 -26.580-143.201 1.00114.92 C
+ATOM 11259 C LYS M 350 -5.809 -26.449-142.660 1.00124.24 C
+ATOM 11260 O LYS M 350 -5.605 -26.507-141.441 1.00136.69 O
+ATOM 11261 CB LYS M 350 -7.980 -25.251-143.092 1.00112.53 C
+ATOM 11262 CG LYS M 350 -9.328 -25.230-143.800 1.00 88.59 C
+ATOM 11263 CD LYS M 350 -9.997 -23.869-143.674 1.00 0.00 C
+ATOM 11264 CE LYS M 350 -11.349 -23.850-144.371 1.00 0.00 C
+ATOM 11265 NZ LYS M 350 -12.027 -22.532-144.234 1.00 0.00 N
+ATOM 11266 H LYS M 350 -8.743 -27.398-141.936 1.00 0.00 H
+ATOM 11267 HA LYS M 350 -7.200 -26.862-144.254 1.00 0.00 H
+ATOM 11268 1HB LYS M 350 -8.150 -25.014-142.041 1.00 0.00 H
+ATOM 11269 2HB LYS M 350 -7.368 -24.453-143.513 1.00 0.00 H
+ATOM 11270 1HG LYS M 350 -9.188 -25.460-144.857 1.00 0.00 H
+ATOM 11271 2HG LYS M 350 -9.979 -25.987-143.364 1.00 0.00 H
+ATOM 11272 1HD LYS M 350 -10.137 -23.628-142.619 1.00 0.00 H
+ATOM 11273 2HD LYS M 350 -9.358 -23.107-144.121 1.00 0.00 H
+ATOM 11274 1HE LYS M 350 -11.216 -24.068-145.429 1.00 0.00 H
+ATOM 11275 2HE LYS M 350 -11.990 -24.620-143.942 1.00 0.00 H
+ATOM 11276 1HZ LYS M 350 -12.919 -22.560-144.707 1.00 0.00 H
+ATOM 11277 2HZ LYS M 350 -12.173 -22.328-143.255 1.00 0.00 H
+ATOM 11278 3HZ LYS M 350 -11.450 -21.812-144.645 1.00 0.00 H
+ATOM 11279 N PRO M 351 -4.811 -26.285-143.527 1.00119.58 N
+ATOM 11280 CA PRO M 351 -3.414 -26.432-143.097 1.00123.99 C
+ATOM 11281 C PRO M 351 -3.058 -25.544-141.910 1.00135.03 C
+ATOM 11282 O PRO M 351 -3.429 -24.370-141.850 1.00142.31 O
+ATOM 11283 CB PRO M 351 -2.623 -26.043-144.349 1.00115.85 C
+ATOM 11284 CG PRO M 351 -3.542 -26.376-145.475 1.00115.18 C
+ATOM 11285 CD PRO M 351 -4.923 -26.055-144.977 1.00112.78 C
+ATOM 11286 HA PRO M 351 -3.228 -27.481-142.825 1.00 0.00 H
+ATOM 11287 1HB PRO M 351 -2.361 -24.975-144.312 1.00 0.00 H
+ATOM 11288 2HB PRO M 351 -1.678 -26.605-144.387 1.00 0.00 H
+ATOM 11289 1HG PRO M 351 -3.278 -25.789-146.367 1.00 0.00 H
+ATOM 11290 2HG PRO M 351 -3.438 -27.436-145.750 1.00 0.00 H
+ATOM 11291 1HD PRO M 351 -5.162 -25.006-145.207 1.00 0.00 H
+ATOM 11292 2HD PRO M 351 -5.650 -26.731-145.450 1.00 0.00 H
+ATOM 11293 N ASP M 352 -2.336 -26.137-140.955 1.00134.61 N
+ATOM 11294 CA ASP M 352 -1.887 -25.462-139.736 1.00140.70 C
+ATOM 11295 C ASP M 352 -3.051 -24.850-138.963 1.00134.42 C
+ATOM 11296 O ASP M 352 -2.907 -23.804-138.326 1.00143.06 O
+ATOM 11297 CB ASP M 352 -0.826 -24.401-140.045 1.00160.17 C
+ATOM 11298 CG ASP M 352 0.487 -25.007-140.509 1.00175.49 C
+ATOM 11299 OD1 ASP M 352 0.689 -26.223-140.301 1.00174.49 O
+ATOM 11300 OD2 ASP M 352 1.319 -24.269-141.078 1.00185.79 O
+ATOM 11301 H ASP M 352 -2.094 -27.107-141.098 1.00 0.00 H
+ATOM 11302 HA ASP M 352 -1.443 -26.205-139.073 1.00 0.00 H
+ATOM 11303 1HB ASP M 352 -1.197 -23.730-140.820 1.00 0.00 H
+ATOM 11304 2HB ASP M 352 -0.641 -23.801-139.154 1.00 0.00 H
+ATOM 11305 N SER M 353 -4.210 -25.501-139.008 1.00119.47 N
+ATOM 11306 CA SER M 353 -5.381 -25.020-138.294 1.00118.25 C
+ATOM 11307 C SER M 353 -6.208 -26.212-137.841 1.00107.90 C
+ATOM 11308 O SER M 353 -5.983 -27.351-138.258 1.00101.39 O
+ATOM 11309 CB SER M 353 -6.221 -24.076-139.162 1.00122.57 C
+ATOM 11310 OG SER M 353 -7.434 -23.737-138.513 1.00123.29 O
+ATOM 11311 H SER M 353 -4.279 -26.350-139.551 1.00 0.00 H
+ATOM 11312 HA SER M 353 -5.047 -24.466-137.415 1.00 0.00 H
+ATOM 11313 1HB SER M 353 -5.651 -23.171-139.372 1.00 0.00 H
+ATOM 11314 2HB SER M 353 -6.437 -24.555-140.116 1.00 0.00 H
+ATOM 11315 HG SER M 353 -7.421 -24.198-137.671 1.00 0.00 H
+ATOM 11316 N ALA M 354 -7.171 -25.933-136.965 1.00104.54 N
+ATOM 11317 CA ALA M 354 -8.133 -26.925-136.514 1.00 95.41 C
+ATOM 11318 C ALA M 354 -9.497 -26.741-137.164 1.00 92.16 C
+ATOM 11319 O ALA M 354 -10.469 -27.370-136.735 1.00 86.64 O
+ATOM 11320 CB ALA M 354 -8.264 -26.884-134.990 1.00 93.45 C
+ATOM 11321 H ALA M 354 -7.229 -24.992-136.604 1.00 0.00 H
+ATOM 11322 HA ALA M 354 -7.770 -27.909-136.811 1.00 0.00 H
+ATOM 11323 1HB ALA M 354 -8.988 -27.632-134.667 1.00 0.00 H
+ATOM 11324 2HB ALA M 354 -7.296 -27.096-134.536 1.00 0.00 H
+ATOM 11325 3HB ALA M 354 -8.601 -25.896-134.681 1.00 0.00 H
+ATOM 11326 N GLU M 355 -9.592 -25.885-138.184 1.00 96.64 N
+ATOM 11327 CA GLU M 355 -10.837 -25.713-138.924 1.00 91.65 C
+ATOM 11328 C GLU M 355 -10.924 -26.756-140.030 1.00 90.25 C
+ATOM 11329 O GLU M 355 -10.000 -26.862-140.846 1.00 93.55 O
+ATOM 11330 CB GLU M 355 -10.928 -24.305-139.516 1.00 98.50 C
+ATOM 11331 CG GLU M 355 -12.230 -24.015-140.251 1.00101.64 C
+ATOM 11332 CD GLU M 355 -12.288 -22.621-140.809 1.00 0.00 C
+ATOM 11333 OE1 GLU M 355 -11.674 -21.748-140.243 1.00 0.00 O
+ATOM 11334 OE2 GLU M 355 -12.948 -22.427-141.803 1.00 0.00 O
+ATOM 11335 H GLU M 355 -8.782 -25.343-138.450 1.00 0.00 H
+ATOM 11336 HA GLU M 355 -11.671 -25.844-138.234 1.00 0.00 H
+ATOM 11337 1HB GLU M 355 -10.822 -23.568-138.720 1.00 0.00 H
+ATOM 11338 2HB GLU M 355 -10.108 -24.151-140.217 1.00 0.00 H
+ATOM 11339 1HG GLU M 355 -12.339 -24.727-141.069 1.00 0.00 H
+ATOM 11340 2HG GLU M 355 -13.062 -24.162-139.564 1.00 0.00 H
+ATOM 11341 N PRO M 356 -11.994 -27.542-140.087 1.00 86.33 N
+ATOM 11342 CA PRO M 356 -12.097 -28.588-141.104 1.00 92.08 C
+ATOM 11343 C PRO M 356 -12.704 -28.088-142.405 1.00105.89 C
+ATOM 11344 O PRO M 356 -13.575 -27.216-142.433 1.00106.76 O
+ATOM 11345 CB PRO M 356 -13.019 -29.615-140.434 1.00 86.85 C
+ATOM 11346 CG PRO M 356 -13.938 -28.770-139.615 1.00 82.18 C
+ATOM 11347 CD PRO M 356 -13.120 -27.585-139.137 1.00 84.71 C
+ATOM 11348 HA PRO M 356 -11.099 -29.012-141.290 1.00 0.00 H
+ATOM 11349 1HB PRO M 356 -13.541 -30.208-141.200 1.00 0.00 H
+ATOM 11350 2HB PRO M 356 -12.424 -30.319-139.833 1.00 0.00 H
+ATOM 11351 1HG PRO M 356 -14.800 -28.450-140.219 1.00 0.00 H
+ATOM 11352 2HG PRO M 356 -14.339 -29.352-138.772 1.00 0.00 H
+ATOM 11353 1HD PRO M 356 -13.730 -26.671-139.192 1.00 0.00 H
+ATOM 11354 2HD PRO M 356 -12.782 -27.764-138.106 1.00 0.00 H
+ATOM 11355 N MET M 357 -12.219 -28.662-143.498 1.00113.44 N
+ATOM 11356 CA MET M 357 -12.804 -28.428-144.806 1.00113.21 C
+ATOM 11357 C MET M 357 -13.857 -29.494-145.098 1.00105.90 C
+ATOM 11358 O MET M 357 -13.998 -30.482-144.375 1.00101.69 O
+ATOM 11359 CB MET M 357 -11.718 -28.411-145.883 1.00124.48 C
+ATOM 11360 CG MET M 357 -10.707 -29.543-145.774 1.00130.13 C
+ATOM 11361 SD MET M 357 -9.365 -29.417-146.976 1.00133.03 S
+ATOM 11362 CE MET M 357 -8.652 -27.836-146.533 1.00135.43 C
+ATOM 11363 H MET M 357 -11.422 -29.278-143.418 1.00 0.00 H
+ATOM 11364 HA MET M 357 -13.299 -27.457-144.795 1.00 0.00 H
+ATOM 11365 1HB MET M 357 -12.181 -28.470-146.867 1.00 0.00 H
+ATOM 11366 2HB MET M 357 -11.171 -27.468-145.834 1.00 0.00 H
+ATOM 11367 1HG MET M 357 -10.270 -29.546-144.776 1.00 0.00 H
+ATOM 11368 2HG MET M 357 -11.211 -30.497-145.927 1.00 0.00 H
+ATOM 11369 1HE MET M 357 -7.809 -27.620-147.190 1.00 0.00 H
+ATOM 11370 2HE MET M 357 -9.405 -27.054-146.639 1.00 0.00 H
+ATOM 11371 3HE MET M 357 -8.307 -27.869-145.499 1.00 0.00 H
+ATOM 11372 N ASP M 358 -14.611 -29.280-146.177 1.00109.58 N
+ATOM 11373 CA ASP M 358 -15.696 -30.182-146.563 1.00103.48 C
+ATOM 11374 C ASP M 358 -15.141 -31.467-147.186 1.00 94.34 C
+ATOM 11375 O ASP M 358 -15.352 -31.777-148.358 1.00104.19 O
+ATOM 11376 CB ASP M 358 -16.655 -29.472-147.510 1.00115.00 C
+ATOM 11377 CG ASP M 358 -17.417 -28.345-146.835 1.00129.88 C
+ATOM 11378 OD1 ASP M 358 -16.931 -27.820-145.810 1.00137.46 O
+ATOM 11379 OD2 ASP M 358 -18.504 -27.981-147.333 1.00130.44 O
+ATOM 11380 H ASP M 358 -14.423 -28.466-146.744 1.00 0.00 H
+ATOM 11381 HA ASP M 358 -16.240 -30.473-145.664 1.00 0.00 H
+ATOM 11382 1HB ASP M 358 -16.098 -29.063-148.353 1.00 0.00 H
+ATOM 11383 2HB ASP M 358 -17.372 -30.191-147.909 1.00 0.00 H
+ATOM 11384 N ARG M 359 -14.402 -32.215-146.368 1.00 81.30 N
+ATOM 11385 CA ARG M 359 -13.858 -33.517-146.746 1.00 77.82 C
+ATOM 11386 C ARG M 359 -13.960 -34.409-145.516 1.00 78.71 C
+ATOM 11387 O ARG M 359 -13.281 -34.159-144.517 1.00 89.06 O
+ATOM 11388 CB ARG M 359 -12.406 -33.411-147.219 1.00 90.15 C
+ATOM 11389 CG ARG M 359 -12.114 -32.286-148.208 1.00107.30 C
+ATOM 11390 CD ARG M 359 -11.713 -32.834-149.564 1.00119.38 C
+ATOM 11391 NE ARG M 359 -10.708 -33.884-149.450 1.00122.10 N
+ATOM 11392 CZ ARG M 359 -10.268 -34.610-150.472 1.00132.08 C
+ATOM 11393 NH1 ARG M 359 -10.744 -34.398-151.693 1.00138.69 N
+ATOM 11394 NH2 ARG M 359 -9.353 -35.549-150.273 1.00131.55 N
+ATOM 11395 H ARG M 359 -14.215 -31.853-145.444 1.00 0.00 H
+ATOM 11396 HA ARG M 359 -14.452 -33.915-147.569 1.00 0.00 H
+ATOM 11397 1HB ARG M 359 -11.754 -33.262-146.360 1.00 0.00 H
+ATOM 11398 2HB ARG M 359 -12.110 -34.345-147.697 1.00 0.00 H
+ATOM 11399 1HG ARG M 359 -13.005 -31.671-148.333 1.00 0.00 H
+ATOM 11400 2HG ARG M 359 -11.298 -31.670-147.828 1.00 0.00 H
+ATOM 11401 1HD ARG M 359 -12.588 -33.252-150.061 1.00 0.00 H
+ATOM 11402 2HD ARG M 359 -11.300 -32.031-150.173 1.00 0.00 H
+ATOM 11403 HE ARG M 359 -10.323 -34.069-148.533 1.00 0.00 H
+ATOM 11404 1HH1 ARG M 359 -11.442 -33.684-151.846 1.00 0.00 H
+ATOM 11405 2HH1 ARG M 359 -10.409 -34.951-152.469 1.00 0.00 H
+ATOM 11406 1HH2 ARG M 359 -8.990 -35.712-149.344 1.00 0.00 H
+ATOM 11407 2HH2 ARG M 359 -9.019 -36.100-151.049 1.00 0.00 H
+ATOM 11408 N SER M 360 -14.798 -35.439-145.577 1.00 72.52 N
+ATOM 11409 CA SER M 360 -15.110 -36.243-144.405 1.00 67.33 C
+ATOM 11410 C SER M 360 -14.695 -37.696-144.604 1.00 65.19 C
+ATOM 11411 O SER M 360 -14.273 -38.113-145.685 1.00 77.26 O
+ATOM 11412 CB SER M 360 -16.606 -36.170-144.067 1.00 79.34 C
+ATOM 11413 OG SER M 360 -16.972 -34.877-143.614 1.00 88.61 O
+ATOM 11414 H SER M 360 -15.229 -35.669-146.461 1.00 0.00 H
+ATOM 11415 HA SER M 360 -14.547 -35.851-143.557 1.00 0.00 H
+ATOM 11416 1HB SER M 360 -17.191 -36.424-144.950 1.00 0.00 H
+ATOM 11417 2HB SER M 360 -16.841 -36.904-143.297 1.00 0.00 H
+ATOM 11418 HG SER M 360 -16.168 -34.353-143.632 1.00 0.00 H
+ATOM 11419 N ALA M 361 -14.831 -38.461-143.523 1.00 66.23 N
+ATOM 11420 CA ALA M 361 -14.473 -39.872-143.485 1.00 69.03 C
+ATOM 11421 C ALA M 361 -15.136 -40.497-142.264 1.00 79.42 C
+ATOM 11422 O ALA M 361 -15.657 -39.799-141.389 1.00 92.34 O
+ATOM 11423 CB ALA M 361 -12.955 -40.070-143.443 1.00 71.48 C
+ATOM 11424 H ALA M 361 -15.204 -38.026-142.692 1.00 0.00 H
+ATOM 11425 HA ALA M 361 -14.854 -40.343-144.392 1.00 0.00 H
+ATOM 11426 1HB ALA M 361 -12.728 -41.136-143.415 1.00 0.00 H
+ATOM 11427 2HB ALA M 361 -12.505 -39.626-144.331 1.00 0.00 H
+ATOM 11428 3HB ALA M 361 -12.550 -39.590-142.553 1.00 0.00 H
+ATOM 11429 N MET M 362 -15.087 -41.826-142.206 1.00 71.29 N
+ATOM 11430 CA MET M 362 -15.813 -42.586-141.191 1.00 71.12 C
+ATOM 11431 C MET M 362 -15.000 -43.808-140.801 1.00 76.81 C
+ATOM 11432 O MET M 362 -14.673 -44.633-141.660 1.00 93.17 O
+ATOM 11433 CB MET M 362 -17.184 -42.992-141.724 1.00 90.19 C
+ATOM 11434 CG MET M 362 -17.756 -44.261-141.137 1.00 94.97 C
+ATOM 11435 SD MET M 362 -18.311 -44.069-139.452 1.00 84.33 S
+ATOM 11436 CE MET M 362 -19.314 -45.543-139.294 1.00 85.63 C
+ATOM 11437 H MET M 362 -14.529 -42.322-142.887 1.00 0.00 H
+ATOM 11438 HA MET M 362 -15.949 -41.952-140.315 1.00 0.00 H
+ATOM 11439 1HB MET M 362 -17.900 -42.194-141.532 1.00 0.00 H
+ATOM 11440 2HB MET M 362 -17.128 -43.129-142.805 1.00 0.00 H
+ATOM 11441 1HG MET M 362 -18.603 -44.590-141.738 1.00 0.00 H
+ATOM 11442 2HG MET M 362 -16.999 -45.045-141.157 1.00 0.00 H
+ATOM 11443 1HE MET M 362 -19.743 -45.585-138.293 1.00 0.00 H
+ATOM 11444 2HE MET M 362 -20.116 -45.519-140.033 1.00 0.00 H
+ATOM 11445 3HE MET M 362 -18.694 -46.425-139.460 1.00 0.00 H
+ATOM 11446 N CYS M 363 -14.683 -43.931-139.514 1.00 74.97 N
+ATOM 11447 CA CYS M 363 -13.804 -44.985-139.030 1.00 78.63 C
+ATOM 11448 C CYS M 363 -14.417 -45.679-137.822 1.00 78.72 C
+ATOM 11449 O CYS M 363 -15.095 -45.056-137.001 1.00 76.38 O
+ATOM 11450 CB CYS M 363 -12.421 -44.431-138.667 1.00 83.47 C
+ATOM 11451 SG CYS M 363 -11.260 -44.341-140.051 1.00105.17 S
+ATOM 11452 H CYS M 363 -15.067 -43.269-138.855 1.00 0.00 H
+ATOM 11453 HA CYS M 363 -13.680 -45.723-139.823 1.00 0.00 H
+ATOM 11454 1HB CYS M 363 -12.528 -43.427-138.256 1.00 0.00 H
+ATOM 11455 2HB CYS M 363 -11.971 -45.054-137.895 1.00 0.00 H
+ATOM 11456 N ALA M 364 -14.165 -46.981-137.720 1.00 75.13 N
+ATOM 11457 CA ALA M 364 -14.669 -47.803-136.629 1.00 65.80 C
+ATOM 11458 C ALA M 364 -13.505 -48.277-135.770 1.00 67.15 C
+ATOM 11459 O ALA M 364 -12.515 -48.799-136.290 1.00 74.89 O
+ATOM 11460 CB ALA M 364 -15.460 -49.000-137.162 1.00 60.51 C
+ATOM 11461 H ALA M 364 -13.597 -47.409-138.437 1.00 0.00 H
+ATOM 11462 HA ALA M 364 -15.335 -47.189-136.022 1.00 0.00 H
+ATOM 11463 1HB ALA M 364 -15.825 -49.597-136.326 1.00 0.00 H
+ATOM 11464 2HB ALA M 364 -16.306 -48.644-137.750 1.00 0.00 H
+ATOM 11465 3HB ALA M 364 -14.814 -49.612-137.790 1.00 0.00 H
+ATOM 11466 N PHE M 365 -13.631 -48.094-134.459 1.00 74.82 N
+ATOM 11467 CA PHE M 365 -12.598 -48.474-133.498 1.00 67.58 C
+ATOM 11468 C PHE M 365 -13.221 -49.381-132.446 1.00 68.08 C
+ATOM 11469 O PHE M 365 -13.858 -48.886-131.499 1.00 73.99 O
+ATOM 11470 CB PHE M 365 -11.975 -47.248-132.840 1.00 60.17 C
+ATOM 11471 CG PHE M 365 -11.308 -46.308-133.803 1.00 68.76 C
+ATOM 11472 CD1 PHE M 365 -12.028 -45.300-134.419 1.00 73.03 C
+ATOM 11473 CD2 PHE M 365 -9.954 -46.418-134.074 1.00 76.53 C
+ATOM 11474 CE1 PHE M 365 -11.413 -44.427-135.299 1.00 75.96 C
+ATOM 11475 CE2 PHE M 365 -9.334 -45.548-134.952 1.00 81.08 C
+ATOM 11476 CZ PHE M 365 -10.066 -44.553-135.565 1.00 79.85 C
+ATOM 11477 H PHE M 365 -14.485 -47.672-134.123 1.00 0.00 H
+ATOM 11478 HA PHE M 365 -11.812 -49.013-134.029 1.00 0.00 H
+ATOM 11479 1HB PHE M 365 -12.744 -46.693-132.304 1.00 0.00 H
+ATOM 11480 2HB PHE M 365 -11.232 -47.565-132.109 1.00 0.00 H
+ATOM 11481 HD1 PHE M 365 -13.092 -45.197-134.204 1.00 0.00 H
+ATOM 11482 HD2 PHE M 365 -9.377 -47.206-133.589 1.00 0.00 H
+ATOM 11483 HE1 PHE M 365 -11.994 -43.641-135.781 1.00 0.00 H
+ATOM 11484 HE2 PHE M 365 -8.269 -45.648-135.161 1.00 0.00 H
+ATOM 11485 HZ PHE M 365 -9.580 -43.869-136.259 1.00 0.00 H
+ATOM 11486 N PRO M 366 -13.078 -50.698-132.574 1.00 62.26 N
+ATOM 11487 CA PRO M 366 -13.571 -51.595-131.522 1.00 69.35 C
+ATOM 11488 C PRO M 366 -12.868 -51.310-130.202 1.00 73.70 C
+ATOM 11489 O PRO M 366 -11.640 -51.216-130.138 1.00 72.77 O
+ATOM 11490 CB PRO M 366 -13.234 -52.992-132.059 1.00 72.28 C
+ATOM 11491 CG PRO M 366 -13.108 -52.811-133.527 1.00 71.74 C
+ATOM 11492 CD PRO M 366 -12.529 -51.440-133.718 1.00 66.19 C
+ATOM 11493 HA PRO M 366 -14.659 -51.468-131.419 1.00 0.00 H
+ATOM 11494 1HB PRO M 366 -12.305 -53.359-131.597 1.00 0.00 H
+ATOM 11495 2HB PRO M 366 -14.030 -53.701-131.788 1.00 0.00 H
+ATOM 11496 1HG PRO M 366 -12.463 -53.594-133.952 1.00 0.00 H
+ATOM 11497 2HG PRO M 366 -14.092 -52.914-134.008 1.00 0.00 H
+ATOM 11498 1HD PRO M 366 -11.431 -51.497-133.682 1.00 0.00 H
+ATOM 11499 2HD PRO M 366 -12.865 -51.031-134.682 1.00 0.00 H
+ATOM 11500 N ILE M 367 -13.664 -51.170-129.140 1.00 74.06 N
+ATOM 11501 CA ILE M 367 -13.120 -50.705-127.868 1.00 69.12 C
+ATOM 11502 C ILE M 367 -12.145 -51.725-127.293 1.00 69.34 C
+ATOM 11503 O ILE M 367 -11.125 -51.358-126.693 1.00 79.22 O
+ATOM 11504 CB ILE M 367 -14.244 -50.435-126.851 1.00 62.51 C
+ATOM 11505 CG1 ILE M 367 -15.149 -49.302-127.344 1.00 51.27 C
+ATOM 11506 CG2 ILE M 367 -13.659 -50.099-125.488 1.00 71.66 C
+ATOM 11507 CD1 ILE M 367 -14.426 -47.992-127.558 1.00 0.00 C
+ATOM 11508 H ILE M 367 -14.649 -51.384-129.205 1.00 0.00 H
+ATOM 11509 HA ILE M 367 -12.539 -49.802-128.050 1.00 0.00 H
+ATOM 11510 HB ILE M 367 -14.871 -51.321-126.759 1.00 0.00 H
+ATOM 11511 1HG1 ILE M 367 -15.615 -49.592-128.285 1.00 0.00 H
+ATOM 11512 2HG1 ILE M 367 -15.949 -49.135-126.622 1.00 0.00 H
+ATOM 11513 1HG2 ILE M 367 -14.468 -49.910-124.782 1.00 0.00 H
+ATOM 11514 2HG2 ILE M 367 -13.057 -50.935-125.135 1.00 0.00 H
+ATOM 11515 3HG2 ILE M 367 -13.034 -49.210-125.570 1.00 0.00 H
+ATOM 11516 1HD1 ILE M 367 -15.132 -47.239-127.906 1.00 0.00 H
+ATOM 11517 2HD1 ILE M 367 -13.980 -47.665-126.618 1.00 0.00 H
+ATOM 11518 3HD1 ILE M 367 -13.643 -48.127-128.303 1.00 0.00 H
+ATOM 11519 N LYS M 368 -12.418 -53.018-127.490 1.00 71.14 N
+ATOM 11520 CA LYS M 368 -11.489 -54.034-127.005 1.00 78.54 C
+ATOM 11521 C LYS M 368 -10.136 -53.914-127.697 1.00 82.53 C
+ATOM 11522 O LYS M 368 -9.086 -54.120-127.072 1.00 87.45 O
+ATOM 11523 CB LYS M 368 -12.079 -55.432-127.195 1.00 75.24 C
+ATOM 11524 CG LYS M 368 -12.557 -55.746-128.598 1.00 81.28 C
+ATOM 11525 CD LYS M 368 -12.518 -57.248-128.855 1.00 95.18 C
+ATOM 11526 CE LYS M 368 -13.209 -57.608-130.161 1.00102.02 C
+ATOM 11527 NZ LYS M 368 -12.868 -58.983-130.621 1.00105.33 N
+ATOM 11528 H LYS M 368 -13.258 -53.308-127.970 1.00 0.00 H
+ATOM 11529 HA LYS M 368 -11.320 -53.868-125.940 1.00 0.00 H
+ATOM 11530 1HB LYS M 368 -11.333 -56.181-126.929 1.00 0.00 H
+ATOM 11531 2HB LYS M 368 -12.928 -55.563-126.524 1.00 0.00 H
+ATOM 11532 1HG LYS M 368 -13.578 -55.384-128.724 1.00 0.00 H
+ATOM 11533 2HG LYS M 368 -11.919 -55.239-129.321 1.00 0.00 H
+ATOM 11534 1HD LYS M 368 -11.481 -57.583-128.899 1.00 0.00 H
+ATOM 11535 2HD LYS M 368 -13.015 -57.770-128.038 1.00 0.00 H
+ATOM 11536 1HE LYS M 368 -14.288 -57.542-130.031 1.00 0.00 H
+ATOM 11537 2HE LYS M 368 -12.915 -56.900-130.936 1.00 0.00 H
+ATOM 11538 1HZ LYS M 368 -13.348 -59.177-131.489 1.00 0.00 H
+ATOM 11539 2HZ LYS M 368 -11.870 -59.053-130.765 1.00 0.00 H
+ATOM 11540 3HZ LYS M 368 -13.154 -59.653-129.922 1.00 0.00 H
+ATOM 11541 N TYR M 369 -10.139 -53.557-128.985 1.00 83.70 N
+ATOM 11542 CA TYR M 369 -8.884 -53.325-129.690 1.00 84.92 C
+ATOM 11543 C TYR M 369 -8.188 -52.067-129.186 1.00 77.01 C
+ATOM 11544 O TYR M 369 -6.954 -51.993-129.204 1.00 87.87 O
+ATOM 11545 CB TYR M 369 -9.132 -53.233-131.198 1.00 91.63 C
+ATOM 11546 CG TYR M 369 -9.348 -54.569-131.881 1.00110.97 C
+ATOM 11547 CD1 TYR M 369 -8.745 -54.853-133.099 1.00121.33 C
+ATOM 11548 CD2 TYR M 369 -10.154 -55.547-131.310 1.00124.69 C
+ATOM 11549 CE1 TYR M 369 -8.940 -56.072-133.727 1.00131.52 C
+ATOM 11550 CE2 TYR M 369 -10.353 -56.767-131.930 1.00131.30 C
+ATOM 11551 CZ TYR M 369 -9.745 -57.025-133.138 1.00133.18 C
+ATOM 11552 OH TYR M 369 -9.943 -58.239-133.756 1.00138.64 O
+ATOM 11553 H TYR M 369 -11.011 -53.444-129.482 1.00 0.00 H
+ATOM 11554 HA TYR M 369 -8.217 -54.165-129.495 1.00 0.00 H
+ATOM 11555 1HB TYR M 369 -10.012 -52.616-131.385 1.00 0.00 H
+ATOM 11556 2HB TYR M 369 -8.283 -52.747-131.677 1.00 0.00 H
+ATOM 11557 HD1 TYR M 369 -8.106 -54.111-133.577 1.00 0.00 H
+ATOM 11558 HD2 TYR M 369 -10.645 -55.359-130.355 1.00 0.00 H
+ATOM 11559 HE1 TYR M 369 -8.458 -56.276-134.683 1.00 0.00 H
+ATOM 11560 HE2 TYR M 369 -10.989 -57.519-131.462 1.00 0.00 H
+ATOM 11561 HH TYR M 369 -10.524 -58.781-133.216 1.00 0.00 H
+ATOM 11562 N VAL M 370 -8.956 -51.074-128.730 1.00 66.40 N
+ATOM 11563 CA VAL M 370 -8.357 -49.879-128.143 1.00 65.21 C
+ATOM 11564 C VAL M 370 -7.642 -50.229-126.845 1.00 69.57 C
+ATOM 11565 O VAL M 370 -6.482 -49.855-126.633 1.00 70.03 O
+ATOM 11566 CB VAL M 370 -9.429 -48.797-127.917 1.00 65.67 C
+ATOM 11567 CG1 VAL M 370 -8.801 -47.538-127.341 1.00 56.13 C
+ATOM 11568 CG2 VAL M 370 -10.164 -48.494-129.214 1.00 63.20 C
+ATOM 11569 H VAL M 370 -9.962 -51.142-128.788 1.00 0.00 H
+ATOM 11570 HA VAL M 370 -7.609 -49.491-128.836 1.00 0.00 H
+ATOM 11571 HB VAL M 370 -10.143 -49.156-127.176 1.00 0.00 H
+ATOM 11572 1HG1 VAL M 370 -9.573 -46.784-127.187 1.00 0.00 H
+ATOM 11573 2HG1 VAL M 370 -8.327 -47.771-126.388 1.00 0.00 H
+ATOM 11574 3HG1 VAL M 370 -8.053 -47.154-128.035 1.00 0.00 H
+ATOM 11575 1HG2 VAL M 370 -10.918 -47.728-129.034 1.00 0.00 H
+ATOM 11576 2HG2 VAL M 370 -9.454 -48.137-129.960 1.00 0.00 H
+ATOM 11577 3HG2 VAL M 370 -10.648 -49.400-129.578 1.00 0.00 H
+ATOM 11578 N ASN M 371 -8.330 -50.954-125.958 1.00 69.35 N
+ATOM 11579 CA ASN M 371 -7.729 -51.359-124.692 1.00 71.05 C
+ATOM 11580 C ASN M 371 -6.487 -52.211-124.923 1.00 81.52 C
+ATOM 11581 O ASN M 371 -5.437 -51.979-124.311 1.00 91.79 O
+ATOM 11582 CB ASN M 371 -8.754 -52.118-123.848 1.00 80.15 C
+ATOM 11583 CG ASN M 371 -9.976 -51.278-123.515 1.00 80.09 C
+ATOM 11584 OD1 ASN M 371 -9.865 -50.089-123.214 1.00 73.20 O
+ATOM 11585 ND2 ASN M 371 -11.151 -51.900-123.558 1.00 74.57 N
+ATOM 11586 H ASN M 371 -9.280 -51.229-126.162 1.00 0.00 H
+ATOM 11587 HA ASN M 371 -7.421 -50.462-124.152 1.00 0.00 H
+ATOM 11588 1HB ASN M 371 -9.077 -53.011-124.384 1.00 0.00 H
+ATOM 11589 2HB ASN M 371 -8.289 -52.445-122.918 1.00 0.00 H
+ATOM 11590 1HD2 ASN M 371 -11.991 -51.398-123.348 1.00 0.00 H
+ATOM 11591 2HD2 ASN M 371 -11.195 -52.869-123.800 1.00 0.00 H
+ATOM 11592 N ASP M 372 -6.589 -53.206-125.811 1.00 92.79 N
+ATOM 11593 CA ASP M 372 -5.426 -54.029-126.130 1.00111.98 C
+ATOM 11594 C ASP M 372 -4.290 -53.201-126.718 1.00107.18 C
+ATOM 11595 O ASP M 372 -3.115 -53.498-126.473 1.00121.63 O
+ATOM 11596 CB ASP M 372 -5.823 -55.154-127.087 1.00132.50 C
+ATOM 11597 CG ASP M 372 -6.510 -56.307-126.376 1.00153.74 C
+ATOM 11598 OD1 ASP M 372 -5.853 -57.348-126.159 1.00165.37 O
+ATOM 11599 OD2 ASP M 372 -7.700 -56.165-126.022 1.00155.12 O
+ATOM 11600 H ASP M 372 -7.468 -53.398-126.269 1.00 0.00 H
+ATOM 11601 HA ASP M 372 -5.050 -54.470-125.206 1.00 0.00 H
+ATOM 11602 1HB ASP M 372 -6.494 -54.762-127.852 1.00 0.00 H
+ATOM 11603 2HB ASP M 372 -4.934 -55.532-127.594 1.00 0.00 H
+ATOM 11604 N PHE M 373 -4.614 -52.160-127.488 1.00 96.46 N
+ATOM 11605 CA PHE M 373 -3.570 -51.278-127.998 1.00 93.25 C
+ATOM 11606 C PHE M 373 -2.912 -50.489-126.875 1.00 91.11 C
+ATOM 11607 O PHE M 373 -1.708 -50.215-126.935 1.00 99.67 O
+ATOM 11608 CB PHE M 373 -4.144 -50.329-129.052 1.00 97.18 C
+ATOM 11609 CG PHE M 373 -3.105 -49.722-129.955 1.00 98.98 C
+ATOM 11610 CD1 PHE M 373 -2.830 -50.283-131.193 1.00117.09 C
+ATOM 11611 CD2 PHE M 373 -2.407 -48.589-129.569 1.00 89.95 C
+ATOM 11612 CE1 PHE M 373 -1.876 -49.727-132.028 1.00128.46 C
+ATOM 11613 CE2 PHE M 373 -1.454 -48.027-130.397 1.00105.56 C
+ATOM 11614 CZ PHE M 373 -1.188 -48.596-131.629 1.00126.37 C
+ATOM 11615 H PHE M 373 -5.577 -51.971-127.726 1.00 0.00 H
+ATOM 11616 HA PHE M 373 -2.796 -51.890-128.463 1.00 0.00 H
+ATOM 11617 1HB PHE M 373 -4.861 -50.865-129.672 1.00 0.00 H
+ATOM 11618 2HB PHE M 373 -4.680 -49.519-128.559 1.00 0.00 H
+ATOM 11619 HD1 PHE M 373 -3.376 -51.173-131.507 1.00 0.00 H
+ATOM 11620 HD2 PHE M 373 -2.617 -48.141-128.597 1.00 0.00 H
+ATOM 11621 HE1 PHE M 373 -1.670 -50.181-132.997 1.00 0.00 H
+ATOM 11622 HE2 PHE M 373 -0.911 -47.137-130.080 1.00 0.00 H
+ATOM 11623 HZ PHE M 373 -0.437 -48.155-132.283 1.00 0.00 H
+ATOM 11624 N PHE M 374 -3.680 -50.115-125.849 1.00 94.93 N
+ATOM 11625 CA PHE M 374 -3.087 -49.468-124.682 1.00 93.42 C
+ATOM 11626 C PHE M 374 -2.166 -50.417-123.928 1.00101.02 C
+ATOM 11627 O PHE M 374 -1.092 -50.013-123.466 1.00104.64 O
+ATOM 11628 CB PHE M 374 -4.181 -48.953-123.749 1.00 87.90 C
+ATOM 11629 CG PHE M 374 -4.718 -47.605-124.123 1.00 84.57 C
+ATOM 11630 CD1 PHE M 374 -6.008 -47.467-124.599 1.00 76.81 C
+ATOM 11631 CD2 PHE M 374 -3.939 -46.470-123.980 1.00 87.50 C
+ATOM 11632 CE1 PHE M 374 -6.508 -46.226-124.934 1.00 71.14 C
+ATOM 11633 CE2 PHE M 374 -4.434 -45.227-124.315 1.00 84.01 C
+ATOM 11634 CZ PHE M 374 -5.720 -45.106-124.794 1.00 76.40 C
+ATOM 11635 H PHE M 374 -4.677 -50.275-125.869 1.00 0.00 H
+ATOM 11636 HA PHE M 374 -2.489 -48.621-125.022 1.00 0.00 H
+ATOM 11637 1HB PHE M 374 -5.012 -49.657-123.740 1.00 0.00 H
+ATOM 11638 2HB PHE M 374 -3.793 -48.892-122.733 1.00 0.00 H
+ATOM 11639 HD1 PHE M 374 -6.633 -48.354-124.708 1.00 0.00 H
+ATOM 11640 HD2 PHE M 374 -2.921 -46.567-123.601 1.00 0.00 H
+ATOM 11641 HE1 PHE M 374 -7.527 -46.133-125.309 1.00 0.00 H
+ATOM 11642 HE2 PHE M 374 -3.810 -44.341-124.202 1.00 0.00 H
+ATOM 11643 HZ PHE M 374 -6.112 -44.126-125.063 1.00 0.00 H
+ATOM 11644 N ASN M 375 -2.565 -51.681-123.793 1.00107.04 N
+ATOM 11645 CA ASN M 375 -1.846 -52.612-122.933 1.00115.53 C
+ATOM 11646 C ASN M 375 -0.672 -53.303-123.615 1.00122.66 C
+ATOM 11647 O ASN M 375 0.234 -53.772-122.916 1.00141.35 O
+ATOM 11648 CB ASN M 375 -2.812 -53.668-122.384 1.00123.31 C
+ATOM 11649 CG ASN M 375 -3.805 -53.091-121.387 1.00131.86 C
+ATOM 11650 OD1 ASN M 375 -3.475 -52.192-120.611 1.00132.72 O
+ATOM 11651 ND2 ASN M 375 -5.030 -53.604-121.407 1.00133.98 N
+ATOM 11652 H ASN M 375 -3.380 -52.004-124.294 1.00 0.00 H
+ATOM 11653 HA ASN M 375 -1.420 -52.054-122.098 1.00 0.00 H
+ATOM 11654 1HB ASN M 375 -3.364 -54.120-123.209 1.00 0.00 H
+ATOM 11655 2HB ASN M 375 -2.245 -54.461-121.896 1.00 0.00 H
+ATOM 11656 1HD2 ASN M 375 -5.725 -53.263-120.774 1.00 0.00 H
+ATOM 11657 2HD2 ASN M 375 -5.257 -54.330-122.055 1.00 0.00 H
+ATOM 11658 N LYS M 376 -0.649 -53.376-124.944 1.00115.41 N
+ATOM 11659 CA LYS M 376 0.390 -54.123-125.650 1.00121.84 C
+ATOM 11660 C LYS M 376 1.441 -53.250-126.317 1.00130.01 C
+ATOM 11661 O LYS M 376 2.631 -53.573-126.251 1.00137.79 O
+ATOM 11662 CB LYS M 376 -0.239 -55.044-126.703 1.00116.66 C
+ATOM 11663 CG LYS M 376 -0.972 -56.235-126.110 1.00110.49 C
+ATOM 11664 CD LYS M 376 -1.214 -57.325-127.139 1.00103.93 C
+ATOM 11665 CE LYS M 376 -1.779 -58.573-126.476 1.00111.47 C
+ATOM 11666 NZ LYS M 376 -1.919 -59.714-127.421 1.00115.66 N
+ATOM 11667 H LYS M 376 -1.365 -52.905-125.478 1.00 0.00 H
+ATOM 11668 HA LYS M 376 0.928 -54.735-124.926 1.00 0.00 H
+ATOM 11669 1HB LYS M 376 -0.945 -54.475-127.309 1.00 0.00 H
+ATOM 11670 2HB LYS M 376 0.538 -55.418-127.370 1.00 0.00 H
+ATOM 11671 1HG LYS M 376 -0.385 -56.653-125.291 1.00 0.00 H
+ATOM 11672 2HG LYS M 376 -1.934 -55.910-125.715 1.00 0.00 H
+ATOM 11673 1HD LYS M 376 -1.917 -56.965-127.892 1.00 0.00 H
+ATOM 11674 2HD LYS M 376 -0.275 -57.574-127.633 1.00 0.00 H
+ATOM 11675 1HE LYS M 376 -1.125 -58.880-125.661 1.00 0.00 H
+ATOM 11676 2HE LYS M 376 -2.761 -58.351-126.059 1.00 0.00 H
+ATOM 11677 1HZ LYS M 376 -2.297 -60.513-126.932 1.00 0.00 H
+ATOM 11678 2HZ LYS M 376 -2.542 -59.455-128.173 1.00 0.00 H
+ATOM 11679 3HZ LYS M 376 -1.014 -59.950-127.801 1.00 0.00 H
+ATOM 11680 N ILE M 377 1.037 -52.152-126.962 1.00131.45 N
+ATOM 11681 CA ILE M 377 1.983 -51.326-127.706 1.00137.35 C
+ATOM 11682 C ILE M 377 2.994 -50.649-126.783 1.00140.49 C
+ATOM 11683 O ILE M 377 4.105 -50.320-127.220 1.00139.29 O
+ATOM 11684 CB ILE M 377 1.242 -50.254-128.526 1.00127.13 C
+ATOM 11685 CG1 ILE M 377 0.348 -50.911-129.580 1.00118.65 C
+ATOM 11686 CG2 ILE M 377 2.234 -49.305-129.180 1.00133.14 C
+ATOM 11687 CD1 ILE M 377 1.100 -51.781-130.562 1.00 0.00 C
+ATOM 11688 H ILE M 377 0.063 -51.885-126.938 1.00 0.00 H
+ATOM 11689 HA ILE M 377 2.570 -51.973-128.357 1.00 0.00 H
+ATOM 11690 HB ILE M 377 0.586 -49.683-127.869 1.00 0.00 H
+ATOM 11691 1HG1 ILE M 377 -0.405 -51.526-129.088 1.00 0.00 H
+ATOM 11692 2HG1 ILE M 377 -0.178 -50.140-130.144 1.00 0.00 H
+ATOM 11693 1HG2 ILE M 377 1.693 -48.554-129.756 1.00 0.00 H
+ATOM 11694 2HG2 ILE M 377 2.828 -48.813-128.411 1.00 0.00 H
+ATOM 11695 3HG2 ILE M 377 2.891 -49.867-129.844 1.00 0.00 H
+ATOM 11696 1HD1 ILE M 377 0.400 -52.211-131.278 1.00 0.00 H
+ATOM 11697 2HD1 ILE M 377 1.837 -51.177-131.093 1.00 0.00 H
+ATOM 11698 3HD1 ILE M 377 1.607 -52.582-130.025 1.00 0.00 H
+ATOM 11699 N VAL M 378 2.649 -50.478-125.504 1.00141.59 N
+ATOM 11700 CA VAL M 378 3.532 -49.819-124.546 1.00148.08 C
+ATOM 11701 C VAL M 378 4.910 -50.470-124.555 1.00155.02 C
+ATOM 11702 O VAL M 378 5.044 -51.693-124.444 1.00152.22 O
+ATOM 11703 CB VAL M 378 2.896 -49.841-123.143 1.00141.34 C
+ATOM 11704 CG1 VAL M 378 2.502 -51.257-122.745 1.00141.65 C
+ATOM 11705 CG2 VAL M 378 3.851 -49.255-122.115 1.00143.65 C
+ATOM 11706 H VAL M 378 1.750 -50.816-125.192 1.00 0.00 H
+ATOM 11707 HA VAL M 378 3.667 -48.782-124.856 1.00 0.00 H
+ATOM 11708 HB VAL M 378 1.980 -49.249-123.160 1.00 0.00 H
+ATOM 11709 1HG1 VAL M 378 2.055 -51.245-121.751 1.00 0.00 H
+ATOM 11710 2HG1 VAL M 378 1.780 -51.649-123.462 1.00 0.00 H
+ATOM 11711 3HG1 VAL M 378 3.388 -51.892-122.736 1.00 0.00 H
+ATOM 11712 1HG2 VAL M 378 3.385 -49.278-121.131 1.00 0.00 H
+ATOM 11713 2HG2 VAL M 378 4.770 -49.842-122.096 1.00 0.00 H
+ATOM 11714 3HG2 VAL M 378 4.085 -48.224-122.381 1.00 0.00 H
+ATOM 11715 N ASN M 379 5.943 -49.641-124.716 1.00160.41 N
+ATOM 11716 CA ASN M 379 7.330 -50.085-124.646 1.00163.24 C
+ATOM 11717 C ASN M 379 8.216 -48.947-124.150 1.00167.76 C
+ATOM 11718 O ASN M 379 7.755 -48.082-123.398 1.00168.36 O
+ATOM 11719 CB ASN M 379 7.810 -50.598-126.008 1.00163.25 C
+ATOM 11720 CG ASN M 379 7.818 -49.518-127.071 1.00160.69 C
+ATOM 11721 OD1 ASN M 379 7.067 -48.550-126.991 1.00158.91 O
+ATOM 11722 ND2 ASN M 379 8.676 -49.678-128.072 1.00165.25 N
+ATOM 11723 H ASN M 379 5.747 -48.666-124.894 1.00 0.00 H
+ATOM 11724 HA ASN M 379 7.396 -50.903-123.927 1.00 0.00 H
+ATOM 11725 1HB ASN M 379 8.819 -51.001-125.910 1.00 0.00 H
+ATOM 11726 2HB ASN M 379 7.163 -51.411-126.339 1.00 0.00 H
+ATOM 11727 1HD2 ASN M 379 8.725 -48.996-128.803 1.00 0.00 H
+ATOM 11728 2HD2 ASN M 379 9.273 -50.480-128.096 1.00 0.00 H
+ATOM 11729 N LYS M 380 9.486 -48.934-124.559 1.00163.58 N
+ATOM 11730 CA LYS M 380 10.446 -47.935-124.106 1.00160.07 C
+ATOM 11731 C LYS M 380 10.710 -46.856-125.153 1.00162.67 C
+ATOM 11732 O LYS M 380 11.834 -46.352-125.254 1.00170.98 O
+ATOM 11733 CB LYS M 380 11.761 -48.611-123.716 1.00162.59 C
+ATOM 11734 CG LYS M 380 11.654 -49.557-122.527 1.00 0.00 C
+ATOM 11735 CD LYS M 380 13.007 -50.155-122.173 1.00 0.00 C
+ATOM 11736 CE LYS M 380 12.903 -51.095-120.981 1.00 0.00 C
+ATOM 11737 NZ LYS M 380 14.215 -51.708-120.639 1.00 0.00 N
+ATOM 11738 H LYS M 380 9.787 -49.647-125.208 1.00 0.00 H
+ATOM 11739 HA LYS M 380 10.029 -47.424-123.237 1.00 0.00 H
+ATOM 11740 1HB LYS M 380 12.143 -49.182-124.564 1.00 0.00 H
+ATOM 11741 2HB LYS M 380 12.503 -47.851-123.473 1.00 0.00 H
+ATOM 11742 1HG LYS M 380 11.269 -49.014-121.663 1.00 0.00 H
+ATOM 11743 2HG LYS M 380 10.961 -50.363-122.765 1.00 0.00 H
+ATOM 11744 1HD LYS M 380 13.396 -50.709-123.029 1.00 0.00 H
+ATOM 11745 2HD LYS M 380 13.707 -49.355-121.932 1.00 0.00 H
+ATOM 11746 1HE LYS M 380 12.536 -50.546-120.116 1.00 0.00 H
+ATOM 11747 2HE LYS M 380 12.193 -51.891-121.206 1.00 0.00 H
+ATOM 11748 1HZ LYS M 380 14.104 -52.323-119.846 1.00 0.00 H
+ATOM 11749 2HZ LYS M 380 14.557 -52.236-121.429 1.00 0.00 H
+ATOM 11750 3HZ LYS M 380 14.877 -50.980-120.409 1.00 0.00 H
+ATOM 11751 N ASN M 381 9.694 -46.487-125.935 1.00152.52 N
+ATOM 11752 CA ASN M 381 9.864 -45.453-126.949 1.00148.94 C
+ATOM 11753 C ASN M 381 8.529 -44.829-127.338 1.00147.66 C
+ATOM 11754 O ASN M 381 8.476 -43.655-127.719 1.00149.85 O
+ATOM 11755 CB ASN M 381 10.565 -46.017-128.171 1.00148.91 C
+ATOM 11756 CG ASN M 381 10.953 -44.951-129.158 1.00 0.00 C
+ATOM 11757 OD1 ASN M 381 11.297 -43.827-128.774 1.00 0.00 O
+ATOM 11758 ND2 ASN M 381 10.903 -45.281-130.424 1.00 0.00 N
+ATOM 11759 H ASN M 381 8.791 -46.927-125.828 1.00 0.00 H
+ATOM 11760 HA ASN M 381 10.487 -44.660-126.533 1.00 0.00 H
+ATOM 11761 1HB ASN M 381 11.463 -46.553-127.861 1.00 0.00 H
+ATOM 11762 2HB ASN M 381 9.911 -46.734-128.667 1.00 0.00 H
+ATOM 11763 1HD2 ASN M 381 11.150 -44.611-131.125 1.00 0.00 H
+ATOM 11764 2HD2 ASN M 381 10.619 -46.201-130.689 1.00 0.00 H
+ATOM 11765 N ASN M 382 7.445 -45.603-127.248 1.00143.29 N
+ATOM 11766 CA ASN M 382 6.135 -45.084-127.628 1.00131.26 C
+ATOM 11767 C ASN M 382 5.522 -44.228-126.526 1.00131.27 C
+ATOM 11768 O ASN M 382 4.844 -43.237-126.818 1.00127.07 O
+ATOM 11769 CB ASN M 382 5.201 -46.222-127.996 1.00123.92 C
+ATOM 11770 CG ASN M 382 5.573 -46.878-129.297 1.00126.45 C
+ATOM 11771 OD1 ASN M 382 6.245 -46.273-130.140 1.00 0.00 O
+ATOM 11772 ND2 ASN M 382 5.149 -48.102-129.476 1.00 0.00 N
+ATOM 11773 H ASN M 382 7.520 -46.554-126.917 1.00 0.00 H
+ATOM 11774 HA ASN M 382 6.257 -44.444-128.503 1.00 0.00 H
+ATOM 11775 1HB ASN M 382 5.215 -46.975-127.206 1.00 0.00 H
+ATOM 11776 2HB ASN M 382 4.181 -45.846-128.071 1.00 0.00 H
+ATOM 11777 1HD2 ASN M 382 5.366 -48.588-130.323 1.00 0.00 H
+ATOM 11778 2HD2 ASN M 382 4.608 -48.553-128.767 1.00 0.00 H
+ATOM 11779 N VAL M 383 5.742 -44.591-125.257 1.00139.15 N
+ATOM 11780 CA VAL M 383 5.134 -43.865-124.147 1.00133.34 C
+ATOM 11781 C VAL M 383 5.935 -42.609-123.837 1.00125.63 C
+ATOM 11782 O VAL M 383 7.163 -42.568-123.962 1.00131.92 O
+ATOM 11783 CB VAL M 383 4.992 -44.762-122.901 1.00132.26 C
+ATOM 11784 CG1 VAL M 383 3.989 -45.868-123.158 1.00118.18 C
+ATOM 11785 CG2 VAL M 383 6.342 -45.345-122.496 1.00143.00 C
+ATOM 11786 H VAL M 383 6.339 -45.381-125.060 1.00 0.00 H
+ATOM 11787 HA VAL M 383 4.137 -43.541-124.450 1.00 0.00 H
+ATOM 11788 HB VAL M 383 4.601 -44.165-122.077 1.00 0.00 H
+ATOM 11789 1HG1 VAL M 383 3.900 -46.492-122.269 1.00 0.00 H
+ATOM 11790 2HG1 VAL M 383 3.018 -45.432-123.393 1.00 0.00 H
+ATOM 11791 3HG1 VAL M 383 4.326 -46.478-123.996 1.00 0.00 H
+ATOM 11792 1HG2 VAL M 383 6.217 -45.973-121.615 1.00 0.00 H
+ATOM 11793 2HG2 VAL M 383 6.741 -45.943-123.315 1.00 0.00 H
+ATOM 11794 3HG2 VAL M 383 7.035 -44.535-122.268 1.00 0.00 H
+ATOM 11795 N ARG M 384 5.215 -41.577-123.411 1.00114.37 N
+ATOM 11796 CA ARG M 384 5.750 -40.248-123.171 1.00114.30 C
+ATOM 11797 C ARG M 384 5.039 -39.684-121.951 1.00123.24 C
+ATOM 11798 O ARG M 384 4.023 -40.217-121.502 1.00131.62 O
+ATOM 11799 CB ARG M 384 5.537 -39.348-124.396 1.00114.12 C
+ATOM 11800 CG ARG M 384 6.358 -38.074-124.458 1.00107.23 C
+ATOM 11801 CD ARG M 384 6.097 -37.372-125.786 1.00115.15 C
+ATOM 11802 NE ARG M 384 6.677 -36.034-125.861 1.00130.28 N
+ATOM 11803 CZ ARG M 384 6.675 -35.281-126.958 1.00134.29 C
+ATOM 11804 NH1 ARG M 384 6.111 -35.730-128.073 1.00128.15 N
+ATOM 11805 NH2 ARG M 384 7.225 -34.074-126.941 1.00140.05 N
+ATOM 11806 H ARG M 384 4.233 -41.749-123.249 1.00 0.00 H
+ATOM 11807 HA ARG M 384 6.821 -40.334-122.986 1.00 0.00 H
+ATOM 11808 1HB ARG M 384 5.763 -39.908-125.302 1.00 0.00 H
+ATOM 11809 2HB ARG M 384 4.491 -39.047-124.449 1.00 0.00 H
+ATOM 11810 1HG ARG M 384 6.073 -37.417-123.636 1.00 0.00 H
+ATOM 11811 2HG ARG M 384 7.418 -38.319-124.377 1.00 0.00 H
+ATOM 11812 1HD ARG M 384 6.525 -37.959-126.598 1.00 0.00 H
+ATOM 11813 2HD ARG M 384 5.023 -37.271-125.939 1.00 0.00 H
+ATOM 11814 HE ARG M 384 7.106 -35.660-125.025 1.00 0.00 H
+ATOM 11815 1HH1 ARG M 384 5.682 -36.645-128.089 1.00 0.00 H
+ATOM 11816 2HH1 ARG M 384 6.110 -35.157-128.905 1.00 0.00 H
+ATOM 11817 1HH2 ARG M 384 7.648 -33.723-126.092 1.00 0.00 H
+ATOM 11818 2HH2 ARG M 384 7.221 -33.506-127.775 1.00 0.00 H
+ATOM 11819 N CYS M 385 5.577 -38.607-121.400 1.00123.36 N
+ATOM 11820 CA CYS M 385 4.886 -37.912-120.327 1.00122.97 C
+ATOM 11821 C CYS M 385 3.890 -36.923-120.919 1.00116.04 C
+ATOM 11822 O CYS M 385 4.046 -36.452-122.048 1.00120.68 O
+ATOM 11823 CB CYS M 385 5.874 -37.179-119.423 1.00135.82 C
+ATOM 11824 SG CYS M 385 6.319 -35.537-120.021 1.00160.75 S
+ATOM 11825 H CYS M 385 6.470 -38.258-121.718 1.00 0.00 H
+ATOM 11826 HA CYS M 385 4.351 -38.648-119.726 1.00 0.00 H
+ATOM 11827 1HB CYS M 385 5.447 -37.075-118.425 1.00 0.00 H
+ATOM 11828 2HB CYS M 385 6.786 -37.767-119.329 1.00 0.00 H
+ATOM 11829 N LEU M 386 2.856 -36.611-120.142 1.00107.18 N
+ATOM 11830 CA LEU M 386 1.854 -35.646-120.579 1.00101.86 C
+ATOM 11831 C LEU M 386 2.507 -34.274-120.702 1.00106.52 C
+ATOM 11832 O LEU M 386 2.950 -33.693-119.706 1.00102.68 O
+ATOM 11833 CB LEU M 386 0.683 -35.623-119.603 1.00 98.84 C
+ATOM 11834 CG LEU M 386 -0.632 -35.110-120.186 1.00 89.48 C
+ATOM 11835 CD1 LEU M 386 -0.883 -35.728-121.550 1.00 86.91 C
+ATOM 11836 CD2 LEU M 386 -1.784 -35.411-119.244 1.00 98.16 C
+ATOM 11837 H LEU M 386 2.758 -37.045-119.235 1.00 0.00 H
+ATOM 11838 HA LEU M 386 1.487 -35.948-121.559 1.00 0.00 H
+ATOM 11839 1HB LEU M 386 0.518 -36.634-119.235 1.00 0.00 H
+ATOM 11840 2HB LEU M 386 0.948 -34.989-118.757 1.00 0.00 H
+ATOM 11841 HG LEU M 386 -0.568 -34.032-120.334 1.00 0.00 H
+ATOM 11842 1HD1 LEU M 386 -1.824 -35.352-121.952 1.00 0.00 H
+ATOM 11843 2HD1 LEU M 386 -0.069 -35.463-122.225 1.00 0.00 H
+ATOM 11844 3HD1 LEU M 386 -0.937 -36.812-121.454 1.00 0.00 H
+ATOM 11845 1HD2 LEU M 386 -2.714 -35.038-119.675 1.00 0.00 H
+ATOM 11846 2HD2 LEU M 386 -1.860 -36.488-119.095 1.00 0.00 H
+ATOM 11847 3HD2 LEU M 386 -1.607 -34.923-118.285 1.00 0.00 H
+ATOM 11848 N GLN M 387 2.572 -33.755-121.930 1.00108.73 N
+ATOM 11849 CA GLN M 387 3.349 -32.548-122.189 1.00109.40 C
+ATOM 11850 C GLN M 387 2.672 -31.295-121.648 1.00106.96 C
+ATOM 11851 O GLN M 387 3.359 -30.359-121.229 1.00108.70 O
+ATOM 11852 CB GLN M 387 3.602 -32.406-123.689 1.00118.91 C
+ATOM 11853 CG GLN M 387 4.623 -33.386-124.253 1.00121.29 C
+ATOM 11854 CD GLN M 387 6.034 -33.124-123.754 1.00125.53 C
+ATOM 11855 OE1 GLN M 387 6.633 -32.092-124.062 1.00134.64 O
+ATOM 11856 NE2 GLN M 387 6.573 -34.061-122.983 1.00119.53 N
+ATOM 11857 H GLN M 387 2.081 -34.197-122.694 1.00 0.00 H
+ATOM 11858 HA GLN M 387 4.306 -32.636-121.675 1.00 0.00 H
+ATOM 11859 1HB GLN M 387 2.667 -32.550-124.231 1.00 0.00 H
+ATOM 11860 2HB GLN M 387 3.954 -31.397-123.905 1.00 0.00 H
+ATOM 11861 1HG GLN M 387 4.343 -34.397-123.957 1.00 0.00 H
+ATOM 11862 2HG GLN M 387 4.629 -33.303-125.340 1.00 0.00 H
+ATOM 11863 1HE2 GLN M 387 7.500 -33.943-122.625 1.00 0.00 H
+ATOM 11864 2HE2 GLN M 387 6.053 -34.886-122.760 1.00 0.00 H
+ATOM 11865 N HIS M 388 1.340 -31.246-121.653 1.00115.45 N
+ATOM 11866 CA HIS M 388 0.638 -30.063-121.172 1.00118.46 C
+ATOM 11867 C HIS M 388 0.320 -30.113-119.682 1.00114.61 C
+ATOM 11868 O HIS M 388 0.092 -29.058-119.079 1.00115.71 O
+ATOM 11869 CB HIS M 388 -0.654 -29.846-121.973 1.00113.58 C
+ATOM 11870 CG HIS M 388 -1.613 -30.994-121.909 1.00110.32 C
+ATOM 11871 ND1 HIS M 388 -2.700 -31.012-121.060 1.00108.72 N
+ATOM 11872 CD2 HIS M 388 -1.656 -32.158-122.599 1.00 98.39 C
+ATOM 11873 CE1 HIS M 388 -3.367 -32.140-121.225 1.00 95.71 C
+ATOM 11874 NE2 HIS M 388 -2.754 -32.853-122.153 1.00 94.37 N
+ATOM 11875 H HIS M 388 0.804 -32.032-121.992 1.00 0.00 H
+ATOM 11876 HA HIS M 388 1.271 -29.186-121.303 1.00 0.00 H
+ATOM 11877 1HB HIS M 388 -1.166 -28.957-121.603 1.00 0.00 H
+ATOM 11878 2HB HIS M 388 -0.408 -29.670-123.020 1.00 0.00 H
+ATOM 11879 HD2 HIS M 388 -0.950 -32.485-123.363 1.00 0.00 H
+ATOM 11880 HE1 HIS M 388 -4.269 -32.432-120.687 1.00 0.00 H
+ATOM 11881 HE2 HIS M 388 -3.041 -33.763-122.485 1.00 0.00 H
+ATOM 11882 N PHE M 389 0.308 -31.300-119.073 1.00109.27 N
+ATOM 11883 CA PHE M 389 0.057 -31.401-117.634 1.00112.38 C
+ATOM 11884 C PHE M 389 1.322 -31.065-116.849 1.00115.54 C
+ATOM 11885 O PHE M 389 1.401 -30.022-116.192 1.00112.63 O
+ATOM 11886 CB PHE M 389 -0.467 -32.798-117.288 1.00109.15 C
+ATOM 11887 CG PHE M 389 -0.578 -33.064-115.813 1.00107.65 C
+ATOM 11888 CD1 PHE M 389 -1.473 -32.353-115.034 1.00101.20 C
+ATOM 11889 CD2 PHE M 389 0.192 -34.044-115.210 1.00108.33 C
+ATOM 11890 CE1 PHE M 389 -1.587 -32.602-113.682 1.00105.81 C
+ATOM 11891 CE2 PHE M 389 0.083 -34.297-113.858 1.00105.06 C
+ATOM 11892 CZ PHE M 389 -0.808 -33.576-113.093 1.00108.60 C
+ATOM 11893 H PHE M 389 0.473 -32.143-119.604 1.00 0.00 H
+ATOM 11894 HA PHE M 389 -0.700 -30.664-117.362 1.00 0.00 H
+ATOM 11895 1HB PHE M 389 -1.453 -32.937-117.731 1.00 0.00 H
+ATOM 11896 2HB PHE M 389 0.193 -33.551-117.717 1.00 0.00 H
+ATOM 11897 HD1 PHE M 389 -2.094 -31.588-115.500 1.00 0.00 H
+ATOM 11898 HD2 PHE M 389 0.897 -34.614-115.816 1.00 0.00 H
+ATOM 11899 HE1 PHE M 389 -2.293 -32.029-113.081 1.00 0.00 H
+ATOM 11900 HE2 PHE M 389 0.701 -35.066-113.394 1.00 0.00 H
+ATOM 11901 HZ PHE M 389 -0.896 -33.774-112.026 1.00 0.00 H
+ATOM 11902 N TYR M 390 2.323 -31.942-116.905 1.00122.64 N
+ATOM 11903 CA TYR M 390 3.650 -31.581-116.433 1.00124.06 C
+ATOM 11904 C TYR M 390 4.276 -30.569-117.391 1.00145.67 C
+ATOM 11905 O TYR M 390 3.706 -30.211-118.426 1.00155.44 O
+ATOM 11906 CB TYR M 390 4.546 -32.814-116.317 1.00114.20 C
+ATOM 11907 CG TYR M 390 3.900 -34.040-115.709 1.00116.42 C
+ATOM 11908 CD1 TYR M 390 3.869 -34.222-114.333 1.00128.54 C
+ATOM 11909 CD2 TYR M 390 3.346 -35.028-116.512 1.00114.50 C
+ATOM 11910 CE1 TYR M 390 3.293 -35.346-113.772 1.00128.55 C
+ATOM 11911 CE2 TYR M 390 2.766 -36.155-115.960 1.00119.81 C
+ATOM 11912 CZ TYR M 390 2.741 -36.308-114.590 1.00129.03 C
+ATOM 11913 OH TYR M 390 2.165 -37.428-114.035 1.00133.83 O
+ATOM 11914 H TYR M 390 2.168 -32.868-117.277 1.00 0.00 H
+ATOM 11915 HA TYR M 390 3.555 -31.131-115.444 1.00 0.00 H
+ATOM 11916 1HB TYR M 390 4.906 -33.097-117.307 1.00 0.00 H
+ATOM 11917 2HB TYR M 390 5.417 -32.574-115.708 1.00 0.00 H
+ATOM 11918 HD1 TYR M 390 4.304 -33.471-113.674 1.00 0.00 H
+ATOM 11919 HD2 TYR M 390 3.365 -34.923-117.597 1.00 0.00 H
+ATOM 11920 HE1 TYR M 390 3.280 -35.469-112.689 1.00 0.00 H
+ATOM 11921 HE2 TYR M 390 2.332 -36.918-116.607 1.00 0.00 H
+ATOM 11922 HH TYR M 390 1.832 -37.996-114.735 1.00 0.00 H
+ATOM 11923 N GLY M 391 5.472 -30.106-117.048 1.00153.88 N
+ATOM 11924 CA GLY M 391 6.235 -29.282-117.951 1.00171.79 C
+ATOM 11925 C GLY M 391 6.904 -30.127-119.015 1.00183.79 C
+ATOM 11926 O GLY M 391 7.007 -31.352-118.887 1.00186.03 O
+ATOM 11927 H GLY M 391 5.858 -30.331-116.142 1.00 0.00 H
+ATOM 11928 1HA GLY M 391 5.577 -28.549-118.418 1.00 0.00 H
+ATOM 11929 2HA GLY M 391 6.987 -28.728-117.390 1.00 0.00 H
+ATOM 11930 N PRO M 392 7.354 -29.497-120.103 1.00189.83 N
+ATOM 11931 CA PRO M 392 8.166 -30.241-121.080 1.00190.34 C
+ATOM 11932 C PRO M 392 9.472 -30.743-120.493 1.00192.68 C
+ATOM 11933 O PRO M 392 10.034 -31.725-120.993 1.00196.86 O
+ATOM 11934 CB PRO M 392 8.402 -29.215-122.198 1.00193.16 C
+ATOM 11935 CG PRO M 392 7.317 -28.201-122.029 1.00190.53 C
+ATOM 11936 CD PRO M 392 7.061 -28.127-120.555 1.00192.06 C
+ATOM 11937 HA PRO M 392 7.587 -31.099-121.452 1.00 0.00 H
+ATOM 11938 1HB PRO M 392 9.406 -28.776-122.100 1.00 0.00 H
+ATOM 11939 2HB PRO M 392 8.363 -29.712-123.179 1.00 0.00 H
+ATOM 11940 1HG PRO M 392 7.635 -27.232-122.442 1.00 0.00 H
+ATOM 11941 2HG PRO M 392 6.421 -28.507-122.589 1.00 0.00 H
+ATOM 11942 1HD PRO M 392 7.742 -27.392-120.100 1.00 0.00 H
+ATOM 11943 2HD PRO M 392 6.012 -27.846-120.378 1.00 0.00 H
+ATOM 11944 N ASN M 393 9.966 -30.099-119.434 1.00192.94 N
+ATOM 11945 CA ASN M 393 11.200 -30.485-118.746 1.00198.47 C
+ATOM 11946 C ASN M 393 10.887 -30.625-117.255 1.00193.20 C
+ATOM 11947 O ASN M 393 11.224 -29.758-116.446 1.00186.49 O
+ATOM 11948 CB ASN M 393 12.307 -29.466-119.018 1.00205.49 C
+ATOM 11949 CG ASN M 393 11.792 -28.039-119.044 1.00207.65 C
+ATOM 11950 OD1 ASN M 393 10.918 -27.666-118.262 1.00206.91 O
+ATOM 11951 ND2 ASN M 393 12.329 -27.234-119.954 1.00210.75 N
+ATOM 11952 H ASN M 393 9.446 -29.300-119.100 1.00 0.00 H
+ATOM 11953 HA ASN M 393 11.519 -31.456-119.127 1.00 0.00 H
+ATOM 11954 1HB ASN M 393 13.075 -29.549-118.248 1.00 0.00 H
+ATOM 11955 2HB ASN M 393 12.778 -29.687-119.976 1.00 0.00 H
+ATOM 11956 1HD2 ASN M 393 12.029 -26.282-120.019 1.00 0.00 H
+ATOM 11957 2HD2 ASN M 393 13.033 -27.580-120.574 1.00 0.00 H
+ATOM 11958 N HIS M 394 10.241 -31.732-116.898 1.00188.32 N
+ATOM 11959 CA HIS M 394 9.818 -32.018-115.536 1.00179.56 C
+ATOM 11960 C HIS M 394 10.611 -33.195-114.978 1.00172.43 C
+ATOM 11961 O HIS M 394 11.199 -33.986-115.721 1.00178.77 O
+ATOM 11962 CB HIS M 394 8.314 -32.319-115.493 1.00173.02 C
+ATOM 11963 CG HIS M 394 7.721 -32.277-114.118 1.00166.73 C
+ATOM 11964 ND1 HIS M 394 7.664 -33.383-113.297 1.00164.25 N
+ATOM 11965 CD2 HIS M 394 7.149 -31.265-113.424 1.00167.74 C
+ATOM 11966 CE1 HIS M 394 7.089 -33.053-112.155 1.00165.85 C
+ATOM 11967 NE2 HIS M 394 6.766 -31.773-112.206 1.00168.56 N
+ATOM 11968 H HIS M 394 10.040 -32.402-117.626 1.00 0.00 H
+ATOM 11969 HA HIS M 394 10.008 -31.150-114.906 1.00 0.00 H
+ATOM 11970 1HB HIS M 394 7.780 -31.598-116.113 1.00 0.00 H
+ATOM 11971 2HB HIS M 394 8.129 -33.309-115.910 1.00 0.00 H
+ATOM 11972 HD2 HIS M 394 7.018 -30.238-113.767 1.00 0.00 H
+ATOM 11973 HE1 HIS M 394 6.912 -33.723-111.314 1.00 0.00 H
+ATOM 11974 HE2 HIS M 394 6.312 -31.249-111.472 1.00 0.00 H
+ATOM 11975 N GLU M 395 10.625 -33.300-113.646 1.00173.28 N
+ATOM 11976 CA GLU M 395 11.339 -34.396-112.997 1.00170.35 C
+ATOM 11977 C GLU M 395 10.702 -35.742-113.320 1.00175.08 C
+ATOM 11978 O GLU M 395 11.404 -36.744-113.502 1.00157.94 O
+ATOM 11979 CB GLU M 395 11.370 -34.188-111.481 1.00143.86 C
+ATOM 11980 CG GLU M 395 12.237 -33.024-111.024 1.00 0.00 C
+ATOM 11981 CD GLU M 395 12.199 -32.815-109.536 1.00 0.00 C
+ATOM 11982 OE1 GLU M 395 11.448 -33.495-108.879 1.00 0.00 O
+ATOM 11983 OE2 GLU M 395 12.923 -31.975-109.055 1.00 0.00 O
+ATOM 11984 H GLU M 395 10.141 -32.622-113.075 1.00 0.00 H
+ATOM 11985 HA GLU M 395 12.360 -34.417-113.378 1.00 0.00 H
+ATOM 11986 1HB GLU M 395 10.357 -34.014-111.117 1.00 0.00 H
+ATOM 11987 2HB GLU M 395 11.741 -35.092-110.998 1.00 0.00 H
+ATOM 11988 1HG GLU M 395 13.267 -33.210-111.327 1.00 0.00 H
+ATOM 11989 2HG GLU M 395 11.900 -32.116-111.522 1.00 0.00 H
+ATOM 11990 N HIS M 396 9.369 -35.785-113.393 1.00191.76 N
+ATOM 11991 CA HIS M 396 8.682 -37.030-113.721 1.00191.93 C
+ATOM 11992 C HIS M 396 8.853 -37.394-115.188 1.00185.91 C
+ATOM 11993 O HIS M 396 8.885 -38.580-115.533 1.00183.63 O
+ATOM 11994 CB HIS M 396 7.197 -36.915-113.383 1.00196.18 C
+ATOM 11995 CG HIS M 396 6.928 -36.598-111.947 1.00210.63 C
+ATOM 11996 ND1 HIS M 396 5.713 -36.119-111.506 1.00212.16 N
+ATOM 11997 CD2 HIS M 396 7.717 -36.687-110.851 1.00224.79 C
+ATOM 11998 CE1 HIS M 396 5.765 -35.928-110.200 1.00221.13 C
+ATOM 11999 NE2 HIS M 396 6.971 -36.265-109.778 1.00228.48 N
+ATOM 12000 H HIS M 396 8.823 -34.953-113.221 1.00 0.00 H
+ATOM 12001 HA HIS M 396 9.105 -37.844-113.134 1.00 0.00 H
+ATOM 12002 1HB HIS M 396 6.744 -36.134-113.995 1.00 0.00 H
+ATOM 12003 2HB HIS M 396 6.695 -37.852-113.624 1.00 0.00 H
+ATOM 12004 HD2 HIS M 396 8.752 -37.029-110.825 1.00 0.00 H
+ATOM 12005 HE1 HIS M 396 4.952 -35.556-109.577 1.00 0.00 H
+ATOM 12006 HE2 HIS M 396 7.296 -36.221-108.823 1.00 0.00 H
+ATOM 12007 N CYS M 397 8.966 -36.397-116.055 1.00177.07 N
+ATOM 12008 CA CYS M 397 9.096 -36.606-117.490 1.00174.87 C
+ATOM 12009 C CYS M 397 10.488 -37.074-117.895 1.00173.19 C
+ATOM 12010 O CYS M 397 10.815 -37.072-119.088 1.00172.64 O
+ATOM 12011 CB CYS M 397 8.735 -35.314-118.226 1.00183.37 C
+ATOM 12012 SG CYS M 397 8.345 -35.534-119.973 1.00196.05 S
+ATOM 12013 H CYS M 397 8.961 -35.454-115.694 1.00 0.00 H
+ATOM 12014 HA CYS M 397 8.404 -37.394-117.789 1.00 0.00 H
+ATOM 12015 1HB CYS M 397 7.872 -34.851-117.747 1.00 0.00 H
+ATOM 12016 2HB CYS M 397 9.565 -34.611-118.155 1.00 0.00 H
+ATOM 12017 N PHE M 398 11.326 -37.486-116.951 1.00172.53 N
+ATOM 12018 CA PHE M 398 12.702 -37.855-117.252 1.00172.03 C
+ATOM 12019 C PHE M 398 13.075 -39.252-116.791 1.00180.64 C
+ATOM 12020 O PHE M 398 13.840 -39.934-117.478 1.00189.95 O
+ATOM 12021 CB PHE M 398 13.660 -36.848-116.612 1.00165.01 C
+ATOM 12022 CG PHE M 398 15.107 -37.108-116.921 1.00 0.00 C
+ATOM 12023 CD1 PHE M 398 15.635 -36.787-118.163 1.00 0.00 C
+ATOM 12024 CD2 PHE M 398 15.943 -37.673-115.970 1.00 0.00 C
+ATOM 12025 CE1 PHE M 398 16.966 -37.026-118.447 1.00 0.00 C
+ATOM 12026 CE2 PHE M 398 17.274 -37.912-116.252 1.00 0.00 C
+ATOM 12027 CZ PHE M 398 17.786 -37.588-117.492 1.00 0.00 C
+ATOM 12028 H PHE M 398 10.998 -37.545-115.997 1.00 0.00 H
+ATOM 12029 HA PHE M 398 12.835 -37.841-118.335 1.00 0.00 H
+ATOM 12030 1HB PHE M 398 13.414 -35.844-116.956 1.00 0.00 H
+ATOM 12031 2HB PHE M 398 13.534 -36.863-115.531 1.00 0.00 H
+ATOM 12032 HD1 PHE M 398 14.986 -36.342-118.918 1.00 0.00 H
+ATOM 12033 HD2 PHE M 398 15.539 -37.930-114.990 1.00 0.00 H
+ATOM 12034 HE1 PHE M 398 17.367 -36.769-119.427 1.00 0.00 H
+ATOM 12035 HE2 PHE M 398 17.921 -38.357-115.495 1.00 0.00 H
+ATOM 12036 HZ PHE M 398 18.835 -37.777-117.716 1.00 0.00 H
+ATOM 12037 N ASN M 399 12.555 -39.709-115.651 1.00177.36 N
+ATOM 12038 CA ASN M 399 13.049 -40.948-115.059 1.00173.15 C
+ATOM 12039 C ASN M 399 11.957 -41.657-114.262 1.00162.93 C
+ATOM 12040 O ASN M 399 12.216 -42.216-113.191 1.00159.97 O
+ATOM 12041 CB ASN M 399 14.279 -40.684-114.185 1.00178.10 C
+ATOM 12042 CG ASN M 399 14.021 -39.649-113.102 1.00181.51 C
+ATOM 12043 OD1 ASN M 399 12.896 -39.488-112.629 1.00176.72 O
+ATOM 12044 ND2 ASN M 399 15.072 -38.938-112.706 1.00185.50 N
+ATOM 12045 H ASN M 399 11.815 -39.203-115.186 1.00 0.00 H
+ATOM 12046 HA ASN M 399 13.337 -41.626-115.864 1.00 0.00 H
+ATOM 12047 1HB ASN M 399 14.596 -41.614-113.712 1.00 0.00 H
+ATOM 12048 2HB ASN M 399 15.102 -40.338-114.810 1.00 0.00 H
+ATOM 12049 1HD2 ASN M 399 14.966 -38.241-111.996 1.00 0.00 H
+ATOM 12050 2HD2 ASN M 399 15.968 -39.100-113.118 1.00 0.00 H
+ATOM 12051 N ARG M 400 10.730 -41.657-114.777 1.00155.60 N
+ATOM 12052 CA ARG M 400 9.649 -42.438-114.194 1.00144.43 C
+ATOM 12053 C ARG M 400 8.941 -43.209-115.296 1.00135.00 C
+ATOM 12054 O ARG M 400 8.636 -42.654-116.356 1.00125.83 O
+ATOM 12055 CB ARG M 400 8.655 -41.544-113.468 1.00138.75 C
+ATOM 12056 CG ARG M 400 9.222 -40.796-112.272 1.00136.91 C
+ATOM 12057 CD ARG M 400 9.523 -41.713-111.143 1.00136.36 C
+ATOM 12058 NE ARG M 400 10.011 -40.995-109.976 1.00132.44 N
+ATOM 12059 CZ ARG M 400 11.303 -40.682-109.755 1.00 0.00 C
+ATOM 12060 NH1 ARG M 400 12.222 -41.031-110.628 1.00 0.00 N
+ATOM 12061 NH2 ARG M 400 11.646 -40.025-108.661 1.00 0.00 N
+ATOM 12062 H ARG M 400 10.546 -41.097-115.597 1.00 0.00 H
+ATOM 12063 HA ARG M 400 10.077 -43.144-113.482 1.00 0.00 H
+ATOM 12064 1HB ARG M 400 8.257 -40.804-114.161 1.00 0.00 H
+ATOM 12065 2HB ARG M 400 7.817 -42.145-113.114 1.00 0.00 H
+ATOM 12066 1HG ARG M 400 10.145 -40.294-112.561 1.00 0.00 H
+ATOM 12067 2HG ARG M 400 8.498 -40.056-111.929 1.00 0.00 H
+ATOM 12068 1HD ARG M 400 8.619 -42.250-110.859 1.00 0.00 H
+ATOM 12069 2HD ARG M 400 10.288 -42.426-111.448 1.00 0.00 H
+ATOM 12070 HE ARG M 400 9.333 -40.710-109.282 1.00 0.00 H
+ATOM 12071 1HH1 ARG M 400 11.960 -41.533-111.464 1.00 0.00 H
+ATOM 12072 2HH1 ARG M 400 13.190 -40.797-110.462 1.00 0.00 H
+ATOM 12073 1HH2 ARG M 400 10.939 -39.758-107.990 1.00 0.00 H
+ATOM 12074 2HH2 ARG M 400 12.613 -39.791-108.495 1.00 0.00 H
+ATOM 12075 N THR M 401 8.688 -44.490-115.043 1.00138.07 N
+ATOM 12076 CA THR M 401 8.080 -45.377-116.021 1.00134.83 C
+ATOM 12077 C THR M 401 6.788 -45.959-115.468 1.00131.69 C
+ATOM 12078 O THR M 401 6.627 -46.112-114.253 1.00141.56 O
+ATOM 12079 CB THR M 401 9.039 -46.514-116.420 1.00133.29 C
+ATOM 12080 OG1 THR M 401 9.353 -47.305-115.267 1.00 0.00 O
+ATOM 12081 CG2 THR M 401 10.323 -45.947-117.007 1.00 0.00 C
+ATOM 12082 H THR M 401 8.931 -44.854-114.133 1.00 0.00 H
+ATOM 12083 HA THR M 401 7.856 -44.801-116.919 1.00 0.00 H
+ATOM 12084 HB THR M 401 8.559 -47.151-117.162 1.00 0.00 H
+ATOM 12085 HG1 THR M 401 8.817 -48.102-115.271 1.00 0.00 H
+ATOM 12086 1HG2 THR M 401 10.989 -46.764-117.284 1.00 0.00 H
+ATOM 12087 2HG2 THR M 401 10.089 -45.354-117.891 1.00 0.00 H
+ATOM 12088 3HG2 THR M 401 10.813 -45.316-116.266 1.00 0.00 H
+ATOM 12089 N LEU M 402 5.866 -46.277-116.372 1.00124.72 N
+ATOM 12090 CA LEU M 402 4.640 -46.951-115.972 1.00126.73 C
+ATOM 12091 C LEU M 402 4.981 -48.318-115.393 1.00135.29 C
+ATOM 12092 O LEU M 402 5.693 -49.107-116.021 1.00129.65 O
+ATOM 12093 CB LEU M 402 3.691 -47.103-117.167 1.00109.31 C
+ATOM 12094 CG LEU M 402 2.322 -47.723-116.855 1.00 0.00 C
+ATOM 12095 CD1 LEU M 402 1.535 -46.786-115.949 1.00 0.00 C
+ATOM 12096 CD2 LEU M 402 1.575 -47.984-118.154 1.00 0.00 C
+ATOM 12097 H LEU M 402 6.009 -46.053-117.346 1.00 0.00 H
+ATOM 12098 HA LEU M 402 4.152 -46.353-115.203 1.00 0.00 H
+ATOM 12099 1HB LEU M 402 3.518 -46.120-117.601 1.00 0.00 H
+ATOM 12100 2HB LEU M 402 4.174 -47.729-117.918 1.00 0.00 H
+ATOM 12101 HG LEU M 402 2.462 -48.663-116.321 1.00 0.00 H
+ATOM 12102 1HD1 LEU M 402 0.563 -47.226-115.727 1.00 0.00 H
+ATOM 12103 2HD1 LEU M 402 2.083 -46.632-115.020 1.00 0.00 H
+ATOM 12104 3HD1 LEU M 402 1.394 -45.829-116.451 1.00 0.00 H
+ATOM 12105 1HD2 LEU M 402 0.602 -48.425-117.932 1.00 0.00 H
+ATOM 12106 2HD2 LEU M 402 1.434 -47.044-118.688 1.00 0.00 H
+ATOM 12107 3HD2 LEU M 402 2.152 -48.670-118.774 1.00 0.00 H
+ATOM 12108 N LEU M 403 4.497 -48.583-114.182 1.00141.26 N
+ATOM 12109 CA LEU M 403 4.783 -49.853-113.530 1.00142.13 C
+ATOM 12110 C LEU M 403 4.129 -50.999-114.293 1.00140.53 C
+ATOM 12111 O LEU M 403 2.998 -50.883-114.772 1.00144.34 O
+ATOM 12112 CB LEU M 403 4.286 -49.826-112.083 1.00137.24 C
+ATOM 12113 CG LEU M 403 5.346 -49.739-110.983 1.00143.64 C
+ATOM 12114 CD1 LEU M 403 6.027 -48.378-111.004 1.00141.41 C
+ATOM 12115 CD2 LEU M 403 4.738 -50.018-109.613 1.00151.79 C
+ATOM 12116 H LEU M 403 3.925 -47.902-113.703 1.00 0.00 H
+ATOM 12117 HA LEU M 403 5.862 -50.005-113.528 1.00 0.00 H
+ATOM 12118 1HB LEU M 403 3.627 -48.968-111.958 1.00 0.00 H
+ATOM 12119 2HB LEU M 403 3.708 -50.731-111.897 1.00 0.00 H
+ATOM 12120 HG LEU M 403 6.129 -50.473-111.173 1.00 0.00 H
+ATOM 12121 1HD1 LEU M 403 6.778 -48.335-110.215 1.00 0.00 H
+ATOM 12122 2HD1 LEU M 403 6.508 -48.227-111.970 1.00 0.00 H
+ATOM 12123 3HD1 LEU M 403 5.285 -47.597-110.841 1.00 0.00 H
+ATOM 12124 1HD2 LEU M 403 5.514 -49.950-108.850 1.00 0.00 H
+ATOM 12125 2HD2 LEU M 403 3.959 -49.285-109.404 1.00 0.00 H
+ATOM 12126 3HD2 LEU M 403 4.306 -51.019-109.604 1.00 0.00 H
+ATOM 12127 N ARG M 404 4.852 -52.110-114.409 1.00137.30 N
+ATOM 12128 CA ARG M 404 4.350 -53.298-115.089 1.00133.49 C
+ATOM 12129 C ARG M 404 3.645 -54.275-114.144 1.00145.11 C
+ATOM 12130 O ARG M 404 3.138 -55.300-114.603 1.00142.63 O
+ATOM 12131 CB ARG M 404 5.494 -54.020-115.786 1.00131.84 C
+ATOM 12132 CG ARG M 404 6.139 -53.246-116.924 1.00129.83 C
+ATOM 12133 CD ARG M 404 7.238 -54.018-117.559 1.00 0.00 C
+ATOM 12134 NE ARG M 404 7.860 -53.281-118.647 1.00 0.00 N
+ATOM 12135 CZ ARG M 404 8.867 -53.749-119.411 1.00 0.00 C
+ATOM 12136 NH1 ARG M 404 9.353 -54.950-119.194 1.00 0.00 N
+ATOM 12137 NH2 ARG M 404 9.366 -52.999-120.378 1.00 0.00 N
+ATOM 12138 H ARG M 404 5.780 -52.126-114.011 1.00 0.00 H
+ATOM 12139 HA ARG M 404 3.597 -52.989-115.815 1.00 0.00 H
+ATOM 12140 1HB ARG M 404 6.273 -54.252-115.061 1.00 0.00 H
+ATOM 12141 2HB ARG M 404 5.133 -54.965-116.192 1.00 0.00 H
+ATOM 12142 1HG ARG M 404 5.391 -53.026-117.686 1.00 0.00 H
+ATOM 12143 2HG ARG M 404 6.553 -52.313-116.541 1.00 0.00 H
+ATOM 12144 1HD ARG M 404 8.004 -54.240-116.816 1.00 0.00 H
+ATOM 12145 2HD ARG M 404 6.843 -54.950-117.962 1.00 0.00 H
+ATOM 12146 HE ARG M 404 7.513 -52.352-118.845 1.00 0.00 H
+ATOM 12147 1HH1 ARG M 404 8.972 -55.523-118.454 1.00 0.00 H
+ATOM 12148 2HH1 ARG M 404 10.108 -55.301-119.766 1.00 0.00 H
+ATOM 12149 1HH2 ARG M 404 8.992 -52.075-120.545 1.00 0.00 H
+ATOM 12150 2HH2 ARG M 404 10.120 -53.349-120.950 1.00 0.00 H
+ATOM 12151 N ASN M 405 3.621 -53.987-112.838 1.00161.91 N
+ATOM 12152 CA ASN M 405 2.704 -54.646-111.904 1.00176.27 C
+ATOM 12153 C ASN M 405 1.249 -54.369-112.268 1.00180.61 C
+ATOM 12154 O ASN M 405 0.371 -55.186-111.969 1.00196.35 O
+ATOM 12155 CB ASN M 405 3.059 -54.170-110.484 1.00179.94 C
+ATOM 12156 CG ASN M 405 1.990 -54.449-109.397 1.00186.95 C
+ATOM 12157 OD1 ASN M 405 1.212 -55.407-109.405 1.00167.99 O
+ATOM 12158 ND2 ASN M 405 2.000 -53.520-108.442 1.00224.47 N
+ATOM 12159 H ASN M 405 4.261 -53.288-112.488 1.00 0.00 H
+ATOM 12160 HA ASN M 405 2.847 -55.725-111.982 1.00 0.00 H
+ATOM 12161 1HB ASN M 405 3.983 -54.651-110.159 1.00 0.00 H
+ATOM 12162 2HB ASN M 405 3.236 -53.094-110.494 1.00 0.00 H
+ATOM 12163 1HD2 ASN M 405 1.357 -53.581-107.678 1.00 0.00 H
+ATOM 12164 2HD2 ASN M 405 2.650 -52.762-108.489 1.00 0.00 H
+ATOM 12165 N SER M 406 0.985 -53.246-112.936 1.00168.88 N
+ATOM 12166 CA SER M 406 -0.361 -52.850-113.352 1.00157.72 C
+ATOM 12167 C SER M 406 -1.148 -53.963-114.037 1.00154.51 C
+ATOM 12168 O SER M 406 -0.859 -54.327-115.175 1.00156.91 O
+ATOM 12169 CB SER M 406 -0.284 -51.646-114.295 1.00155.22 C
+ATOM 12170 OG SER M 406 0.601 -51.901-115.371 1.00156.19 O
+ATOM 12171 H SER M 406 1.766 -52.646-113.160 1.00 0.00 H
+ATOM 12172 HA SER M 406 -0.929 -52.568-112.464 1.00 0.00 H
+ATOM 12173 1HB SER M 406 -1.278 -51.423-114.682 1.00 0.00 H
+ATOM 12174 2HB SER M 406 0.055 -50.771-113.741 1.00 0.00 H
+ATOM 12175 HG SER M 406 0.938 -52.789-115.232 1.00 0.00 H
+ATOM 12176 N GLY M 408 -4.295 -53.061-115.348 1.00133.65 N
+ATOM 12177 CA GLY M 408 -4.529 -51.944-116.244 1.00131.49 C
+ATOM 12178 C GLY M 408 -5.221 -50.766-115.582 1.00125.48 C
+ATOM 12179 O GLY M 408 -5.371 -49.703-116.187 1.00109.41 O
+ATOM 12180 H GLY M 408 -5.075 -53.637-115.065 1.00 0.00 H
+ATOM 12181 1HA GLY M 408 -3.579 -51.600-116.652 1.00 0.00 H
+ATOM 12182 2HA GLY M 408 -5.139 -52.273-117.084 1.00 0.00 H
+ATOM 12183 N CYS M 409 -5.658 -50.958-114.335 1.00127.32 N
+ATOM 12184 CA CYS M 409 -6.284 -49.881-113.566 1.00121.58 C
+ATOM 12185 C CYS M 409 -5.893 -50.065-112.101 1.00116.19 C
+ATOM 12186 O CYS M 409 -6.513 -50.848-111.378 1.00109.64 O
+ATOM 12187 CB CYS M 409 -7.798 -49.864-113.747 1.00127.30 C
+ATOM 12188 SG CYS M 409 -8.675 -48.932-112.447 1.00138.60 S
+ATOM 12189 H CYS M 409 -5.554 -51.869-113.911 1.00 0.00 H
+ATOM 12190 HA CYS M 409 -5.891 -48.928-113.922 1.00 0.00 H
+ATOM 12191 1HB CYS M 409 -8.044 -49.421-114.712 1.00 0.00 H
+ATOM 12192 2HB CYS M 409 -8.175 -50.886-113.750 1.00 0.00 H
+ATOM 12193 N GLU M 410 -4.852 -49.358-111.683 1.00118.68 N
+ATOM 12194 CA GLU M 410 -4.455 -49.299-110.285 1.00119.46 C
+ATOM 12195 C GLU M 410 -4.381 -47.842-109.853 1.00113.92 C
+ATOM 12196 O GLU M 410 -3.977 -46.971-110.630 1.00113.11 O
+ATOM 12197 CB GLU M 410 -3.099 -49.979-110.032 1.00116.93 C
+ATOM 12198 CG GLU M 410 -3.072 -51.475-110.308 1.00115.00 C
+ATOM 12199 CD GLU M 410 -1.674 -52.056-110.188 1.00124.84 C
+ATOM 12200 OE1 GLU M 410 -0.696 -51.278-110.236 1.00127.71 O
+ATOM 12201 OE2 GLU M 410 -1.554 -53.292-110.050 1.00125.80 O
+ATOM 12202 H GLU M 410 -4.318 -48.843-112.368 1.00 0.00 H
+ATOM 12203 HA GLU M 410 -5.205 -49.822-109.690 1.00 0.00 H
+ATOM 12204 1HB GLU M 410 -2.337 -49.514-110.657 1.00 0.00 H
+ATOM 12205 2HB GLU M 410 -2.805 -49.830-108.993 1.00 0.00 H
+ATOM 12206 1HG GLU M 410 -3.730 -51.977-109.599 1.00 0.00 H
+ATOM 12207 2HG GLU M 410 -3.458 -51.656-111.310 1.00 0.00 H
+ATOM 12208 N ALA M 411 -4.776 -47.582-108.611 1.00117.52 N
+ATOM 12209 CA ALA M 411 -4.751 -46.241-108.042 1.00 96.56 C
+ATOM 12210 C ALA M 411 -3.608 -46.159-107.044 1.00100.98 C
+ATOM 12211 O ALA M 411 -3.551 -46.950-106.096 1.00113.98 O
+ATOM 12212 CB ALA M 411 -6.081 -45.905-107.370 1.00 96.05 C
+ATOM 12213 H ALA M 411 -5.106 -48.351-108.045 1.00 0.00 H
+ATOM 12214 HA ALA M 411 -4.583 -45.532-108.853 1.00 0.00 H
+ATOM 12215 1HB ALA M 411 -6.034 -44.899-106.954 1.00 0.00 H
+ATOM 12216 2HB ALA M 411 -6.884 -45.957-108.106 1.00 0.00 H
+ATOM 12217 3HB ALA M 411 -6.275 -46.619-106.571 1.00 0.00 H
+ATOM 12218 N ARG M 412 -2.699 -45.215-107.261 1.00101.78 N
+ATOM 12219 CA ARG M 412 -1.570 -45.000-106.371 1.00119.95 C
+ATOM 12220 C ARG M 412 -1.553 -43.554-105.891 1.00125.06 C
+ATOM 12221 O ARG M 412 -2.211 -42.678-106.461 1.00118.78 O
+ATOM 12222 CB ARG M 412 -0.259 -45.324-107.071 1.00123.03 C
+ATOM 12223 CG ARG M 412 -0.115 -46.769-107.524 1.00112.01 C
+ATOM 12224 CD ARG M 412 1.222 -47.028-108.115 1.00110.73 C
+ATOM 12225 NE ARG M 412 1.436 -46.261-109.332 1.00 0.00 N
+ATOM 12226 CZ ARG M 412 1.046 -46.652-110.561 1.00 0.00 C
+ATOM 12227 NH1 ARG M 412 0.426 -47.800-110.720 1.00 0.00 N
+ATOM 12228 NH2 ARG M 412 1.287 -45.881-111.607 1.00 0.00 N
+ATOM 12229 H ARG M 412 -2.801 -44.628-108.076 1.00 0.00 H
+ATOM 12230 HA ARG M 412 -1.688 -45.646-105.500 1.00 0.00 H
+ATOM 12231 1HB ARG M 412 -0.150 -44.691-107.950 1.00 0.00 H
+ATOM 12232 2HB ARG M 412 0.575 -45.103-106.404 1.00 0.00 H
+ATOM 12233 1HG ARG M 412 -0.247 -47.432-106.669 1.00 0.00 H
+ATOM 12234 2HG ARG M 412 -0.872 -46.991-108.276 1.00 0.00 H
+ATOM 12235 1HD ARG M 412 1.996 -46.754-107.399 1.00 0.00 H
+ATOM 12236 2HD ARG M 412 1.313 -48.086-108.360 1.00 0.00 H
+ATOM 12237 HE ARG M 412 1.910 -45.372-109.250 1.00 0.00 H
+ATOM 12238 1HH1 ARG M 412 0.242 -48.389-109.921 1.00 0.00 H
+ATOM 12239 2HH1 ARG M 412 0.134 -48.093-111.641 1.00 0.00 H
+ATOM 12240 1HH2 ARG M 412 1.764 -44.998-111.485 1.00 0.00 H
+ATOM 12241 2HH2 ARG M 412 0.995 -46.173-112.528 1.00 0.00 H
+ATOM 12242 N ARG M 413 -0.793 -43.314-104.818 1.00129.82 N
+ATOM 12243 CA ARG M 413 -0.726 -41.974-104.244 1.00132.00 C
+ATOM 12244 C ARG M 413 -0.065 -40.982-105.194 1.00134.66 C
+ATOM 12245 O ARG M 413 -0.427 -39.800-105.202 1.00132.17 O
+ATOM 12246 CB ARG M 413 0.042 -41.997-102.931 1.00119.04 C
+ATOM 12247 CG ARG M 413 -0.675 -42.687-101.782 1.00 0.00 C
+ATOM 12248 CD ARG M 413 0.156 -42.712-100.551 1.00 0.00 C
+ATOM 12249 NE ARG M 413 -0.526 -43.372 -99.449 1.00 0.00 N
+ATOM 12250 CZ ARG M 413 0.038 -43.650 -98.258 1.00 0.00 C
+ATOM 12251 NH1 ARG M 413 1.290 -43.321 -98.030 1.00 0.00 N
+ATOM 12252 NH2 ARG M 413 -0.668 -44.254 -97.318 1.00 0.00 N
+ATOM 12253 H ARG M 413 -0.258 -44.058-104.394 1.00 0.00 H
+ATOM 12254 HA ARG M 413 -1.743 -41.621-104.070 1.00 0.00 H
+ATOM 12255 1HB ARG M 413 0.996 -42.503-103.076 1.00 0.00 H
+ATOM 12256 2HB ARG M 413 0.259 -40.975-102.618 1.00 0.00 H
+ATOM 12257 1HG ARG M 413 -1.601 -42.157-101.560 1.00 0.00 H
+ATOM 12258 2HG ARG M 413 -0.904 -43.716-102.062 1.00 0.00 H
+ATOM 12259 1HD ARG M 413 1.083 -43.249-100.749 1.00 0.00 H
+ATOM 12260 2HD ARG M 413 0.386 -41.691-100.247 1.00 0.00 H
+ATOM 12261 HE ARG M 413 -1.491 -43.640 -99.587 1.00 0.00 H
+ATOM 12262 1HH1 ARG M 413 1.830 -42.859 -98.748 1.00 0.00 H
+ATOM 12263 2HH1 ARG M 413 1.712 -43.530 -97.137 1.00 0.00 H
+ATOM 12264 1HH2 ARG M 413 -1.631 -44.507 -97.493 1.00 0.00 H
+ATOM 12265 2HH2 ARG M 413 -0.246 -44.463 -96.425 1.00 0.00 H
+ATOM 12266 N ASP M 414 0.895 -41.435-105.996 1.00127.76 N
+ATOM 12267 CA ASP M 414 1.592 -40.590-106.964 1.00127.35 C
+ATOM 12268 C ASP M 414 1.284 -41.145-108.353 1.00122.12 C
+ATOM 12269 O ASP M 414 2.030 -41.969-108.890 1.00120.29 O
+ATOM 12270 CB ASP M 414 3.096 -40.548-106.677 1.00139.29 C
+ATOM 12271 CG ASP M 414 3.808 -39.454-107.452 1.00144.18 C
+ATOM 12272 OD1 ASP M 414 3.128 -38.685-108.163 1.00138.81 O
+ATOM 12273 OD2 ASP M 414 5.049 -39.354-107.333 1.00148.78 O
+ATOM 12274 H ASP M 414 1.146 -42.411-105.924 1.00 0.00 H
+ATOM 12275 HA ASP M 414 1.199 -39.576-106.884 1.00 0.00 H
+ATOM 12276 1HB ASP M 414 3.259 -40.386-105.611 1.00 0.00 H
+ATOM 12277 2HB ASP M 414 3.543 -41.509-106.934 1.00 0.00 H
+ATOM 12278 N GLU M 415 0.177 -40.687-108.930 1.00118.25 N
+ATOM 12279 CA GLU M 415 -0.306 -41.219-110.195 1.00108.63 C
+ATOM 12280 C GLU M 415 0.501 -40.650-111.357 1.00117.03 C
+ATOM 12281 O GLU M 415 0.851 -39.466-111.368 1.00119.45 O
+ATOM 12282 CB GLU M 415 -1.791 -40.894-110.367 1.00 96.70 C
+ATOM 12283 CG GLU M 415 -2.428 -41.472-111.622 1.00127.95 C
+ATOM 12284 CD GLU M 415 -2.496 -42.989-111.605 1.00125.98 C
+ATOM 12285 OE1 GLU M 415 -2.497 -43.577-110.502 1.00130.99 O
+ATOM 12286 OE2 GLU M 415 -2.552 -43.593-112.697 1.00124.51 O
+ATOM 12287 H GLU M 415 -0.342 -39.949-108.476 1.00 0.00 H
+ATOM 12288 HA GLU M 415 -0.181 -42.302-110.185 1.00 0.00 H
+ATOM 12289 1HB GLU M 415 -2.348 -41.271-109.509 1.00 0.00 H
+ATOM 12290 2HB GLU M 415 -1.926 -39.813-110.395 1.00 0.00 H
+ATOM 12291 1HG GLU M 415 -3.438 -41.076-111.720 1.00 0.00 H
+ATOM 12292 2HG GLU M 415 -1.855 -41.148-112.490 1.00 0.00 H
+ATOM 12293 N TYR M 416 0.802 -41.506-112.331 1.00122.31 N
+ATOM 12294 CA TYR M 416 1.541 -41.120-113.526 1.00117.58 C
+ATOM 12295 C TYR M 416 0.580 -40.949-114.695 1.00113.94 C
+ATOM 12296 O TYR M 416 -0.348 -41.744-114.874 1.00119.57 O
+ATOM 12297 CB TYR M 416 2.609 -42.162-113.871 1.00122.28 C
+ATOM 12298 CG TYR M 416 3.628 -41.691-114.888 1.00131.06 C
+ATOM 12299 CD1 TYR M 416 3.958 -40.347-115.001 1.00133.82 C
+ATOM 12300 CD2 TYR M 416 4.260 -42.593-115.737 1.00137.14 C
+ATOM 12301 CE1 TYR M 416 4.886 -39.912-115.929 1.00134.35 C
+ATOM 12302 CE2 TYR M 416 5.191 -42.167-116.669 1.00137.79 C
+ATOM 12303 CZ TYR M 416 5.499 -40.826-116.761 1.00140.76 C
+ATOM 12304 OH TYR M 416 6.423 -40.396-117.687 1.00144.75 O
+ATOM 12305 H TYR M 416 0.500 -42.464-112.227 1.00 0.00 H
+ATOM 12306 HA TYR M 416 2.038 -40.169-113.333 1.00 0.00 H
+ATOM 12307 1HB TYR M 416 3.145 -42.448-112.965 1.00 0.00 H
+ATOM 12308 2HB TYR M 416 2.129 -43.058-114.265 1.00 0.00 H
+ATOM 12309 HD1 TYR M 416 3.482 -39.612-114.351 1.00 0.00 H
+ATOM 12310 HD2 TYR M 416 4.024 -43.656-115.676 1.00 0.00 H
+ATOM 12311 HE1 TYR M 416 5.130 -38.852-116.000 1.00 0.00 H
+ATOM 12312 HE2 TYR M 416 5.675 -42.890-117.326 1.00 0.00 H
+ATOM 12313 HH TYR M 416 6.753 -41.150-118.182 1.00 0.00 H
+ATOM 12314 N ARG M 417 0.803 -39.901-115.487 1.00107.03 N
+ATOM 12315 CA ARG M 417 -0.087 -39.534-116.582 1.00 95.88 C
+ATOM 12316 C ARG M 417 0.726 -39.443-117.863 1.00 98.88 C
+ATOM 12317 O ARG M 417 1.603 -38.581-117.988 1.00103.90 O
+ATOM 12318 CB ARG M 417 -0.798 -38.216-116.275 1.00 90.37 C
+ATOM 12319 CG ARG M 417 -1.239 -38.142-114.822 1.00 95.12 C
+ATOM 12320 CD ARG M 417 -2.073 -36.926-114.533 1.00 98.75 C
+ATOM 12321 NE ARG M 417 -2.574 -36.933-113.161 1.00 99.36 N
+ATOM 12322 CZ ARG M 417 -3.494 -37.780-112.708 1.00 98.87 C
+ATOM 12323 NH1 ARG M 417 -4.010 -38.697-113.515 1.00 96.37 N
+ATOM 12324 NH2 ARG M 417 -3.897 -37.714-111.447 1.00 91.90 N
+ATOM 12325 H ARG M 417 1.626 -39.342-115.314 1.00 0.00 H
+ATOM 12326 HA ARG M 417 -0.838 -40.317-116.695 1.00 0.00 H
+ATOM 12327 1HB ARG M 417 -0.130 -37.384-116.492 1.00 0.00 H
+ATOM 12328 2HB ARG M 417 -1.669 -38.113-116.922 1.00 0.00 H
+ATOM 12329 1HG ARG M 417 -1.834 -39.022-114.577 1.00 0.00 H
+ATOM 12330 2HG ARG M 417 -0.361 -38.107-114.176 1.00 0.00 H
+ATOM 12331 1HD ARG M 417 -1.470 -36.029-114.675 1.00 0.00 H
+ATOM 12332 2HD ARG M 417 -2.926 -36.900-115.211 1.00 0.00 H
+ATOM 12333 HE ARG M 417 -2.195 -36.250-112.519 1.00 0.00 H
+ATOM 12334 1HH1 ARG M 417 -3.704 -38.753-114.476 1.00 0.00 H
+ATOM 12335 2HH1 ARG M 417 -4.708 -39.339-113.169 1.00 0.00 H
+ATOM 12336 1HH2 ARG M 417 -3.505 -37.019-110.827 1.00 0.00 H
+ATOM 12337 2HH2 ARG M 417 -4.595 -38.358-111.106 1.00 0.00 H
+ATOM 12338 N THR M 418 0.432 -40.325-118.810 1.00 89.33 N
+ATOM 12339 CA THR M 418 1.274 -40.566-119.970 1.00104.22 C
+ATOM 12340 C THR M 418 0.585 -40.095-121.251 1.00104.09 C
+ATOM 12341 O THR M 418 -0.550 -39.610-121.242 1.00103.60 O
+ATOM 12342 CB THR M 418 1.632 -42.051-120.052 1.00101.42 C
+ATOM 12343 OG1 THR M 418 0.435 -42.832-119.960 1.00114.82 O
+ATOM 12344 CG2 THR M 418 2.557 -42.438-118.916 1.00 98.13 C
+ATOM 12345 H THR M 418 -0.425 -40.849-118.707 1.00 0.00 H
+ATOM 12346 HA THR M 418 2.191 -39.986-119.859 1.00 0.00 H
+ATOM 12347 HB THR M 418 2.127 -42.254-121.001 1.00 0.00 H
+ATOM 12348 HG1 THR M 418 -0.321 -42.248-119.868 1.00 0.00 H
+ATOM 12349 1HG2 THR M 418 2.801 -43.497-118.991 1.00 0.00 H
+ATOM 12350 2HG2 THR M 418 3.472 -41.849-118.975 1.00 0.00 H
+ATOM 12351 3HG2 THR M 418 2.064 -42.246-117.964 1.00 0.00 H
+ATOM 12352 N GLU M 419 1.291 -40.262-122.369 1.00110.48 N
+ATOM 12353 CA GLU M 419 0.840 -39.783-123.669 1.00 87.15 C
+ATOM 12354 C GLU M 419 1.591 -40.557-124.742 1.00 96.03 C
+ATOM 12355 O GLU M 419 2.822 -40.622-124.707 1.00 93.23 O
+ATOM 12356 CB GLU M 419 1.080 -38.274-123.797 1.00 88.84 C
+ATOM 12357 CG GLU M 419 0.943 -37.708-125.191 1.00101.33 C
+ATOM 12358 CD GLU M 419 1.483 -36.293-125.288 1.00107.26 C
+ATOM 12359 OE1 GLU M 419 1.917 -35.747-124.253 1.00 93.80 O
+ATOM 12360 OE2 GLU M 419 1.474 -35.724-126.398 1.00123.18 O
+ATOM 12361 H GLU M 419 2.177 -40.743-122.302 1.00 0.00 H
+ATOM 12362 HA GLU M 419 -0.230 -39.975-123.756 1.00 0.00 H
+ATOM 12363 1HB GLU M 419 0.376 -37.738-123.160 1.00 0.00 H
+ATOM 12364 2HB GLU M 419 2.085 -38.034-123.448 1.00 0.00 H
+ATOM 12365 1HG GLU M 419 1.485 -38.348-125.887 1.00 0.00 H
+ATOM 12366 2HG GLU M 419 -0.109 -37.719-125.474 1.00 0.00 H
+ATOM 12367 N PHE M 420 0.855 -41.145-125.683 1.00 94.88 N
+ATOM 12368 CA PHE M 420 1.440 -42.055-126.659 1.00 90.09 C
+ATOM 12369 C PHE M 420 2.005 -41.309-127.866 1.00 93.00 C
+ATOM 12370 O PHE M 420 1.616 -40.180-128.181 1.00 88.53 O
+ATOM 12371 CB PHE M 420 0.409 -43.081-127.135 1.00 92.06 C
+ATOM 12372 CG PHE M 420 0.369 -44.338-126.310 1.00107.18 C
+ATOM 12373 CD1 PHE M 420 -0.614 -44.526-125.352 1.00110.00 C
+ATOM 12374 CD2 PHE M 420 1.313 -45.336-126.500 1.00117.03 C
+ATOM 12375 CE1 PHE M 420 -0.656 -45.686-124.596 1.00116.35 C
+ATOM 12376 CE2 PHE M 420 1.277 -46.499-125.746 1.00124.73 C
+ATOM 12377 CZ PHE M 420 0.292 -46.673-124.794 1.00124.98 C
+ATOM 12378 H PHE M 420 -0.136 -40.954-125.720 1.00 0.00 H
+ATOM 12379 HA PHE M 420 2.264 -42.589-126.184 1.00 0.00 H
+ATOM 12380 1HB PHE M 420 -0.584 -42.634-127.117 1.00 0.00 H
+ATOM 12381 2HB PHE M 420 0.623 -43.360-128.166 1.00 0.00 H
+ATOM 12382 HD1 PHE M 420 -1.362 -43.748-125.196 1.00 0.00 H
+ATOM 12383 HD2 PHE M 420 2.091 -45.198-127.252 1.00 0.00 H
+ATOM 12384 HE1 PHE M 420 -1.436 -45.819-123.847 1.00 0.00 H
+ATOM 12385 HE2 PHE M 420 2.025 -47.276-125.903 1.00 0.00 H
+ATOM 12386 HZ PHE M 420 0.263 -47.585-124.199 1.00 0.00 H
+ATOM 12387 N THR M 421 2.937 -41.974-128.550 1.00105.96 N
+ATOM 12388 CA THR M 421 3.543 -41.485-129.783 1.00113.95 C
+ATOM 12389 C THR M 421 2.956 -42.153-131.022 1.00110.86 C
+ATOM 12390 O THR M 421 2.535 -41.464-131.956 1.00114.91 O
+ATOM 12391 CB THR M 421 5.061 -41.700-129.748 1.00125.15 C
+ATOM 12392 OG1 THR M 421 5.628 -40.930-128.681 1.00124.95 O
+ATOM 12393 CG2 THR M 421 5.695 -41.277-131.070 1.00130.86 C
+ATOM 12394 H THR M 421 3.229 -42.867-128.179 1.00 0.00 H
+ATOM 12395 HA THR M 421 3.342 -40.417-129.868 1.00 0.00 H
+ATOM 12396 HB THR M 421 5.275 -42.754-129.571 1.00 0.00 H
+ATOM 12397 HG1 THR M 421 4.930 -40.452-128.227 1.00 0.00 H
+ATOM 12398 1HG2 THR M 421 6.772 -41.438-131.025 1.00 0.00 H
+ATOM 12399 2HG2 THR M 421 5.273 -41.869-131.882 1.00 0.00 H
+ATOM 12400 3HG2 THR M 421 5.493 -40.222-131.249 1.00 0.00 H
+ATOM 12401 N THR M 422 2.922 -43.484-131.053 1.00104.98 N
+ATOM 12402 CA THR M 422 2.290 -44.188-132.160 1.00109.24 C
+ATOM 12403 C THR M 422 0.773 -44.082-132.052 1.00105.72 C
+ATOM 12404 O THR M 422 0.201 -44.195-130.965 1.00106.77 O
+ATOM 12405 CB THR M 422 2.716 -45.657-132.180 1.00118.72 C
+ATOM 12406 OG1 THR M 422 2.413 -46.266-130.918 1.00117.05 O
+ATOM 12407 CG2 THR M 422 4.211 -45.778-132.451 1.00128.88 C
+ATOM 12408 H THR M 422 3.337 -44.018-130.303 1.00 0.00 H
+ATOM 12409 HA THR M 422 2.608 -43.722-133.093 1.00 0.00 H
+ATOM 12410 HB THR M 422 2.168 -46.184-132.961 1.00 0.00 H
+ATOM 12411 HG1 THR M 422 2.009 -45.616-130.338 1.00 0.00 H
+ATOM 12412 1HG2 THR M 422 4.495 -46.830-132.462 1.00 0.00 H
+ATOM 12413 2HG2 THR M 422 4.443 -45.329-133.417 1.00 0.00 H
+ATOM 12414 3HG2 THR M 422 4.765 -45.261-131.669 1.00 0.00 H
+ATOM 12415 N ALA M 423 0.123 -43.859-133.188 1.00103.44 N
+ATOM 12416 CA ALA M 423 -1.316 -43.656-133.240 1.00 80.26 C
+ATOM 12417 C ALA M 423 -2.035 -44.950-133.596 1.00 78.56 C
+ATOM 12418 O ALA M 423 -1.436 -45.914-134.074 1.00 80.89 O
+ATOM 12419 CB ALA M 423 -1.672 -42.568-134.255 1.00 79.89 C
+ATOM 12420 H ALA M 423 0.655 -43.831-134.046 1.00 0.00 H
+ATOM 12421 HA ALA M 423 -1.649 -43.336-132.252 1.00 0.00 H
+ATOM 12422 1HB ALA M 423 -2.753 -42.432-134.278 1.00 0.00 H
+ATOM 12423 2HB ALA M 423 -1.194 -41.631-133.967 1.00 0.00 H
+ATOM 12424 3HB ALA M 423 -1.323 -42.864-135.243 1.00 0.00 H
+ATOM 12425 N LEU M 424 -3.340 -44.959-133.351 1.00 80.47 N
+ATOM 12426 CA LEU M 424 -4.197 -46.075-133.737 1.00 82.93 C
+ATOM 12427 C LEU M 424 -4.906 -45.687-135.030 1.00 83.21 C
+ATOM 12428 O LEU M 424 -5.770 -44.804-135.030 1.00 81.20 O
+ATOM 12429 CB LEU M 424 -5.195 -46.415-132.632 1.00 84.32 C
+ATOM 12430 CG LEU M 424 -6.100 -47.622-132.887 1.00 86.26 C
+ATOM 12431 CD1 LEU M 424 -5.280 -48.830-133.324 1.00104.00 C
+ATOM 12432 CD2 LEU M 424 -6.929 -47.955-131.656 1.00 79.08 C
+ATOM 12433 H LEU M 424 -3.749 -44.164-132.881 1.00 0.00 H
+ATOM 12434 HA LEU M 424 -3.570 -46.949-133.911 1.00 0.00 H
+ATOM 12435 1HB LEU M 424 -4.643 -46.609-131.714 1.00 0.00 H
+ATOM 12436 2HB LEU M 424 -5.840 -45.552-132.469 1.00 0.00 H
+ATOM 12437 HG LEU M 424 -6.776 -47.402-133.713 1.00 0.00 H
+ATOM 12438 1HD1 LEU M 424 -5.944 -49.676-133.500 1.00 0.00 H
+ATOM 12439 2HD1 LEU M 424 -4.744 -48.593-134.243 1.00 0.00 H
+ATOM 12440 3HD1 LEU M 424 -4.565 -49.086-132.543 1.00 0.00 H
+ATOM 12441 1HD2 LEU M 424 -7.563 -48.817-131.867 1.00 0.00 H
+ATOM 12442 2HD2 LEU M 424 -6.266 -48.188-130.823 1.00 0.00 H
+ATOM 12443 3HD2 LEU M 424 -7.553 -47.100-131.395 1.00 0.00 H
+ATOM 12444 N GLN M 425 -4.535 -46.341-136.127 1.00 87.50 N
+ATOM 12445 CA GLN M 425 -5.019 -45.988-137.454 1.00 92.44 C
+ATOM 12446 C GLN M 425 -6.088 -46.962-137.924 1.00 88.81 C
+ATOM 12447 O GLN M 425 -6.016 -48.163-137.650 1.00 83.39 O
+ATOM 12448 CB GLN M 425 -3.873 -45.968-138.467 1.00106.75 C
+ATOM 12449 CG GLN M 425 -2.799 -44.942-138.171 1.00124.42 C
+ATOM 12450 CD GLN M 425 -1.956 -44.634-139.387 1.00135.30 C
+ATOM 12451 OE1 GLN M 425 -2.265 -45.073-140.494 1.00125.73 O
+ATOM 12452 NE2 GLN M 425 -0.889 -43.867-139.191 1.00148.87 N
+ATOM 12453 H GLN M 425 -3.891 -47.113-136.027 1.00 0.00 H
+ATOM 12454 HA GLN M 425 -5.456 -44.991-137.409 1.00 0.00 H
+ATOM 12455 1HB GLN M 425 -3.400 -46.949-138.501 1.00 0.00 H
+ATOM 12456 2HB GLN M 425 -4.270 -45.762-139.461 1.00 0.00 H
+ATOM 12457 1HG GLN M 425 -3.274 -44.019-137.838 1.00 0.00 H
+ATOM 12458 2HG GLN M 425 -2.147 -45.329-137.388 1.00 0.00 H
+ATOM 12459 1HE2 GLN M 425 -0.294 -43.630-139.960 1.00 0.00 H
+ATOM 12460 2HE2 GLN M 425 -0.679 -43.526-138.275 1.00 0.00 H
+ATOM 12461 N ARG M 426 -7.076 -46.429-138.640 1.00 90.82 N
+ATOM 12462 CA ARG M 426 -8.095 -47.233-139.297 1.00 82.25 C
+ATOM 12463 C ARG M 426 -8.382 -46.639-140.667 1.00 79.33 C
+ATOM 12464 O ARG M 426 -8.195 -45.439-140.894 1.00 70.14 O
+ATOM 12465 CB ARG M 426 -9.385 -47.313-138.465 1.00 67.30 C
+ATOM 12466 CG ARG M 426 -9.272 -48.212-137.247 1.00 65.88 C
+ATOM 12467 CD ARG M 426 -8.898 -49.617-137.663 1.00 75.00 C
+ATOM 12468 NE ARG M 426 -7.950 -50.233-136.740 1.00 82.13 N
+ATOM 12469 CZ ARG M 426 -8.285 -51.101-135.792 1.00 84.88 C
+ATOM 12470 NH1 ARG M 426 -9.552 -51.468-135.647 1.00 75.47 N
+ATOM 12471 NH2 ARG M 426 -7.349 -51.612-135.001 1.00 80.52 N
+ATOM 12472 H ARG M 426 -7.112 -45.423-138.725 1.00 0.00 H
+ATOM 12473 HA ARG M 426 -7.710 -48.246-139.420 1.00 0.00 H
+ATOM 12474 1HB ARG M 426 -9.662 -46.315-138.127 1.00 0.00 H
+ATOM 12475 2HB ARG M 426 -10.198 -47.685-139.089 1.00 0.00 H
+ATOM 12476 1HG ARG M 426 -8.504 -47.823-136.578 1.00 0.00 H
+ATOM 12477 2HG ARG M 426 -10.229 -48.239-136.724 1.00 0.00 H
+ATOM 12478 1HD ARG M 426 -9.793 -50.238-137.692 1.00 0.00 H
+ATOM 12479 2HD ARG M 426 -8.440 -49.594-138.651 1.00 0.00 H
+ATOM 12480 HE ARG M 426 -6.975 -49.981-136.830 1.00 0.00 H
+ATOM 12481 1HH1 ARG M 426 -10.261 -51.087-136.257 1.00 0.00 H
+ATOM 12482 2HH1 ARG M 426 -9.807 -52.128-134.927 1.00 0.00 H
+ATOM 12483 1HH2 ARG M 426 -6.383 -51.340-135.121 1.00 0.00 H
+ATOM 12484 2HH2 ARG M 426 -7.602 -52.272-134.280 1.00 0.00 H
+ATOM 12485 N VAL M 427 -8.821 -47.489-141.581 1.00 80.09 N
+ATOM 12486 CA VAL M 427 -9.160 -47.061-142.932 1.00 86.91 C
+ATOM 12487 C VAL M 427 -10.633 -46.682-142.974 1.00 89.19 C
+ATOM 12488 O VAL M 427 -11.467 -47.269-142.277 1.00103.51 O
+ATOM 12489 CB VAL M 427 -8.828 -48.162-143.960 1.00102.47 C
+ATOM 12490 CG1 VAL M 427 -8.794 -47.584-145.363 1.00110.38 C
+ATOM 12491 CG2 VAL M 427 -7.505 -48.831-143.617 1.00110.29 C
+ATOM 12492 H VAL M 427 -8.924 -48.463-141.333 1.00 0.00 H
+ATOM 12493 HA VAL M 427 -8.570 -46.176-143.173 1.00 0.00 H
+ATOM 12494 HB VAL M 427 -9.622 -48.909-143.947 1.00 0.00 H
+ATOM 12495 1HG1 VAL M 427 -8.559 -48.374-146.077 1.00 0.00 H
+ATOM 12496 2HG1 VAL M 427 -9.767 -47.156-145.604 1.00 0.00 H
+ATOM 12497 3HG1 VAL M 427 -8.031 -46.808-145.418 1.00 0.00 H
+ATOM 12498 1HG2 VAL M 427 -7.288 -49.605-144.352 1.00 0.00 H
+ATOM 12499 2HG2 VAL M 427 -6.708 -48.087-143.626 1.00 0.00 H
+ATOM 12500 3HG2 VAL M 427 -7.571 -49.280-142.626 1.00 0.00 H
+ATOM 12501 N ASP M 428 -10.954 -45.680-143.793 1.00 78.56 N
+ATOM 12502 CA ASP M 428 -12.334 -45.230-143.943 1.00 73.88 C
+ATOM 12503 C ASP M 428 -13.219 -46.370-144.437 1.00 81.66 C
+ATOM 12504 O ASP M 428 -12.854 -47.100-145.364 1.00 89.49 O
+ATOM 12505 CB ASP M 428 -12.392 -44.049-144.915 1.00 76.39 C
+ATOM 12506 CG ASP M 428 -13.810 -43.564-145.176 1.00 77.02 C
+ATOM 12507 OD1 ASP M 428 -14.673 -43.711-144.287 1.00 84.39 O
+ATOM 12508 OD2 ASP M 428 -14.060 -43.027-146.277 1.00 67.02 O
+ATOM 12509 H ASP M 428 -10.227 -45.221-144.322 1.00 0.00 H
+ATOM 12510 HA ASP M 428 -12.700 -44.905-142.969 1.00 0.00 H
+ATOM 12511 1HB ASP M 428 -11.808 -43.219-144.515 1.00 0.00 H
+ATOM 12512 2HB ASP M 428 -11.942 -44.337-145.865 1.00 0.00 H
+ATOM 12513 N LEU M 429 -14.385 -46.528-143.805 1.00 71.77 N
+ATOM 12514 CA LEU M 429 -15.314 -47.579-144.203 1.00 83.99 C
+ATOM 12515 C LEU M 429 -16.213 -47.161-145.360 1.00 84.78 C
+ATOM 12516 O LEU M 429 -16.784 -48.027-146.030 1.00 93.23 O
+ATOM 12517 CB LEU M 429 -16.174 -48.017-143.013 1.00 83.94 C
+ATOM 12518 CG LEU M 429 -15.495 -48.910-141.968 1.00 89.80 C
+ATOM 12519 CD1 LEU M 429 -14.633 -48.102-141.005 1.00108.63 C
+ATOM 12520 CD2 LEU M 429 -16.521 -49.736-141.211 1.00 75.87 C
+ATOM 12521 H LEU M 429 -14.633 -45.916-143.041 1.00 0.00 H
+ATOM 12522 HA LEU M 429 -14.738 -48.436-144.550 1.00 0.00 H
+ATOM 12523 1HB LEU M 429 -16.530 -47.128-142.495 1.00 0.00 H
+ATOM 12524 2HB LEU M 429 -17.039 -48.562-143.391 1.00 0.00 H
+ATOM 12525 HG LEU M 429 -14.799 -49.586-142.464 1.00 0.00 H
+ATOM 12526 1HD1 LEU M 429 -14.170 -48.773-140.281 1.00 0.00 H
+ATOM 12527 2HD1 LEU M 429 -13.856 -47.579-141.563 1.00 0.00 H
+ATOM 12528 3HD1 LEU M 429 -15.255 -47.377-140.481 1.00 0.00 H
+ATOM 12529 1HD2 LEU M 429 -16.014 -50.362-140.476 1.00 0.00 H
+ATOM 12530 2HD2 LEU M 429 -17.219 -49.071-140.702 1.00 0.00 H
+ATOM 12531 3HD2 LEU M 429 -17.067 -50.369-141.911 1.00 0.00 H
+ATOM 12532 N PHE M 430 -16.350 -45.861-145.608 1.00 79.78 N
+ATOM 12533 CA PHE M 430 -17.074 -45.386-146.777 1.00 86.96 C
+ATOM 12534 C PHE M 430 -16.172 -45.208-147.991 1.00 90.56 C
+ATOM 12535 O PHE M 430 -16.678 -45.133-149.117 1.00 74.95 O
+ATOM 12536 CB PHE M 430 -17.788 -44.074-146.442 1.00 80.73 C
+ATOM 12537 CG PHE M 430 -18.870 -44.230-145.413 1.00 77.01 C
+ATOM 12538 CD1 PHE M 430 -19.134 -43.224-144.501 1.00 76.19 C
+ATOM 12539 CD2 PHE M 430 -19.626 -45.390-145.360 1.00 75.03 C
+ATOM 12540 CE1 PHE M 430 -20.130 -43.372-143.551 1.00 67.08 C
+ATOM 12541 CE2 PHE M 430 -20.623 -45.543-144.416 1.00 65.90 C
+ATOM 12542 CZ PHE M 430 -20.874 -44.534-143.509 1.00 67.42 C
+ATOM 12543 H PHE M 430 -15.944 -45.188-144.974 1.00 0.00 H
+ATOM 12544 HA PHE M 430 -17.817 -46.136-147.052 1.00 0.00 H
+ATOM 12545 1HB PHE M 430 -17.063 -43.350-146.072 1.00 0.00 H
+ATOM 12546 2HB PHE M 430 -18.231 -43.660-147.347 1.00 0.00 H
+ATOM 12547 HD1 PHE M 430 -18.547 -42.306-144.537 1.00 0.00 H
+ATOM 12548 HD2 PHE M 430 -19.427 -46.188-146.077 1.00 0.00 H
+ATOM 12549 HE1 PHE M 430 -20.326 -42.571-142.838 1.00 0.00 H
+ATOM 12550 HE2 PHE M 430 -21.211 -46.460-144.386 1.00 0.00 H
+ATOM 12551 HZ PHE M 430 -21.656 -44.655-142.761 1.00 0.00 H
+ATOM 12552 N MET M 431 -14.855 -45.145-147.779 1.00 94.70 N
+ATOM 12553 CA MET M 431 -13.859 -45.157-148.851 1.00 98.50 C
+ATOM 12554 C MET M 431 -14.079 -44.018-149.846 1.00 90.43 C
+ATOM 12555 O MET M 431 -14.147 -44.223-151.059 1.00102.48 O
+ATOM 12556 CB MET M 431 -13.833 -46.517-149.552 1.00109.82 C
+ATOM 12557 CG MET M 431 -13.260 -47.628-148.680 1.00125.41 C
+ATOM 12558 SD MET M 431 -13.284 -49.251-149.460 1.00135.46 S
+ATOM 12559 CE MET M 431 -15.050 -49.517-149.586 1.00141.18 C
+ATOM 12560 H MET M 431 -14.545 -45.086-146.820 1.00 0.00 H
+ATOM 12561 HA MET M 431 -12.878 -44.975-148.413 1.00 0.00 H
+ATOM 12562 1HB MET M 431 -14.844 -46.794-149.846 1.00 0.00 H
+ATOM 12563 2HB MET M 431 -13.235 -46.446-150.462 1.00 0.00 H
+ATOM 12564 1HG MET M 431 -12.226 -47.395-148.426 1.00 0.00 H
+ATOM 12565 2HG MET M 431 -13.831 -47.695-147.754 1.00 0.00 H
+ATOM 12566 1HE MET M 431 -15.240 -50.485-150.051 1.00 0.00 H
+ATOM 12567 2HE MET M 431 -15.493 -49.499-148.589 1.00 0.00 H
+ATOM 12568 3HE MET M 431 -15.494 -48.729-150.195 1.00 0.00 H
+ATOM 12569 N GLY M 432 -14.184 -42.803-149.316 1.00 84.39 N
+ATOM 12570 CA GLY M 432 -14.223 -41.606-150.125 1.00 74.23 C
+ATOM 12571 C GLY M 432 -15.594 -41.154-150.574 1.00 90.64 C
+ATOM 12572 O GLY M 432 -15.689 -40.132-151.265 1.00102.24 O
+ATOM 12573 H GLY M 432 -14.238 -42.719-148.311 1.00 0.00 H
+ATOM 12574 1HA GLY M 432 -13.776 -40.779-149.573 1.00 0.00 H
+ATOM 12575 2HA GLY M 432 -13.623 -41.754-151.022 1.00 0.00 H
+ATOM 12576 N GLN M 433 -16.659 -41.876-150.213 1.00 81.10 N
+ATOM 12577 CA GLN M 433 -17.993 -41.481-150.658 1.00 83.39 C
+ATOM 12578 C GLN M 433 -18.388 -40.121-150.100 1.00 77.23 C
+ATOM 12579 O GLN M 433 -19.078 -39.346-150.773 1.00 74.28 O
+ATOM 12580 CB GLN M 433 -19.021 -42.541-150.261 1.00 85.24 C
+ATOM 12581 CG GLN M 433 -20.471 -42.111-150.470 1.00100.03 C
+ATOM 12582 CD GLN M 433 -20.809 -41.838-151.927 1.00114.57 C
+ATOM 12583 OE1 GLN M 433 -20.204 -42.408-152.838 1.00118.73 O
+ATOM 12584 NE2 GLN M 433 -21.782 -40.960-152.153 1.00117.68 N
+ATOM 12585 H GLN M 433 -16.557 -42.697-149.633 1.00 0.00 H
+ATOM 12586 HA GLN M 433 -17.983 -41.393-151.744 1.00 0.00 H
+ATOM 12587 1HB GLN M 433 -18.851 -43.448-150.841 1.00 0.00 H
+ATOM 12588 2HB GLN M 433 -18.893 -42.796-149.209 1.00 0.00 H
+ATOM 12589 1HG GLN M 433 -21.129 -42.905-150.116 1.00 0.00 H
+ATOM 12590 2HG GLN M 433 -20.653 -41.196-149.906 1.00 0.00 H
+ATOM 12591 1HE2 GLN M 433 -22.049 -40.739-153.092 1.00 0.00 H
+ATOM 12592 2HE2 GLN M 433 -22.247 -40.520-151.385 1.00 0.00 H
+ATOM 12593 N PHE M 434 -17.951 -39.805-148.886 1.00 76.81 N
+ATOM 12594 CA PHE M 434 -18.229 -38.516-148.272 1.00 76.37 C
+ATOM 12595 C PHE M 434 -16.969 -37.664-148.171 1.00 80.89 C
+ATOM 12596 O PHE M 434 -16.859 -36.802-147.297 1.00 85.89 O
+ATOM 12597 CB PHE M 434 -18.875 -38.721-146.907 1.00 70.79 C
+ATOM 12598 CG PHE M 434 -20.108 -39.574-146.959 1.00 77.63 C
+ATOM 12599 CD1 PHE M 434 -20.025 -40.945-146.787 1.00 76.43 C
+ATOM 12600 CD2 PHE M 434 -21.349 -39.007-147.198 1.00 85.45 C
+ATOM 12601 CE1 PHE M 434 -21.156 -41.735-146.842 1.00 76.03 C
+ATOM 12602 CE2 PHE M 434 -22.484 -39.792-147.253 1.00 86.24 C
+ATOM 12603 CZ PHE M 434 -22.387 -41.157-147.074 1.00 83.72 C
+ATOM 12604 H PHE M 434 -17.407 -40.486-148.375 1.00 0.00 H
+ATOM 12605 HA PHE M 434 -18.922 -37.969-148.913 1.00 0.00 H
+ATOM 12606 1HB PHE M 434 -18.159 -39.189-146.233 1.00 0.00 H
+ATOM 12607 2HB PHE M 434 -19.141 -37.754-146.482 1.00 0.00 H
+ATOM 12608 HD1 PHE M 434 -19.051 -41.401-146.605 1.00 0.00 H
+ATOM 12609 HD2 PHE M 434 -21.425 -37.928-147.340 1.00 0.00 H
+ATOM 12610 HE1 PHE M 434 -21.075 -42.813-146.702 1.00 0.00 H
+ATOM 12611 HE2 PHE M 434 -23.456 -39.335-147.438 1.00 0.00 H
+ATOM 12612 HZ PHE M 434 -23.282 -41.777-147.117 1.00 0.00 H
+ATOM 12613 N SER M 435 -16.019 -37.889-149.074 1.00 86.14 N
+ATOM 12614 CA SER M 435 -14.763 -37.154-149.091 1.00 87.41 C
+ATOM 12615 C SER M 435 -14.890 -35.776-149.721 1.00 91.25 C
+ATOM 12616 O SER M 435 -13.865 -35.129-149.959 1.00 87.96 O
+ATOM 12617 CB SER M 435 -13.692 -37.958-149.830 1.00 85.76 C
+ATOM 12618 OG SER M 435 -14.033 -38.111-151.195 1.00 93.67 O
+ATOM 12619 H SER M 435 -16.183 -38.600-149.773 1.00 0.00 H
+ATOM 12620 HA SER M 435 -14.438 -36.999-148.061 1.00 0.00 H
+ATOM 12621 1HB SER M 435 -12.732 -37.450-149.744 1.00 0.00 H
+ATOM 12622 2HB SER M 435 -13.586 -38.937-149.364 1.00 0.00 H
+ATOM 12623 HG SER M 435 -14.872 -37.659-151.311 1.00 0.00 H
+ATOM 12624 N GLU M 436 -16.112 -35.317-150.017 1.00 94.74 N
+ATOM 12625 CA GLU M 436 -16.289 -33.964-150.533 1.00103.88 C
+ATOM 12626 C GLU M 436 -17.457 -33.241-149.865 1.00 96.03 C
+ATOM 12627 O GLU M 436 -17.958 -32.252-150.417 1.00 87.64 O
+ATOM 12628 CB GLU M 436 -16.465 -33.974-152.056 1.00113.89 C
+ATOM 12629 CG GLU M 436 -15.293 -34.607-152.799 1.00124.81 C
+ATOM 12630 CD GLU M 436 -15.014 -33.952-154.136 1.00141.65 C
+ATOM 12631 OE1 GLU M 436 -15.769 -33.034-154.520 1.00145.95 O
+ATOM 12632 OE2 GLU M 436 -14.035 -34.354-154.802 1.00151.10 O
+ATOM 12633 H GLU M 436 -16.924 -35.904-149.886 1.00 0.00 H
+ATOM 12634 HA GLU M 436 -15.398 -33.383-150.294 1.00 0.00 H
+ATOM 12635 1HB GLU M 436 -17.371 -34.522-152.314 1.00 0.00 H
+ATOM 12636 2HB GLU M 436 -16.587 -32.952-152.415 1.00 0.00 H
+ATOM 12637 1HG GLU M 436 -14.400 -34.532-152.179 1.00 0.00 H
+ATOM 12638 2HG GLU M 436 -15.504 -35.664-152.956 1.00 0.00 H
+ATOM 12639 N VAL M 437 -17.897 -33.707-148.693 1.00100.02 N
+ATOM 12640 CA VAL M 437 -18.842 -32.994-147.842 1.00 90.87 C
+ATOM 12641 C VAL M 437 -18.310 -33.012-146.415 1.00 99.62 C
+ATOM 12642 O VAL M 437 -17.338 -33.698-146.097 1.00104.72 O
+ATOM 12643 CB VAL M 437 -20.262 -33.594-147.886 1.00 68.62 C
+ATOM 12644 CG1 VAL M 437 -20.848 -33.477-149.274 1.00 70.85 C
+ATOM 12645 CG2 VAL M 437 -20.232 -35.041-147.434 1.00 66.22 C
+ATOM 12646 H VAL M 437 -17.546 -34.605-148.393 1.00 0.00 H
+ATOM 12647 HA VAL M 437 -18.912 -31.963-148.191 1.00 0.00 H
+ATOM 12648 HB VAL M 437 -20.909 -33.021-147.222 1.00 0.00 H
+ATOM 12649 1HG1 VAL M 437 -21.850 -33.906-149.283 1.00 0.00 H
+ATOM 12650 2HG1 VAL M 437 -20.901 -32.426-149.559 1.00 0.00 H
+ATOM 12651 3HG1 VAL M 437 -20.217 -34.015-149.982 1.00 0.00 H
+ATOM 12652 1HG2 VAL M 437 -21.240 -35.454-147.468 1.00 0.00 H
+ATOM 12653 2HG2 VAL M 437 -19.582 -35.615-148.094 1.00 0.00 H
+ATOM 12654 3HG2 VAL M 437 -19.853 -35.096-146.413 1.00 0.00 H
+ATOM 12655 N LEU M 438 -18.968 -32.246-145.549 1.00 94.60 N
+ATOM 12656 CA LEU M 438 -18.606 -32.163-144.135 1.00 82.80 C
+ATOM 12657 C LEU M 438 -19.711 -32.821-143.316 1.00 78.95 C
+ATOM 12658 O LEU M 438 -20.769 -32.227-143.092 1.00 77.88 O
+ATOM 12659 CB LEU M 438 -18.389 -30.715-143.703 1.00 74.48 C
+ATOM 12660 CG LEU M 438 -18.129 -30.533-142.205 1.00 69.56 C
+ATOM 12661 CD1 LEU M 438 -16.869 -31.271-141.783 1.00 68.05 C
+ATOM 12662 CD2 LEU M 438 -18.048 -29.062-141.827 1.00 70.50 C
+ATOM 12663 H LEU M 438 -19.748 -31.703-145.890 1.00 0.00 H
+ATOM 12664 HA LEU M 438 -17.675 -32.707-143.984 1.00 0.00 H
+ATOM 12665 1HB LEU M 438 -17.538 -30.313-144.250 1.00 0.00 H
+ATOM 12666 2HB LEU M 438 -19.273 -30.136-143.971 1.00 0.00 H
+ATOM 12667 HG LEU M 438 -18.939 -30.990-141.637 1.00 0.00 H
+ATOM 12668 1HD1 LEU M 438 -16.704 -31.128-140.715 1.00 0.00 H
+ATOM 12669 2HD1 LEU M 438 -16.983 -32.335-141.992 1.00 0.00 H
+ATOM 12670 3HD1 LEU M 438 -16.016 -30.881-142.337 1.00 0.00 H
+ATOM 12671 1HD2 LEU M 438 -17.863 -28.971-140.756 1.00 0.00 H
+ATOM 12672 2HD2 LEU M 438 -17.234 -28.589-142.377 1.00 0.00 H
+ATOM 12673 3HD2 LEU M 438 -18.988 -28.570-142.076 1.00 0.00 H
+ATOM 12674 N LEU M 439 -19.465 -34.050-142.872 1.00 71.56 N
+ATOM 12675 CA LEU M 439 -20.401 -34.720-141.984 1.00 68.52 C
+ATOM 12676 C LEU M 439 -20.278 -34.144-140.583 1.00 80.62 C
+ATOM 12677 O LEU M 439 -19.174 -33.879-140.099 1.00 92.19 O
+ATOM 12678 CB LEU M 439 -20.140 -36.221-141.950 1.00 57.79 C
+ATOM 12679 CG LEU M 439 -20.045 -36.931-143.291 1.00 65.59 C
+ATOM 12680 CD1 LEU M 439 -19.823 -38.411-143.058 1.00 62.50 C
+ATOM 12681 CD2 LEU M 439 -21.296 -36.677-144.117 1.00 79.22 C
+ATOM 12682 H LEU M 439 -18.621 -34.530-143.150 1.00 0.00 H
+ATOM 12683 HA LEU M 439 -21.411 -34.555-142.358 1.00 0.00 H
+ATOM 12684 1HB LEU M 439 -19.202 -36.399-141.426 1.00 0.00 H
+ATOM 12685 2HB LEU M 439 -20.942 -36.701-141.389 1.00 0.00 H
+ATOM 12686 HG LEU M 439 -19.178 -36.560-143.838 1.00 0.00 H
+ATOM 12687 1HD1 LEU M 439 -19.754 -38.924-144.017 1.00 0.00 H
+ATOM 12688 2HD1 LEU M 439 -18.897 -38.557-142.502 1.00 0.00 H
+ATOM 12689 3HD1 LEU M 439 -20.657 -38.819-142.488 1.00 0.00 H
+ATOM 12690 1HD2 LEU M 439 -21.211 -37.192-145.074 1.00 0.00 H
+ATOM 12691 2HD2 LEU M 439 -22.168 -37.050-143.580 1.00 0.00 H
+ATOM 12692 3HD2 LEU M 439 -21.407 -35.606-144.290 1.00 0.00 H
+ATOM 12693 N THR M 440 -21.421 -33.945-139.931 1.00 71.55 N
+ATOM 12694 CA THR M 440 -21.445 -33.333-138.614 1.00 62.51 C
+ATOM 12695 C THR M 440 -22.234 -34.119-137.575 1.00 69.32 C
+ATOM 12696 O THR M 440 -22.211 -33.735-136.400 1.00 75.12 O
+ATOM 12697 CB THR M 440 -22.015 -31.907-138.694 1.00 63.62 C
+ATOM 12698 OG1 THR M 440 -23.300 -31.936-139.325 1.00 67.46 O
+ATOM 12699 CG2 THR M 440 -21.085 -31.002-139.491 1.00 61.74 C
+ATOM 12700 H THR M 440 -22.292 -34.225-140.359 1.00 0.00 H
+ATOM 12701 HA THR M 440 -20.423 -33.279-138.239 1.00 0.00 H
+ATOM 12702 HB THR M 440 -22.130 -31.504-137.688 1.00 0.00 H
+ATOM 12703 HG1 THR M 440 -23.521 -32.841-139.558 1.00 0.00 H
+ATOM 12704 1HG2 THR M 440 -21.505 -29.998-139.536 1.00 0.00 H
+ATOM 12705 2HG2 THR M 440 -20.109 -30.966-139.007 1.00 0.00 H
+ATOM 12706 3HG2 THR M 440 -20.974 -31.394-140.501 1.00 0.00 H
+ATOM 12707 N SER M 441 -22.921 -35.194-137.956 1.00 63.05 N
+ATOM 12708 CA SER M 441 -23.655 -35.993-136.985 1.00 66.68 C
+ATOM 12709 C SER M 441 -23.617 -37.455-137.403 1.00 65.45 C
+ATOM 12710 O SER M 441 -23.633 -37.772-138.596 1.00 78.10 O
+ATOM 12711 CB SER M 441 -25.106 -35.509-136.850 1.00 76.60 C
+ATOM 12712 OG SER M 441 -25.889 -36.406-136.081 1.00 81.46 O
+ATOM 12713 H SER M 441 -22.938 -35.465-138.929 1.00 0.00 H
+ATOM 12714 HA SER M 441 -23.168 -35.891-136.014 1.00 0.00 H
+ATOM 12715 1HB SER M 441 -25.119 -34.526-136.380 1.00 0.00 H
+ATOM 12716 2HB SER M 441 -25.548 -35.404-137.840 1.00 0.00 H
+ATOM 12717 HG SER M 441 -25.300 -37.119-135.825 1.00 0.00 H
+ATOM 12718 N ILE M 442 -23.571 -38.347-136.416 1.00 63.07 N
+ATOM 12719 CA ILE M 442 -23.614 -39.780-136.693 1.00 60.06 C
+ATOM 12720 C ILE M 442 -24.306 -40.497-135.541 1.00 59.13 C
+ATOM 12721 O ILE M 442 -24.190 -40.101-134.377 1.00 58.92 O
+ATOM 12722 CB ILE M 442 -22.206 -40.364-136.941 1.00 51.54 C
+ATOM 12723 CG1 ILE M 442 -22.304 -41.865-137.233 1.00 51.50 C
+ATOM 12724 CG2 ILE M 442 -21.303 -40.102-135.751 1.00 51.26 C
+ATOM 12725 CD1 ILE M 442 -21.000 -42.519-137.600 1.00 53.54 C
+ATOM 12726 H ILE M 442 -23.505 -38.033-135.458 1.00 0.00 H
+ATOM 12727 HA ILE M 442 -24.206 -39.940-137.593 1.00 0.00 H
+ATOM 12728 HB ILE M 442 -21.770 -39.899-137.824 1.00 0.00 H
+ATOM 12729 1HG1 ILE M 442 -22.701 -42.380-136.359 1.00 0.00 H
+ATOM 12730 2HG1 ILE M 442 -23.002 -42.031-138.054 1.00 0.00 H
+ATOM 12731 1HG2 ILE M 442 -20.316 -40.521-135.944 1.00 0.00 H
+ATOM 12732 2HG2 ILE M 442 -21.216 -39.028-135.590 1.00 0.00 H
+ATOM 12733 3HG2 ILE M 442 -21.728 -40.569-134.862 1.00 0.00 H
+ATOM 12734 1HD1 ILE M 442 -21.166 -43.580-137.790 1.00 0.00 H
+ATOM 12735 2HD1 ILE M 442 -20.597 -42.049-138.497 1.00 0.00 H
+ATOM 12736 3HD1 ILE M 442 -20.292 -42.404-136.780 1.00 0.00 H
+ATOM 12737 N SER M 443 -25.062 -41.534-135.893 1.00 59.83 N
+ATOM 12738 CA SER M 443 -25.556 -42.528-134.954 1.00 52.05 C
+ATOM 12739 C SER M 443 -25.616 -43.855-135.698 1.00 62.47 C
+ATOM 12740 O SER M 443 -25.402 -43.916-136.910 1.00 71.99 O
+ATOM 12741 CB SER M 443 -26.917 -42.134-134.371 1.00 62.58 C
+ATOM 12742 OG SER M 443 -27.856 -41.828-135.386 1.00 73.44 O
+ATOM 12743 H SER M 443 -25.297 -41.622-136.871 1.00 0.00 H
+ATOM 12744 HA SER M 443 -24.846 -42.608-134.129 1.00 0.00 H
+ATOM 12745 1HB SER M 443 -27.302 -42.951-133.761 1.00 0.00 H
+ATOM 12746 2HB SER M 443 -26.797 -41.269-133.721 1.00 0.00 H
+ATOM 12747 HG SER M 443 -27.393 -41.947-136.219 1.00 0.00 H
+ATOM 12748 N THR M 444 -25.907 -44.925-134.966 1.00 65.73 N
+ATOM 12749 CA THR M 444 -25.798 -46.259-135.541 1.00 71.66 C
+ATOM 12750 C THR M 444 -26.875 -47.167-134.969 1.00 81.46 C
+ATOM 12751 O THR M 444 -27.164 -47.116-133.769 1.00 90.33 O
+ATOM 12752 CB THR M 444 -24.408 -46.850-135.274 1.00 73.17 C
+ATOM 12753 OG1 THR M 444 -23.457 -46.258-136.168 1.00 75.74 O
+ATOM 12754 CG2 THR M 444 -24.405 -48.359-135.449 1.00 77.96 C
+ATOM 12755 H THR M 444 -26.206 -44.826-134.006 1.00 0.00 H
+ATOM 12756 HA THR M 444 -25.942 -46.184-136.619 1.00 0.00 H
+ATOM 12757 HB THR M 444 -24.103 -46.615-134.255 1.00 0.00 H
+ATOM 12758 HG1 THR M 444 -23.903 -45.624-136.734 1.00 0.00 H
+ATOM 12759 1HG2 THR M 444 -23.405 -48.746-135.252 1.00 0.00 H
+ATOM 12760 2HG2 THR M 444 -25.112 -48.808-134.751 1.00 0.00 H
+ATOM 12761 3HG2 THR M 444 -24.695 -48.607-136.469 1.00 0.00 H
+ATOM 12762 N PHE M 445 -27.470 -47.992-135.833 1.00 69.34 N
+ATOM 12763 CA PHE M 445 -28.391 -49.028-135.386 1.00 67.42 C
+ATOM 12764 C PHE M 445 -28.201 -50.265-136.255 1.00 69.30 C
+ATOM 12765 O PHE M 445 -27.432 -50.260-137.221 1.00 70.14 O
+ATOM 12766 CB PHE M 445 -29.843 -48.536-135.405 1.00 60.83 C
+ATOM 12767 CG PHE M 445 -30.386 -48.284-136.779 1.00 66.66 C
+ATOM 12768 CD1 PHE M 445 -31.181 -49.230-137.407 1.00 75.07 C
+ATOM 12769 CD2 PHE M 445 -30.116 -47.097-137.439 1.00 67.76 C
+ATOM 12770 CE1 PHE M 445 -31.689 -48.999-138.668 1.00 73.16 C
+ATOM 12771 CE2 PHE M 445 -30.622 -46.860-138.701 1.00 73.50 C
+ATOM 12772 CZ PHE M 445 -31.410 -47.813-139.315 1.00 76.68 C
+ATOM 12773 H PHE M 445 -27.278 -47.897-136.820 1.00 0.00 H
+ATOM 12774 HA PHE M 445 -28.137 -49.298-134.360 1.00 0.00 H
+ATOM 12775 1HB PHE M 445 -30.483 -49.272-134.920 1.00 0.00 H
+ATOM 12776 2HB PHE M 445 -29.921 -47.610-134.837 1.00 0.00 H
+ATOM 12777 HD1 PHE M 445 -31.404 -50.165-136.892 1.00 0.00 H
+ATOM 12778 HD2 PHE M 445 -29.493 -46.346-136.952 1.00 0.00 H
+ATOM 12779 HE1 PHE M 445 -32.310 -49.753-139.151 1.00 0.00 H
+ATOM 12780 HE2 PHE M 445 -30.401 -45.924-139.214 1.00 0.00 H
+ATOM 12781 HZ PHE M 445 -31.809 -47.627-140.311 1.00 0.00 H
+ATOM 12782 N ILE M 446 -28.905 -51.337-135.905 1.00 68.91 N
+ATOM 12783 CA ILE M 446 -28.762 -52.626-136.569 1.00 64.23 C
+ATOM 12784 C ILE M 446 -30.105 -53.020-137.168 1.00 81.28 C
+ATOM 12785 O ILE M 446 -31.129 -53.003-136.475 1.00 72.82 O
+ATOM 12786 CB ILE M 446 -28.262 -53.709-135.596 1.00 65.51 C
+ATOM 12787 CG1 ILE M 446 -26.939 -53.291-134.960 1.00 64.71 C
+ATOM 12788 CG2 ILE M 446 -28.091 -55.031-136.312 1.00 71.55 C
+ATOM 12789 CD1 ILE M 446 -26.373 -54.327-134.014 1.00 70.23 C
+ATOM 12790 H ILE M 446 -29.565 -51.245-135.146 1.00 0.00 H
+ATOM 12791 HA ILE M 446 -28.029 -52.524-137.369 1.00 0.00 H
+ATOM 12792 HB ILE M 446 -28.984 -53.835-134.790 1.00 0.00 H
+ATOM 12793 1HG1 ILE M 446 -26.204 -53.099-135.741 1.00 0.00 H
+ATOM 12794 2HG1 ILE M 446 -27.078 -52.361-134.408 1.00 0.00 H
+ATOM 12795 1HG2 ILE M 446 -27.736 -55.783-135.608 1.00 0.00 H
+ATOM 12796 2HG2 ILE M 446 -29.047 -55.346-136.728 1.00 0.00 H
+ATOM 12797 3HG2 ILE M 446 -27.365 -54.917-137.117 1.00 0.00 H
+ATOM 12798 1HD1 ILE M 446 -25.433 -53.965-133.598 1.00 0.00 H
+ATOM 12799 2HD1 ILE M 446 -27.082 -54.508-133.205 1.00 0.00 H
+ATOM 12800 3HD1 ILE M 446 -26.195 -55.255-134.555 1.00 0.00 H
+ATOM 12801 N LYS M 447 -30.097 -53.369-138.452 1.00 80.03 N
+ATOM 12802 CA LYS M 447 -31.255 -53.940-139.138 1.00 79.26 C
+ATOM 12803 C LYS M 447 -30.835 -55.318-139.640 1.00 77.71 C
+ATOM 12804 O LYS M 447 -30.112 -55.430-140.635 1.00 79.73 O
+ATOM 12805 CB LYS M 447 -31.727 -53.052-140.290 1.00 86.08 C
+ATOM 12806 CG LYS M 447 -32.918 -53.603-141.062 1.00 90.57 C
+ATOM 12807 CD LYS M 447 -34.179 -53.596-140.211 1.00 0.00 C
+ATOM 12808 CE LYS M 447 -35.388 -54.067-141.006 1.00 0.00 C
+ATOM 12809 NZ LYS M 447 -36.622 -54.099-140.175 1.00 0.00 N
+ATOM 12810 H LYS M 447 -29.240 -53.227-138.968 1.00 0.00 H
+ATOM 12811 HA LYS M 447 -32.070 -54.037-138.419 1.00 0.00 H
+ATOM 12812 1HB LYS M 447 -32.003 -52.070-139.904 1.00 0.00 H
+ATOM 12813 2HB LYS M 447 -30.909 -52.907-140.997 1.00 0.00 H
+ATOM 12814 1HG LYS M 447 -33.088 -52.996-141.952 1.00 0.00 H
+ATOM 12815 2HG LYS M 447 -32.708 -54.625-141.376 1.00 0.00 H
+ATOM 12816 1HD LYS M 447 -34.041 -54.252-139.351 1.00 0.00 H
+ATOM 12817 2HD LYS M 447 -34.367 -52.585-139.848 1.00 0.00 H
+ATOM 12818 1HE LYS M 447 -35.550 -53.399-141.851 1.00 0.00 H
+ATOM 12819 2HE LYS M 447 -35.200 -55.068-141.393 1.00 0.00 H
+ATOM 12820 1HZ LYS M 447 -37.399 -54.417-140.738 1.00 0.00 H
+ATOM 12821 2HZ LYS M 447 -36.489 -54.731-139.398 1.00 0.00 H
+ATOM 12822 3HZ LYS M 447 -36.818 -53.172-139.826 1.00 0.00 H
+ATOM 12823 N GLY M 448 -31.274 -56.361-138.941 1.00 79.56 N
+ATOM 12824 CA GLY M 448 -30.885 -57.713-139.316 1.00 79.46 C
+ATOM 12825 C GLY M 448 -29.395 -57.911-139.128 1.00 85.61 C
+ATOM 12826 O GLY M 448 -28.839 -57.637-138.058 1.00 87.40 O
+ATOM 12827 H GLY M 448 -31.880 -56.227-138.145 1.00 0.00 H
+ATOM 12828 1HA GLY M 448 -31.436 -58.432-138.709 1.00 0.00 H
+ATOM 12829 2HA GLY M 448 -31.157 -57.895-140.355 1.00 0.00 H
+ATOM 12830 N ASP M 449 -28.733 -58.399-140.174 1.00 88.00 N
+ATOM 12831 CA ASP M 449 -27.283 -58.537-140.176 1.00 88.37 C
+ATOM 12832 C ASP M 449 -26.575 -57.259-140.605 1.00 78.29 C
+ATOM 12833 O ASP M 449 -25.341 -57.240-140.667 1.00 77.03 O
+ATOM 12834 CB ASP M 449 -26.865 -59.684-141.099 1.00 79.87 C
+ATOM 12835 CG ASP M 449 -27.287 -61.050-140.576 1.00 0.00 C
+ATOM 12836 OD1 ASP M 449 -27.585 -61.151-139.409 1.00 0.00 O
+ATOM 12837 OD2 ASP M 449 -27.306 -61.979-141.347 1.00 0.00 O
+ATOM 12838 H ASP M 449 -29.255 -58.682-140.991 1.00 0.00 H
+ATOM 12839 HA ASP M 449 -26.955 -58.754-139.159 1.00 0.00 H
+ATOM 12840 1HB ASP M 449 -27.306 -59.537-142.085 1.00 0.00 H
+ATOM 12841 2HB ASP M 449 -25.781 -59.676-141.221 1.00 0.00 H
+ATOM 12842 N LEU M 450 -27.322 -56.195-140.882 1.00 71.81 N
+ATOM 12843 CA LEU M 450 -26.773 -54.956-141.412 1.00 74.79 C
+ATOM 12844 C LEU M 450 -26.560 -53.937-140.304 1.00 75.24 C
+ATOM 12845 O LEU M 450 -27.383 -53.811-139.393 1.00 83.04 O
+ATOM 12846 CB LEU M 450 -27.704 -54.358-142.465 1.00 80.34 C
+ATOM 12847 CG LEU M 450 -27.937 -55.186-143.721 1.00 72.20 C
+ATOM 12848 CD1 LEU M 450 -28.982 -54.511-144.585 1.00 72.65 C
+ATOM 12849 CD2 LEU M 450 -26.630 -55.353-144.469 1.00 72.39 C
+ATOM 12850 H LEU M 450 -28.316 -56.260-140.713 1.00 0.00 H
+ATOM 12851 HA LEU M 450 -25.815 -55.176-141.882 1.00 0.00 H
+ATOM 12852 1HB LEU M 450 -28.677 -54.184-142.009 1.00 0.00 H
+ATOM 12853 2HB LEU M 450 -27.298 -53.398-142.783 1.00 0.00 H
+ATOM 12854 HG LEU M 450 -28.323 -56.167-143.444 1.00 0.00 H
+ATOM 12855 1HD1 LEU M 450 -29.149 -55.104-145.484 1.00 0.00 H
+ATOM 12856 2HD1 LEU M 450 -29.915 -54.427-144.028 1.00 0.00 H
+ATOM 12857 3HD1 LEU M 450 -28.635 -53.517-144.865 1.00 0.00 H
+ATOM 12858 1HD2 LEU M 450 -26.798 -55.947-145.368 1.00 0.00 H
+ATOM 12859 2HD2 LEU M 450 -26.243 -54.373-144.749 1.00 0.00 H
+ATOM 12860 3HD2 LEU M 450 -25.907 -55.860-143.830 1.00 0.00 H
+ATOM 12861 N THR M 451 -25.459 -53.199-140.399 1.00 77.81 N
+ATOM 12862 CA THR M 451 -25.196 -52.058-139.532 1.00 81.11 C
+ATOM 12863 C THR M 451 -25.435 -50.790-140.339 1.00 62.06 C
+ATOM 12864 O THR M 451 -24.759 -50.556-141.343 1.00 63.29 O
+ATOM 12865 CB THR M 451 -23.766 -52.084-138.991 1.00 86.74 C
+ATOM 12866 OG1 THR M 451 -23.483 -53.376-138.439 1.00 99.09 O
+ATOM 12867 CG2 THR M 451 -23.589 -51.028-137.914 1.00 76.95 C
+ATOM 12868 H THR M 451 -24.781 -53.447-141.105 1.00 0.00 H
+ATOM 12869 HA THR M 451 -25.881 -52.102-138.685 1.00 0.00 H
+ATOM 12870 HB THR M 451 -23.066 -51.889-139.803 1.00 0.00 H
+ATOM 12871 HG1 THR M 451 -24.255 -53.939-138.532 1.00 0.00 H
+ATOM 12872 1HG2 THR M 451 -22.566 -51.059-137.539 1.00 0.00 H
+ATOM 12873 2HG2 THR M 451 -23.793 -50.043-138.333 1.00 0.00 H
+ATOM 12874 3HG2 THR M 451 -24.281 -51.224-137.096 1.00 0.00 H
+ATOM 12875 N ILE M 452 -26.393 -49.980-139.906 1.00 59.41 N
+ATOM 12876 CA ILE M 452 -26.811 -48.795-140.643 1.00 62.24 C
+ATOM 12877 C ILE M 452 -26.436 -47.552-139.850 1.00 63.96 C
+ATOM 12878 O ILE M 452 -26.636 -47.489-138.628 1.00 87.56 O
+ATOM 12879 CB ILE M 452 -28.321 -48.839-140.952 1.00 60.19 C
+ATOM 12880 CG1 ILE M 452 -28.629 -50.051-141.836 1.00 62.56 C
+ATOM 12881 CG2 ILE M 452 -28.777 -47.557-141.622 1.00 59.76 C
+ATOM 12882 CD1 ILE M 452 -30.085 -50.202-142.169 1.00 67.84 C
+ATOM 12883 H ILE M 452 -26.846 -50.200-139.030 1.00 0.00 H
+ATOM 12884 HA ILE M 452 -26.268 -48.766-141.587 1.00 0.00 H
+ATOM 12885 HB ILE M 452 -28.879 -48.965-140.024 1.00 0.00 H
+ATOM 12886 1HG1 ILE M 452 -28.071 -49.972-142.769 1.00 0.00 H
+ATOM 12887 2HG1 ILE M 452 -28.298 -50.961-141.334 1.00 0.00 H
+ATOM 12888 1HG2 ILE M 452 -29.845 -47.615-141.829 1.00 0.00 H
+ATOM 12889 2HG2 ILE M 452 -28.581 -46.713-140.963 1.00 0.00 H
+ATOM 12890 3HG2 ILE M 452 -28.233 -47.421-142.557 1.00 0.00 H
+ATOM 12891 1HD1 ILE M 452 -30.225 -51.082-142.797 1.00 0.00 H
+ATOM 12892 2HD1 ILE M 452 -30.659 -50.318-141.249 1.00 0.00 H
+ATOM 12893 3HD1 ILE M 452 -30.429 -49.317-142.703 1.00 0.00 H
+ATOM 12894 N ALA M 453 -25.880 -46.569-140.554 1.00 56.08 N
+ATOM 12895 CA ALA M 453 -25.403 -45.320-139.980 1.00 54.66 C
+ATOM 12896 C ALA M 453 -26.307 -44.172-140.403 1.00 62.37 C
+ATOM 12897 O ALA M 453 -26.666 -44.057-141.583 1.00 69.81 O
+ATOM 12898 CB ALA M 453 -23.966 -45.033-140.417 1.00 54.32 C
+ATOM 12899 H ALA M 453 -25.792 -46.718-141.549 1.00 0.00 H
+ATOM 12900 HA ALA M 453 -25.425 -45.416-138.894 1.00 0.00 H
+ATOM 12901 1HB ALA M 453 -23.632 -44.094-139.975 1.00 0.00 H
+ATOM 12902 2HB ALA M 453 -23.316 -45.842-140.084 1.00 0.00 H
+ATOM 12903 3HB ALA M 453 -23.924 -44.958-141.502 1.00 0.00 H
+ATOM 12904 N ASN M 454 -26.672 -43.332-139.433 1.00 57.83 N
+ATOM 12905 CA ASN M 454 -27.408 -42.100-139.675 1.00 54.59 C
+ATOM 12906 C ASN M 454 -26.420 -40.946-139.641 1.00 59.27 C
+ATOM 12907 O ASN M 454 -25.767 -40.714-138.617 1.00 67.13 O
+ATOM 12908 CB ASN M 454 -28.506 -41.892-138.633 1.00 54.99 C
+ATOM 12909 CG ASN M 454 -29.372 -43.115-138.448 1.00 66.47 C
+ATOM 12910 OD1 ASN M 454 -30.254 -43.395-139.259 1.00 75.05 O
+ATOM 12911 ND2 ASN M 454 -29.129 -43.853-137.373 1.00 72.49 N
+ATOM 12912 H ASN M 454 -26.418 -43.576-138.486 1.00 0.00 H
+ATOM 12913 HA ASN M 454 -27.879 -42.165-140.657 1.00 0.00 H
+ATOM 12914 1HB ASN M 454 -28.054 -41.633-137.674 1.00 0.00 H
+ATOM 12915 2HB ASN M 454 -29.138 -41.056-138.933 1.00 0.00 H
+ATOM 12916 1HD2 ASN M 454 -29.671 -44.675-137.198 1.00 0.00 H
+ATOM 12917 2HD2 ASN M 454 -28.404 -43.587-136.738 1.00 0.00 H
+ATOM 12918 N LEU M 455 -26.316 -40.228-140.754 1.00 57.14 N
+ATOM 12919 CA LEU M 455 -25.329 -39.176-140.929 1.00 56.14 C
+ATOM 12920 C LEU M 455 -26.017 -37.846-141.192 1.00 61.05 C
+ATOM 12921 O LEU M 455 -27.058 -37.790-141.858 1.00 67.78 O
+ATOM 12922 CB LEU M 455 -24.382 -39.503-142.084 1.00 58.98 C
+ATOM 12923 CG LEU M 455 -23.701 -40.868-142.002 1.00 66.56 C
+ATOM 12924 CD1 LEU M 455 -22.841 -41.108-143.233 1.00 65.48 C
+ATOM 12925 CD2 LEU M 455 -22.869 -40.965-140.734 1.00 63.15 C
+ATOM 12926 H LEU M 455 -26.958 -40.431-141.507 1.00 0.00 H
+ATOM 12927 HA LEU M 455 -24.742 -39.097-140.014 1.00 0.00 H
+ATOM 12928 1HB LEU M 455 -24.944 -39.464-143.016 1.00 0.00 H
+ATOM 12929 2HB LEU M 455 -23.603 -38.741-142.122 1.00 0.00 H
+ATOM 12930 HG LEU M 455 -24.458 -41.652-141.992 1.00 0.00 H
+ATOM 12931 1HD1 LEU M 455 -22.363 -42.085-143.158 1.00 0.00 H
+ATOM 12932 2HD1 LEU M 455 -23.466 -41.078-144.125 1.00 0.00 H
+ATOM 12933 3HD1 LEU M 455 -22.076 -40.335-143.299 1.00 0.00 H
+ATOM 12934 1HD2 LEU M 455 -22.389 -41.943-140.687 1.00 0.00 H
+ATOM 12935 2HD2 LEU M 455 -22.106 -40.187-140.739 1.00 0.00 H
+ATOM 12936 3HD2 LEU M 455 -23.514 -40.835-139.865 1.00 0.00 H
+ATOM 12937 N GLY M 456 -25.428 -36.789-140.662 1.00 55.79 N
+ATOM 12938 CA GLY M 456 -25.885 -35.438-140.940 1.00 59.36 C
+ATOM 12939 C GLY M 456 -24.718 -34.580-141.371 1.00 63.73 C
+ATOM 12940 O GLY M 456 -23.622 -34.676-140.814 1.00 76.54 O
+ATOM 12941 H GLY M 456 -24.638 -36.924-140.047 1.00 0.00 H
+ATOM 12942 1HA GLY M 456 -26.646 -35.465-141.720 1.00 0.00 H
+ATOM 12943 2HA GLY M 456 -26.353 -35.022-140.049 1.00 0.00 H
+ATOM 12944 N THR M 457 -24.969 -33.729-142.363 1.00 64.92 N
+ATOM 12945 CA THR M 457 -23.931 -32.956-143.027 1.00 71.55 C
+ATOM 12946 C THR M 457 -23.947 -31.495-142.591 1.00 69.74 C
+ATOM 12947 O THR M 457 -24.850 -31.025-141.895 1.00 68.36 O
+ATOM 12948 CB THR M 457 -24.094 -33.029-144.548 1.00 83.91 C
+ATOM 12949 OG1 THR M 457 -25.200 -32.206-144.945 1.00 81.05 O
+ATOM 12950 CG2 THR M 457 -24.337 -34.464-144.992 1.00 79.63 C
+ATOM 12951 H THR M 457 -25.928 -33.623-142.661 1.00 0.00 H
+ATOM 12952 HA THR M 457 -22.962 -33.378-142.761 1.00 0.00 H
+ATOM 12953 HB THR M 457 -23.191 -32.654-145.029 1.00 0.00 H
+ATOM 12954 HG1 THR M 457 -25.588 -31.796-144.168 1.00 0.00 H
+ATOM 12955 1HG2 THR M 457 -24.450 -34.495-146.076 1.00 0.00 H
+ATOM 12956 2HG2 THR M 457 -23.491 -35.084-144.697 1.00 0.00 H
+ATOM 12957 3HG2 THR M 457 -25.244 -34.841-144.522 1.00 0.00 H
+ATOM 12958 N SER M 458 -22.915 -30.774-143.036 1.00 79.37 N
+ATOM 12959 CA SER M 458 -22.824 -29.339-142.790 1.00 78.49 C
+ATOM 12960 C SER M 458 -23.916 -28.576-143.527 1.00 80.09 C
+ATOM 12961 O SER M 458 -24.466 -27.602-142.999 1.00 75.44 O
+ATOM 12962 CB SER M 458 -21.445 -28.833-143.210 1.00 80.20 C
+ATOM 12963 OG SER M 458 -21.481 -27.458-143.547 1.00 84.29 O
+ATOM 12964 H SER M 458 -22.179 -31.232-143.555 1.00 0.00 H
+ATOM 12965 HA SER M 458 -22.958 -29.162-141.722 1.00 0.00 H
+ATOM 12966 1HB SER M 458 -20.737 -28.989-142.397 1.00 0.00 H
+ATOM 12967 2HB SER M 458 -21.092 -29.407-144.066 1.00 0.00 H
+ATOM 12968 HG SER M 458 -22.391 -27.179-143.423 1.00 0.00 H
+ATOM 12969 N GLU M 459 -24.241 -28.997-144.750 1.00 87.69 N
+ATOM 12970 CA GLU M 459 -25.256 -28.305-145.532 1.00 89.29 C
+ATOM 12971 C GLU M 459 -26.663 -28.513-144.987 1.00 87.50 C
+ATOM 12972 O GLU M 459 -27.600 -27.888-145.490 1.00 93.84 O
+ATOM 12973 CB GLU M 459 -25.199 -28.770-146.989 1.00 81.89 C
+ATOM 12974 CG GLU M 459 -23.930 -28.368-147.728 1.00 0.00 C
+ATOM 12975 CD GLU M 459 -23.903 -28.854-149.150 1.00 0.00 C
+ATOM 12976 OE1 GLU M 459 -24.811 -29.549-149.538 1.00 0.00 O
+ATOM 12977 OE2 GLU M 459 -22.973 -28.529-149.850 1.00 0.00 O
+ATOM 12978 H GLU M 459 -23.782 -29.805-145.145 1.00 0.00 H
+ATOM 12979 HA GLU M 459 -25.058 -27.234-145.485 1.00 0.00 H
+ATOM 12980 1HB GLU M 459 -25.279 -29.856-147.027 1.00 0.00 H
+ATOM 12981 2HB GLU M 459 -26.048 -28.360-147.535 1.00 0.00 H
+ATOM 12982 1HG GLU M 459 -23.850 -27.281-147.725 1.00 0.00 H
+ATOM 12983 2HG GLU M 459 -23.069 -28.770-147.195 1.00 0.00 H
+ATOM 12984 N GLY M 460 -26.834 -29.358-143.977 1.00 81.32 N
+ATOM 12985 CA GLY M 460 -28.146 -29.632-143.430 1.00 81.96 C
+ATOM 12986 C GLY M 460 -28.809 -30.877-143.964 1.00 80.45 C
+ATOM 12987 O GLY M 460 -30.017 -31.053-143.760 1.00 68.03 O
+ATOM 12988 H GLY M 460 -26.029 -29.821-143.580 1.00 0.00 H
+ATOM 12989 1HA GLY M 460 -28.075 -29.732-142.347 1.00 0.00 H
+ATOM 12990 2HA GLY M 460 -28.807 -28.790-143.632 1.00 0.00 H
+ATOM 12991 N ARG M 461 -28.063 -31.747-144.641 1.00 81.84 N
+ATOM 12992 CA ARG M 461 -28.616 -32.966-145.209 1.00 72.86 C
+ATOM 12993 C ARG M 461 -28.592 -34.087-144.181 1.00 76.53 C
+ATOM 12994 O ARG M 461 -27.640 -34.216-143.404 1.00 82.72 O
+ATOM 12995 CB ARG M 461 -27.830 -33.399-146.447 1.00 75.68 C
+ATOM 12996 CG ARG M 461 -27.480 -32.282-147.407 1.00 94.62 C
+ATOM 12997 CD ARG M 461 -26.936 -32.846-148.710 1.00103.46 C
+ATOM 12998 NE ARG M 461 -27.883 -33.776-149.317 1.00103.81 N
+ATOM 12999 CZ ARG M 461 -28.920 -33.399-150.057 1.00112.89 C
+ATOM 13000 NH1 ARG M 461 -29.140 -32.110-150.274 1.00117.06 N
+ATOM 13001 NH2 ARG M 461 -29.740 -34.305-150.572 1.00117.28 N
+ATOM 13002 H ARG M 461 -27.080 -31.550-144.762 1.00 0.00 H
+ATOM 13003 HA ARG M 461 -29.647 -32.772-145.506 1.00 0.00 H
+ATOM 13004 1HB ARG M 461 -26.898 -33.871-146.139 1.00 0.00 H
+ATOM 13005 2HB ARG M 461 -28.405 -34.141-147.002 1.00 0.00 H
+ATOM 13006 1HG ARG M 461 -28.373 -31.694-147.623 1.00 0.00 H
+ATOM 13007 2HG ARG M 461 -26.722 -31.639-146.957 1.00 0.00 H
+ATOM 13008 1HD ARG M 461 -26.751 -32.032-149.410 1.00 0.00 H
+ATOM 13009 2HD ARG M 461 -26.004 -33.376-148.516 1.00 0.00 H
+ATOM 13010 HE ARG M 461 -27.736 -34.765-149.162 1.00 0.00 H
+ATOM 13011 1HH1 ARG M 461 -28.520 -31.418-149.877 1.00 0.00 H
+ATOM 13012 2HH1 ARG M 461 -29.927 -31.820-150.836 1.00 0.00 H
+ATOM 13013 1HH2 ARG M 461 -29.578 -35.288-150.402 1.00 0.00 H
+ATOM 13014 2HH2 ARG M 461 -30.526 -34.013-151.133 1.00 0.00 H
+ATOM 13015 N PHE M 462 -29.650 -34.892-144.181 1.00 71.18 N
+ATOM 13016 CA PHE M 462 -29.706 -36.131-143.422 1.00 69.53 C
+ATOM 13017 C PHE M 462 -29.680 -37.304-144.389 1.00 75.56 C
+ATOM 13018 O PHE M 462 -30.306 -37.255-145.453 1.00 95.79 O
+ATOM 13019 CB PHE M 462 -30.967 -36.200-142.557 1.00 69.06 C
+ATOM 13020 CG PHE M 462 -31.079 -37.466-141.753 1.00 71.07 C
+ATOM 13021 CD1 PHE M 462 -30.499 -37.557-140.498 1.00 65.47 C
+ATOM 13022 CD2 PHE M 462 -31.759 -38.565-142.251 1.00 75.92 C
+ATOM 13023 CE1 PHE M 462 -30.596 -38.719-139.757 1.00 70.74 C
+ATOM 13024 CE2 PHE M 462 -31.857 -39.732-141.513 1.00 81.56 C
+ATOM 13025 CZ PHE M 462 -31.275 -39.808-140.265 1.00 81.72 C
+ATOM 13026 H PHE M 462 -30.447 -34.620-144.738 1.00 0.00 H
+ATOM 13027 HA PHE M 462 -28.838 -36.172-142.763 1.00 0.00 H
+ATOM 13028 1HB PHE M 462 -30.982 -35.356-141.869 1.00 0.00 H
+ATOM 13029 2HB PHE M 462 -31.848 -36.120-143.192 1.00 0.00 H
+ATOM 13030 HD1 PHE M 462 -29.962 -36.698-140.096 1.00 0.00 H
+ATOM 13031 HD2 PHE M 462 -32.219 -38.504-143.238 1.00 0.00 H
+ATOM 13032 HE1 PHE M 462 -30.136 -38.776-138.771 1.00 0.00 H
+ATOM 13033 HE2 PHE M 462 -32.393 -40.591-141.917 1.00 0.00 H
+ATOM 13034 HZ PHE M 462 -31.350 -40.725-139.682 1.00 0.00 H
+ATOM 13035 N MET M 463 -28.959 -38.359-144.020 1.00 69.04 N
+ATOM 13036 CA MET M 463 -28.869 -39.516-144.898 1.00 77.12 C
+ATOM 13037 C MET M 463 -28.633 -40.776-144.079 1.00 71.28 C
+ATOM 13038 O MET M 463 -27.984 -40.742-143.033 1.00 78.63 O
+ATOM 13039 CB MET M 463 -27.765 -39.332-145.947 1.00 82.66 C
+ATOM 13040 CG MET M 463 -26.484 -38.715-145.440 1.00 90.65 C
+ATOM 13041 SD MET M 463 -25.472 -38.164-146.827 1.00 94.83 S
+ATOM 13042 CE MET M 463 -26.497 -36.855-147.490 1.00100.74 C
+ATOM 13043 H MET M 463 -28.470 -38.373-143.137 1.00 0.00 H
+ATOM 13044 HA MET M 463 -29.820 -39.630-145.418 1.00 0.00 H
+ATOM 13045 1HB MET M 463 -27.510 -40.298-146.380 1.00 0.00 H
+ATOM 13046 2HB MET M 463 -28.133 -38.698-146.755 1.00 0.00 H
+ATOM 13047 1HG MET M 463 -26.718 -37.869-144.795 1.00 0.00 H
+ATOM 13048 2HG MET M 463 -25.934 -39.450-144.852 1.00 0.00 H
+ATOM 13049 1HE MET M 463 -26.006 -36.412-148.357 1.00 0.00 H
+ATOM 13050 2HE MET M 463 -27.463 -37.265-147.789 1.00 0.00 H
+ATOM 13051 3HE MET M 463 -26.648 -36.089-146.728 1.00 0.00 H
+ATOM 13052 N GLN M 464 -29.182 -41.887-144.562 1.00 59.83 N
+ATOM 13053 CA GLN M 464 -28.981 -43.198-143.960 1.00 62.38 C
+ATOM 13054 C GLN M 464 -28.215 -44.081-144.931 1.00 66.49 C
+ATOM 13055 O GLN M 464 -28.626 -44.237-146.090 1.00 78.58 O
+ATOM 13056 CB GLN M 464 -30.309 -43.863-143.597 1.00 65.61 C
+ATOM 13057 CG GLN M 464 -31.043 -43.229-142.438 1.00 66.60 C
+ATOM 13058 CD GLN M 464 -32.221 -44.066-141.986 1.00 72.92 C
+ATOM 13059 OE1 GLN M 464 -32.668 -44.966-142.698 1.00 75.37 O
+ATOM 13060 NE2 GLN M 464 -32.720 -43.787-140.790 1.00 83.25 N
+ATOM 13061 H GLN M 464 -29.763 -41.807-145.384 1.00 0.00 H
+ATOM 13062 HA GLN M 464 -28.404 -43.073-143.044 1.00 0.00 H
+ATOM 13063 1HB GLN M 464 -30.975 -43.841-144.460 1.00 0.00 H
+ATOM 13064 2HB GLN M 464 -30.135 -44.909-143.344 1.00 0.00 H
+ATOM 13065 1HG GLN M 464 -30.354 -43.121-141.600 1.00 0.00 H
+ATOM 13066 2HG GLN M 464 -31.412 -42.251-142.746 1.00 0.00 H
+ATOM 13067 1HE2 GLN M 464 -33.499 -44.308-140.439 1.00 0.00 H
+ATOM 13068 2HE2 GLN M 464 -32.318 -43.056-140.238 1.00 0.00 H
+ATOM 13069 N VAL M 465 -27.111 -44.664-144.448 1.00 69.19 N
+ATOM 13070 CA VAL M 465 -26.210 -45.468-145.263 1.00 81.31 C
+ATOM 13071 C VAL M 465 -26.001 -46.816-144.585 1.00 75.87 C
+ATOM 13072 O VAL M 465 -26.180 -46.964-143.376 1.00 93.20 O
+ATOM 13073 CB VAL M 465 -24.847 -44.772-145.486 1.00 91.40 C
+ATOM 13074 CG1 VAL M 465 -24.152 -45.328-146.722 1.00101.84 C
+ATOM 13075 CG2 VAL M 465 -25.019 -43.265-145.589 1.00 98.55 C
+ATOM 13076 H VAL M 465 -26.903 -44.533-143.468 1.00 0.00 H
+ATOM 13077 HA VAL M 465 -26.670 -45.621-146.240 1.00 0.00 H
+ATOM 13078 HB VAL M 465 -24.192 -44.998-144.645 1.00 0.00 H
+ATOM 13079 1HG1 VAL M 465 -23.195 -44.824-146.859 1.00 0.00 H
+ATOM 13080 2HG1 VAL M 465 -23.983 -46.397-146.595 1.00 0.00 H
+ATOM 13081 3HG1 VAL M 465 -24.778 -45.160-147.598 1.00 0.00 H
+ATOM 13082 1HG2 VAL M 465 -24.047 -42.798-145.745 1.00 0.00 H
+ATOM 13083 2HG2 VAL M 465 -25.674 -43.030-146.428 1.00 0.00 H
+ATOM 13084 3HG2 VAL M 465 -25.460 -42.885-144.667 1.00 0.00 H
+ATOM 13085 N VAL M 466 -25.612 -47.807-145.380 1.00 71.91 N
+ATOM 13086 CA VAL M 466 -25.267 -49.132-144.876 1.00 62.30 C
+ATOM 13087 C VAL M 466 -23.755 -49.225-144.764 1.00 72.12 C
+ATOM 13088 O VAL M 466 -23.035 -48.974-145.738 1.00 85.87 O
+ATOM 13089 CB VAL M 466 -25.822 -50.242-145.784 1.00 75.94 C
+ATOM 13090 CG1 VAL M 466 -25.256 -51.589-145.375 1.00 66.12 C
+ATOM 13091 CG2 VAL M 466 -27.336 -50.265-145.714 1.00 94.48 C
+ATOM 13092 H VAL M 466 -25.555 -47.628-146.372 1.00 0.00 H
+ATOM 13093 HA VAL M 466 -25.708 -49.251-143.886 1.00 0.00 H
+ATOM 13094 HB VAL M 466 -25.510 -50.049-146.810 1.00 0.00 H
+ATOM 13095 1HG1 VAL M 466 -25.657 -52.366-146.027 1.00 0.00 H
+ATOM 13096 2HG1 VAL M 466 -24.170 -51.569-145.462 1.00 0.00 H
+ATOM 13097 3HG1 VAL M 466 -25.535 -51.803-144.343 1.00 0.00 H
+ATOM 13098 1HG2 VAL M 466 -27.718 -51.054-146.361 1.00 0.00 H
+ATOM 13099 2HG2 VAL M 466 -27.650 -50.453-144.687 1.00 0.00 H
+ATOM 13100 3HG2 VAL M 466 -27.730 -49.303-146.043 1.00 0.00 H
+ATOM 13101 N VAL M 467 -23.275 -49.592-143.582 1.00 71.10 N
+ATOM 13102 CA VAL M 467 -21.848 -49.650-143.294 1.00 76.23 C
+ATOM 13103 C VAL M 467 -21.334 -51.047-143.618 1.00 85.14 C
+ATOM 13104 O VAL M 467 -21.724 -52.028-142.974 1.00 83.27 O
+ATOM 13105 CB VAL M 467 -21.564 -49.293-141.829 1.00 66.96 C
+ATOM 13106 CG1 VAL M 467 -20.068 -49.279-141.575 1.00 68.92 C
+ATOM 13107 CG2 VAL M 467 -22.188 -47.955-141.475 1.00 57.10 C
+ATOM 13108 H VAL M 467 -23.934 -49.840-142.857 1.00 0.00 H
+ATOM 13109 HA VAL M 467 -21.337 -48.925-143.929 1.00 0.00 H
+ATOM 13110 HB VAL M 467 -21.987 -50.066-141.188 1.00 0.00 H
+ATOM 13111 1HG1 VAL M 467 -19.878 -49.025-140.532 1.00 0.00 H
+ATOM 13112 2HG1 VAL M 467 -19.653 -50.264-141.789 1.00 0.00 H
+ATOM 13113 3HG1 VAL M 467 -19.596 -48.538-142.220 1.00 0.00 H
+ATOM 13114 1HG2 VAL M 467 -21.976 -47.720-140.432 1.00 0.00 H
+ATOM 13115 2HG2 VAL M 467 -21.770 -47.178-142.115 1.00 0.00 H
+ATOM 13116 3HG2 VAL M 467 -23.267 -48.006-141.624 1.00 0.00 H
+ATOM 13117 N SER M 468 -20.451 -51.135-144.612 1.00 83.71 N
+ATOM 13118 CA SER M 468 -19.809 -52.396-144.956 1.00 85.34 C
+ATOM 13119 C SER M 468 -18.523 -52.097-145.709 1.00 87.84 C
+ATOM 13120 O SER M 468 -18.516 -51.257-146.615 1.00 92.46 O
+ATOM 13121 CB SER M 468 -20.731 -53.283-145.798 1.00 85.09 C
+ATOM 13122 OG SER M 468 -20.095 -54.508-146.119 1.00 83.07 O
+ATOM 13123 H SER M 468 -20.221 -50.306-145.141 1.00 0.00 H
+ATOM 13124 HA SER M 468 -19.575 -52.928-144.033 1.00 0.00 H
+ATOM 13125 1HB SER M 468 -21.650 -53.479-145.247 1.00 0.00 H
+ATOM 13126 2HB SER M 468 -21.004 -52.759-146.713 1.00 0.00 H
+ATOM 13127 HG SER M 468 -19.225 -54.468-145.716 1.00 0.00 H
+ATOM 13128 N ARG M 469 -17.442 -52.778-145.326 1.00 86.75 N
+ATOM 13129 CA ARG M 469 -16.163 -52.588-146.005 1.00103.27 C
+ATOM 13130 C ARG M 469 -16.215 -53.121-147.431 1.00112.27 C
+ATOM 13131 O ARG M 469 -15.760 -52.458-148.369 1.00118.18 O
+ATOM 13132 CB ARG M 469 -15.043 -53.262-145.209 1.00105.16 C
+ATOM 13133 CG ARG M 469 -13.663 -53.150-145.845 1.00 98.77 C
+ATOM 13134 CD ARG M 469 -13.292 -51.701-146.122 1.00101.32 C
+ATOM 13135 NE ARG M 469 -13.333 -50.871-144.922 1.00 96.99 N
+ATOM 13136 CZ ARG M 469 -12.288 -50.645-144.134 1.00108.32 C
+ATOM 13137 NH1 ARG M 469 -11.112 -51.184-144.419 1.00128.49 N
+ATOM 13138 NH2 ARG M 469 -12.419 -49.875-143.064 1.00104.19 N
+ATOM 13139 H ARG M 469 -17.500 -53.434-144.560 1.00 0.00 H
+ATOM 13140 HA ARG M 469 -15.959 -51.519-146.065 1.00 0.00 H
+ATOM 13141 1HB ARG M 469 -14.989 -52.822-144.214 1.00 0.00 H
+ATOM 13142 2HB ARG M 469 -15.270 -54.321-145.087 1.00 0.00 H
+ATOM 13143 1HG ARG M 469 -12.917 -53.574-145.173 1.00 0.00 H
+ATOM 13144 2HG ARG M 469 -13.652 -53.695-146.790 1.00 0.00 H
+ATOM 13145 1HD ARG M 469 -12.281 -51.655-146.525 1.00 0.00 H
+ATOM 13146 2HD ARG M 469 -13.990 -51.279-146.844 1.00 0.00 H
+ATOM 13147 HE ARG M 469 -14.215 -50.442-144.677 1.00 0.00 H
+ATOM 13148 1HH1 ARG M 469 -11.009 -51.768-145.237 1.00 0.00 H
+ATOM 13149 2HH1 ARG M 469 -10.319 -51.011-143.819 1.00 0.00 H
+ATOM 13150 1HH2 ARG M 469 -13.315 -49.459-142.847 1.00 0.00 H
+ATOM 13151 2HH2 ARG M 469 -11.625 -49.703-142.466 1.00 0.00 H
+ATOM 13152 N SER M 470 -16.766 -54.318-147.613 1.00113.84 N
+ATOM 13153 CA SER M 470 -16.936 -54.901-148.941 1.00118.16 C
+ATOM 13154 C SER M 470 -18.337 -54.552-149.425 1.00119.74 C
+ATOM 13155 O SER M 470 -19.318 -55.202-149.054 1.00117.53 O
+ATOM 13156 CB SER M 470 -16.711 -56.408-148.907 1.00125.56 C
+ATOM 13157 OG SER M 470 -17.625 -57.041-148.031 1.00127.82 O
+ATOM 13158 H SER M 470 -17.076 -54.838-146.804 1.00 0.00 H
+ATOM 13159 HA SER M 470 -16.198 -54.457-149.611 1.00 0.00 H
+ATOM 13160 1HB SER M 470 -16.826 -56.816-149.911 1.00 0.00 H
+ATOM 13161 2HB SER M 470 -15.692 -56.616-148.584 1.00 0.00 H
+ATOM 13162 HG SER M 470 -18.172 -56.340-147.668 1.00 0.00 H
+ATOM 13163 N GLY M 471 -18.433 -53.515-150.251 1.00128.11 N
+ATOM 13164 CA GLY M 471 -19.701 -53.089-150.785 1.00136.35 C
+ATOM 13165 C GLY M 471 -19.722 -51.607-151.091 1.00141.73 C
+ATOM 13166 O GLY M 471 -18.934 -50.824-150.551 1.00141.63 O
+ATOM 13167 H GLY M 471 -17.596 -53.013-150.511 1.00 0.00 H
+ATOM 13168 1HA GLY M 471 -19.918 -53.647-151.696 1.00 0.00 H
+ATOM 13169 2HA GLY M 471 -20.492 -53.319-150.072 1.00 0.00 H
+ATOM 13170 N PRO M 472 -20.627 -51.194-151.978 1.00139.73 N
+ATOM 13171 CA PRO M 472 -20.756 -49.766-152.301 1.00134.41 C
+ATOM 13172 C PRO M 472 -21.423 -49.020-151.156 1.00134.72 C
+ATOM 13173 O PRO M 472 -22.545 -49.340-150.757 1.00139.95 O
+ATOM 13174 CB PRO M 472 -21.624 -49.765-153.563 1.00136.26 C
+ATOM 13175 CG PRO M 472 -22.435 -51.014-153.448 1.00140.66 C
+ATOM 13176 CD PRO M 472 -21.553 -52.027-152.766 1.00141.71 C
+ATOM 13177 HA PRO M 472 -19.759 -49.351-152.512 1.00 0.00 H
+ATOM 13178 1HB PRO M 472 -22.242 -48.855-153.594 1.00 0.00 H
+ATOM 13179 2HB PRO M 472 -20.986 -49.751-154.459 1.00 0.00 H
+ATOM 13180 1HG PRO M 472 -23.352 -50.820-152.873 1.00 0.00 H
+ATOM 13181 2HG PRO M 472 -22.751 -51.355-154.445 1.00 0.00 H
+ATOM 13182 1HD PRO M 472 -22.166 -52.672-152.120 1.00 0.00 H
+ATOM 13183 2HD PRO M 472 -21.026 -52.625-153.524 1.00 0.00 H
+ATOM 13184 N SER M 473 -20.721 -48.023-150.621 1.00120.15 N
+ATOM 13185 CA SER M 473 -21.253 -47.206-149.533 1.00105.69 C
+ATOM 13186 C SER M 473 -22.101 -46.079-150.126 1.00 95.14 C
+ATOM 13187 O SER M 473 -21.753 -44.899-150.093 1.00 87.58 O
+ATOM 13188 CB SER M 473 -20.128 -46.636-148.691 1.00103.48 C
+ATOM 13189 OG SER M 473 -19.404 -47.657-148.063 1.00 0.00 O
+ATOM 13190 H SER M 473 -19.796 -47.827-150.977 1.00 0.00 H
+ATOM 13191 HA SER M 473 -21.898 -47.831-148.914 1.00 0.00 H
+ATOM 13192 1HB SER M 473 -19.462 -46.050-149.324 1.00 0.00 H
+ATOM 13193 2HB SER M 473 -20.541 -45.964-147.940 1.00 0.00 H
+ATOM 13194 HG SER M 473 -19.817 -48.480-148.334 1.00 0.00 H
+ATOM 13195 N THR M 474 -23.245 -46.471-150.686 1.00 93.54 N
+ATOM 13196 CA THR M 474 -24.161 -45.520-151.304 1.00 96.73 C
+ATOM 13197 C THR M 474 -25.364 -45.313-150.401 1.00 97.04 C
+ATOM 13198 O THR M 474 -26.048 -46.291-150.062 1.00 96.22 O
+ATOM 13199 CB THR M 474 -24.608 -46.007-152.679 1.00 95.68 C
+ATOM 13200 OG1 THR M 474 -25.112 -47.344-152.573 1.00104.29 O
+ATOM 13201 CG2 THR M 474 -23.442 -45.978-153.655 1.00 97.90 C
+ATOM 13202 H THR M 474 -23.484 -47.452-150.682 1.00 0.00 H
+ATOM 13203 HA THR M 474 -23.641 -44.570-151.428 1.00 0.00 H
+ATOM 13204 HB THR M 474 -25.405 -45.363-153.052 1.00 0.00 H
+ATOM 13205 HG1 THR M 474 -25.056 -47.635-151.660 1.00 0.00 H
+ATOM 13206 1HG2 THR M 474 -23.776 -46.328-154.632 1.00 0.00 H
+ATOM 13207 2HG2 THR M 474 -23.067 -44.959-153.743 1.00 0.00 H
+ATOM 13208 3HG2 THR M 474 -22.647 -46.627-153.291 1.00 0.00 H
+ATOM 13209 N PRO M 475 -25.660 -44.080-149.992 1.00 92.25 N
+ATOM 13210 CA PRO M 475 -26.769 -43.859-149.056 1.00 80.43 C
+ATOM 13211 C PRO M 475 -28.105 -44.233-149.681 1.00 90.32 C
+ATOM 13212 O PRO M 475 -28.440 -43.800-150.788 1.00 90.37 O
+ATOM 13213 CB PRO M 475 -26.687 -42.357-148.754 1.00 67.21 C
+ATOM 13214 CG PRO M 475 -25.306 -41.947-149.163 1.00 75.09 C
+ATOM 13215 CD PRO M 475 -24.953 -42.830-150.316 1.00 86.81 C
+ATOM 13216 HA PRO M 475 -26.596 -44.450-148.145 1.00 0.00 H
+ATOM 13217 1HB PRO M 475 -27.465 -41.818-149.314 1.00 0.00 H
+ATOM 13218 2HB PRO M 475 -26.877 -42.177-147.685 1.00 0.00 H
+ATOM 13219 1HG PRO M 475 -25.292 -40.882-149.438 1.00 0.00 H
+ATOM 13220 2HG PRO M 475 -24.609 -42.067-148.321 1.00 0.00 H
+ATOM 13221 1HD PRO M 475 -25.322 -42.380-151.250 1.00 0.00 H
+ATOM 13222 2HD PRO M 475 -23.862 -42.965-150.355 1.00 0.00 H
+ATOM 13223 N HIS M 476 -28.864 -45.058-148.962 1.00 85.31 N
+ATOM 13224 CA HIS M 476 -30.215 -45.397-149.376 1.00 68.29 C
+ATOM 13225 C HIS M 476 -31.251 -44.401-148.872 1.00 67.96 C
+ATOM 13226 O HIS M 476 -32.394 -44.440-149.337 1.00 87.48 O
+ATOM 13227 CB HIS M 476 -30.579 -46.810-148.910 1.00 68.93 C
+ATOM 13228 CG HIS M 476 -30.576 -46.980-147.425 1.00 85.46 C
+ATOM 13229 ND1 HIS M 476 -31.710 -46.822-146.658 1.00 92.67 N
+ATOM 13230 CD2 HIS M 476 -29.582 -47.304-146.566 1.00 85.93 C
+ATOM 13231 CE1 HIS M 476 -31.412 -47.034-145.388 1.00103.53 C
+ATOM 13232 NE2 HIS M 476 -30.127 -47.328-145.305 1.00 99.86 N
+ATOM 13233 H HIS M 476 -28.495 -45.458-148.111 1.00 0.00 H
+ATOM 13234 HA HIS M 476 -30.280 -45.371-150.463 1.00 0.00 H
+ATOM 13235 1HB HIS M 476 -31.572 -47.070-149.278 1.00 0.00 H
+ATOM 13236 2HB HIS M 476 -29.875 -47.525-149.334 1.00 0.00 H
+ATOM 13237 HD2 HIS M 476 -28.542 -47.504-146.825 1.00 0.00 H
+ATOM 13238 HE1 HIS M 476 -32.108 -46.976-144.552 1.00 0.00 H
+ATOM 13239 HE2 HIS M 476 -29.622 -47.537-144.455 1.00 0.00 H
+ATOM 13240 N VAL M 477 -30.890 -43.513-147.944 1.00 65.89 N
+ATOM 13241 CA VAL M 477 -31.732 -42.371-147.599 1.00 72.25 C
+ATOM 13242 C VAL M 477 -30.886 -41.109-147.699 1.00 77.57 C
+ATOM 13243 O VAL M 477 -29.710 -41.115-147.322 1.00 85.22 O
+ATOM 13244 CB VAL M 477 -32.358 -42.510-146.193 1.00 70.29 C
+ATOM 13245 CG1 VAL M 477 -33.205 -41.290-145.853 1.00 65.64 C
+ATOM 13246 CG2 VAL M 477 -33.200 -43.772-146.108 1.00 75.09 C
+ATOM 13247 H VAL M 477 -30.008 -43.636-147.467 1.00 0.00 H
+ATOM 13248 HA VAL M 477 -32.546 -42.311-148.322 1.00 0.00 H
+ATOM 13249 HB VAL M 477 -31.559 -42.561-145.453 1.00 0.00 H
+ATOM 13250 1HG1 VAL M 477 -33.635 -41.411-144.858 1.00 0.00 H
+ATOM 13251 2HG1 VAL M 477 -32.581 -40.397-145.872 1.00 0.00 H
+ATOM 13252 3HG1 VAL M 477 -34.007 -41.189-146.584 1.00 0.00 H
+ATOM 13253 1HG2 VAL M 477 -33.632 -43.854-145.111 1.00 0.00 H
+ATOM 13254 2HG2 VAL M 477 -33.999 -43.727-146.848 1.00 0.00 H
+ATOM 13255 3HG2 VAL M 477 -32.573 -44.642-146.304 1.00 0.00 H
+ATOM 13256 N ASN M 478 -31.480 -40.031-148.219 1.00 77.76 N
+ATOM 13257 CA ASN M 478 -30.763 -38.782-148.465 1.00 70.89 C
+ATOM 13258 C ASN M 478 -31.742 -37.652-148.767 1.00 81.17 C
+ATOM 13259 O ASN M 478 -32.327 -37.611-149.857 1.00 74.41 O
+ATOM 13260 CB ASN M 478 -29.778 -38.959-149.629 1.00 74.12 C
+ATOM 13261 CG ASN M 478 -28.871 -37.748-149.841 1.00 74.24 C
+ATOM 13262 OD1 ASN M 478 -29.216 -36.617-149.498 1.00 76.11 O
+ATOM 13263 ND2 ASN M 478 -27.703 -37.989-150.427 1.00 70.78 N
+ATOM 13264 H ASN M 478 -32.462 -40.088-148.449 1.00 0.00 H
+ATOM 13265 HA ASN M 478 -30.202 -38.522-147.566 1.00 0.00 H
+ATOM 13266 1HB ASN M 478 -29.151 -39.833-149.446 1.00 0.00 H
+ATOM 13267 2HB ASN M 478 -30.332 -39.141-150.550 1.00 0.00 H
+ATOM 13268 1HD2 ASN M 478 -27.063 -37.238-150.595 1.00 0.00 H
+ATOM 13269 2HD2 ASN M 478 -27.464 -38.920-150.700 1.00 0.00 H
+ATOM 13270 N PHE M 479 -31.920 -36.725-147.823 1.00 67.83 N
+ATOM 13271 CA PHE M 479 -32.762 -35.557-148.057 1.00 69.96 C
+ATOM 13272 C PHE M 479 -32.227 -34.384-147.246 1.00 69.34 C
+ATOM 13273 O PHE M 479 -31.192 -34.481-146.583 1.00 77.44 O
+ATOM 13274 CB PHE M 479 -34.232 -35.849-147.732 1.00 74.31 C
+ATOM 13275 CG PHE M 479 -34.502 -36.116-146.280 1.00 69.71 C
+ATOM 13276 CD1 PHE M 479 -34.859 -35.085-145.425 1.00 70.20 C
+ATOM 13277 CD2 PHE M 479 -34.423 -37.402-145.773 1.00 82.63 C
+ATOM 13278 CE1 PHE M 479 -35.115 -35.331-144.088 1.00 73.72 C
+ATOM 13279 CE2 PHE M 479 -34.680 -37.654-144.437 1.00 80.99 C
+ATOM 13280 CZ PHE M 479 -35.026 -36.616-143.594 1.00 76.89 C
+ATOM 13281 H PHE M 479 -31.464 -36.831-146.928 1.00 0.00 H
+ATOM 13282 HA PHE M 479 -32.694 -35.287-149.112 1.00 0.00 H
+ATOM 13283 1HB PHE M 479 -34.847 -35.003-148.037 1.00 0.00 H
+ATOM 13284 2HB PHE M 479 -34.564 -36.717-148.300 1.00 0.00 H
+ATOM 13285 HD1 PHE M 479 -34.938 -34.071-145.818 1.00 0.00 H
+ATOM 13286 HD2 PHE M 479 -34.149 -38.221-146.439 1.00 0.00 H
+ATOM 13287 HE1 PHE M 479 -35.387 -34.509-143.426 1.00 0.00 H
+ATOM 13288 HE2 PHE M 479 -34.609 -38.670-144.049 1.00 0.00 H
+ATOM 13289 HZ PHE M 479 -35.227 -36.811-142.542 1.00 0.00 H
+ATOM 13290 N LEU M 480 -32.944 -33.262-147.313 1.00 76.19 N
+ATOM 13291 CA LEU M 480 -32.554 -32.016-146.658 1.00 75.12 C
+ATOM 13292 C LEU M 480 -33.480 -31.770-145.473 1.00 84.55 C
+ATOM 13293 O LEU M 480 -34.671 -31.495-145.656 1.00 85.67 O
+ATOM 13294 CB LEU M 480 -32.603 -30.846-147.639 1.00 78.09 C
+ATOM 13295 CG LEU M 480 -31.470 -30.743-148.661 1.00101.80 C
+ATOM 13296 CD1 LEU M 480 -31.923 -29.984-149.900 1.00117.05 C
+ATOM 13297 CD2 LEU M 480 -30.266 -30.061-148.038 1.00107.70 C
+ATOM 13298 H LEU M 480 -33.800 -33.289-147.848 1.00 0.00 H
+ATOM 13299 HA LEU M 480 -31.531 -32.121-146.297 1.00 0.00 H
+ATOM 13300 1HB LEU M 480 -33.533 -30.904-148.202 1.00 0.00 H
+ATOM 13301 2HB LEU M 480 -32.603 -29.916-147.071 1.00 0.00 H
+ATOM 13302 HG LEU M 480 -31.184 -31.743-148.990 1.00 0.00 H
+ATOM 13303 1HD1 LEU M 480 -31.099 -29.925-150.612 1.00 0.00 H
+ATOM 13304 2HD1 LEU M 480 -32.762 -30.506-150.360 1.00 0.00 H
+ATOM 13305 3HD1 LEU M 480 -32.232 -28.978-149.618 1.00 0.00 H
+ATOM 13306 1HD2 LEU M 480 -29.464 -29.993-148.774 1.00 0.00 H
+ATOM 13307 2HD2 LEU M 480 -30.544 -29.059-147.711 1.00 0.00 H
+ATOM 13308 3HD2 LEU M 480 -29.923 -30.640-147.180 1.00 0.00 H
+ATOM 13309 N LEU M 481 -32.927 -31.863-144.261 1.00 82.94 N
+ATOM 13310 CA LEU M 481 -33.707 -31.580-143.060 1.00 79.09 C
+ATOM 13311 C LEU M 481 -33.959 -30.086-142.906 1.00 84.56 C
+ATOM 13312 O LEU M 481 -35.107 -29.652-142.754 1.00100.92 O
+ATOM 13313 CB LEU M 481 -32.986 -32.124-141.829 1.00 80.31 C
+ATOM 13314 CG LEU M 481 -33.582 -33.366-141.176 1.00 69.41 C
+ATOM 13315 CD1 LEU M 481 -32.805 -33.708-139.916 1.00 55.51 C
+ATOM 13316 CD2 LEU M 481 -35.056 -33.149-140.873 1.00 58.24 C
+ATOM 13317 H LEU M 481 -31.958 -32.132-144.166 1.00 0.00 H
+ATOM 13318 HA LEU M 481 -34.673 -32.076-143.150 1.00 0.00 H
+ATOM 13319 1HB LEU M 481 -31.962 -32.368-142.106 1.00 0.00 H
+ATOM 13320 2HB LEU M 481 -32.959 -31.343-141.069 1.00 0.00 H
+ATOM 13321 HG LEU M 481 -33.480 -34.217-141.851 1.00 0.00 H
+ATOM 13322 1HD1 LEU M 481 -33.235 -34.596-139.453 1.00 0.00 H
+ATOM 13323 2HD1 LEU M 481 -31.763 -33.901-140.172 1.00 0.00 H
+ATOM 13324 3HD1 LEU M 481 -32.859 -32.874-139.218 1.00 0.00 H
+ATOM 13325 1HD2 LEU M 481 -35.468 -34.045-140.408 1.00 0.00 H
+ATOM 13326 2HD2 LEU M 481 -35.167 -32.304-140.194 1.00 0.00 H
+ATOM 13327 3HD2 LEU M 481 -35.592 -32.943-141.800 1.00 0.00 H
+ATOM 13328 N ASP M 482 -32.897 -29.285-142.935 1.00 78.45 N
+ATOM 13329 CA ASP M 482 -33.011 -27.848-142.733 1.00 90.89 C
+ATOM 13330 C ASP M 482 -31.817 -27.174-143.398 1.00 90.63 C
+ATOM 13331 O ASP M 482 -30.859 -27.832-143.812 1.00 86.18 O
+ATOM 13332 CB ASP M 482 -33.093 -27.507-141.239 1.00105.07 C
+ATOM 13333 CG ASP M 482 -33.515 -26.070-140.985 1.00123.98 C
+ATOM 13334 OD1 ASP M 482 -34.244 -25.505-141.829 1.00137.97 O
+ATOM 13335 OD2 ASP M 482 -33.118 -25.508-139.942 1.00114.05 O
+ATOM 13336 H ASP M 482 -31.986 -29.688-143.102 1.00 0.00 H
+ATOM 13337 HA ASP M 482 -33.926 -27.502-143.215 1.00 0.00 H
+ATOM 13338 1HB ASP M 482 -33.807 -28.172-140.753 1.00 0.00 H
+ATOM 13339 2HB ASP M 482 -32.121 -27.673-140.774 1.00 0.00 H
+ATOM 13340 N SER M 483 -31.894 -25.844-143.506 1.00 91.76 N
+ATOM 13341 CA SER M 483 -30.775 -25.067-144.027 1.00 94.43 C
+ATOM 13342 C SER M 483 -29.628 -24.967-143.031 1.00103.19 C
+ATOM 13343 O SER M 483 -28.498 -24.668-143.433 1.00111.21 O
+ATOM 13344 CB SER M 483 -31.244 -23.664-144.419 1.00103.90 C
+ATOM 13345 OG SER M 483 -31.784 -22.971-143.307 1.00105.18 O
+ATOM 13346 H SER M 483 -32.737 -25.364-143.224 1.00 0.00 H
+ATOM 13347 HA SER M 483 -30.388 -25.569-144.915 1.00 0.00 H
+ATOM 13348 1HB SER M 483 -30.405 -23.100-144.826 1.00 0.00 H
+ATOM 13349 2HB SER M 483 -31.998 -23.738-145.202 1.00 0.00 H
+ATOM 13350 HG SER M 483 -31.719 -23.574-142.562 1.00 0.00 H
+ATOM 13351 N HIS M 484 -29.894 -25.215-141.729 1.00 98.59 N
+ATOM 13352 CA HIS M 484 -28.929 -25.138-140.645 1.00 99.56 C
+ATOM 13353 C HIS M 484 -28.163 -26.450-140.513 1.00 87.92 C
+ATOM 13354 O HIS M 484 -28.697 -27.522-140.816 1.00 88.69 O
+ATOM 13355 CB HIS M 484 -29.635 -24.819-139.329 1.00113.54 C
+ATOM 13356 CG HIS M 484 -30.461 -23.570-139.373 1.00140.58 C
+ATOM 13357 ND1 HIS M 484 -30.366 -22.650-140.395 1.00152.49 N
+ATOM 13358 CD2 HIS M 484 -31.399 -23.091-138.522 1.00153.40 C
+ATOM 13359 CE1 HIS M 484 -31.209 -21.657-140.170 1.00158.90 C
+ATOM 13360 NE2 HIS M 484 -31.847 -21.900-139.040 1.00161.48 N
+ATOM 13361 H HIS M 484 -30.848 -25.472-141.521 1.00 0.00 H
+ATOM 13362 HA HIS M 484 -28.214 -24.342-140.850 1.00 0.00 H
+ATOM 13363 1HB HIS M 484 -30.287 -25.649-139.055 1.00 0.00 H
+ATOM 13364 2HB HIS M 484 -28.895 -24.710-138.537 1.00 0.00 H
+ATOM 13365 HD2 HIS M 484 -31.734 -23.561-137.597 1.00 0.00 H
+ATOM 13366 HE1 HIS M 484 -31.353 -20.786-140.809 1.00 0.00 H
+ATOM 13367 HE2 HIS M 484 -32.551 -21.310-138.620 1.00 0.00 H
+ATOM 13368 N PRO M 485 -26.905 -26.391-140.073 1.00 81.66 N
+ATOM 13369 CA PRO M 485 -26.116 -27.620-139.937 1.00 69.04 C
+ATOM 13370 C PRO M 485 -26.721 -28.560-138.908 1.00 81.82 C
+ATOM 13371 O PRO M 485 -27.411 -28.140-137.976 1.00 94.91 O
+ATOM 13372 CB PRO M 485 -24.740 -27.114-139.489 1.00 71.12 C
+ATOM 13373 CG PRO M 485 -24.702 -25.682-139.907 1.00 87.53 C
+ATOM 13374 CD PRO M 485 -26.110 -25.189-139.775 1.00 87.52 C
+ATOM 13375 HA PRO M 485 -26.049 -28.117-140.916 1.00 0.00 H
+ATOM 13376 1HB PRO M 485 -24.629 -27.238-138.402 1.00 0.00 H
+ATOM 13377 2HB PRO M 485 -23.947 -27.711-139.963 1.00 0.00 H
+ATOM 13378 1HG PRO M 485 -24.005 -25.119-139.269 1.00 0.00 H
+ATOM 13379 2HG PRO M 485 -24.329 -25.597-140.938 1.00 0.00 H
+ATOM 13380 1HD PRO M 485 -26.279 -24.831-138.749 1.00 0.00 H
+ATOM 13381 2HD PRO M 485 -26.286 -24.382-140.502 1.00 0.00 H
+ATOM 13382 N VAL M 486 -26.450 -29.847-139.086 1.00 70.85 N
+ATOM 13383 CA VAL M 486 -27.008 -30.873-138.213 1.00 71.15 C
+ATOM 13384 C VAL M 486 -26.132 -31.012-136.976 1.00 73.45 C
+ATOM 13385 O VAL M 486 -24.918 -31.224-137.081 1.00 76.10 O
+ATOM 13386 CB VAL M 486 -27.130 -32.209-138.958 1.00 67.99 C
+ATOM 13387 CG1 VAL M 486 -27.734 -33.254-138.051 1.00 57.18 C
+ATOM 13388 CG2 VAL M 486 -27.957 -32.037-140.225 1.00 74.83 C
+ATOM 13389 H VAL M 486 -25.843 -30.123-139.844 1.00 0.00 H
+ATOM 13390 HA VAL M 486 -28.004 -30.557-137.901 1.00 0.00 H
+ATOM 13391 HB VAL M 486 -26.132 -32.558-139.224 1.00 0.00 H
+ATOM 13392 1HG1 VAL M 486 -27.816 -34.199-138.589 1.00 0.00 H
+ATOM 13393 2HG1 VAL M 486 -27.097 -33.389-137.177 1.00 0.00 H
+ATOM 13394 3HG1 VAL M 486 -28.725 -32.931-137.733 1.00 0.00 H
+ATOM 13395 1HG2 VAL M 486 -28.033 -32.993-140.742 1.00 0.00 H
+ATOM 13396 2HG2 VAL M 486 -28.955 -31.685-139.963 1.00 0.00 H
+ATOM 13397 3HG2 VAL M 486 -27.475 -31.309-140.878 1.00 0.00 H
+ATOM 13398 N SER M 487 -26.747 -30.908-135.802 1.00 76.53 N
+ATOM 13399 CA SER M 487 -25.992 -30.955-134.558 1.00 80.91 C
+ATOM 13400 C SER M 487 -25.552 -32.387-134.253 1.00 72.20 C
+ATOM 13401 O SER M 487 -26.286 -33.340-134.537 1.00 67.35 O
+ATOM 13402 CB SER M 487 -26.834 -30.408-133.403 1.00 85.17 C
+ATOM 13403 OG SER M 487 -26.114 -30.415-132.180 1.00 89.31 O
+ATOM 13404 H SER M 487 -27.750 -30.795-135.765 1.00 0.00 H
+ATOM 13405 HA SER M 487 -25.103 -30.332-134.669 1.00 0.00 H
+ATOM 13406 1HB SER M 487 -27.146 -29.389-133.631 1.00 0.00 H
+ATOM 13407 2HB SER M 487 -27.735 -31.010-133.293 1.00 0.00 H
+ATOM 13408 HG SER M 487 -25.247 -30.773-132.385 1.00 0.00 H
+ATOM 13409 N PRO M 488 -24.360 -32.573-133.677 1.00 60.18 N
+ATOM 13410 CA PRO M 488 -23.922 -33.931-133.323 1.00 69.19 C
+ATOM 13411 C PRO M 488 -24.675 -34.528-132.148 1.00 76.52 C
+ATOM 13412 O PRO M 488 -24.607 -35.748-131.950 1.00 79.18 O
+ATOM 13413 CB PRO M 488 -22.435 -33.743-132.995 1.00 67.92 C
+ATOM 13414 CG PRO M 488 -22.332 -32.326-132.554 1.00 67.47 C
+ATOM 13415 CD PRO M 488 -23.327 -31.565-133.388 1.00 65.42 C
+ATOM 13416 HA PRO M 488 -24.052 -34.591-134.193 1.00 0.00 H
+ATOM 13417 1HB PRO M 488 -22.129 -34.455-132.215 1.00 0.00 H
+ATOM 13418 2HB PRO M 488 -21.824 -33.958-133.884 1.00 0.00 H
+ATOM 13419 1HG PRO M 488 -22.550 -32.246-131.479 1.00 0.00 H
+ATOM 13420 2HG PRO M 488 -21.306 -31.957-132.699 1.00 0.00 H
+ATOM 13421 1HD PRO M 488 -23.731 -30.726-132.803 1.00 0.00 H
+ATOM 13422 2HD PRO M 488 -22.837 -31.200-134.303 1.00 0.00 H
+ATOM 13423 N GLU M 489 -25.383 -33.718-131.366 1.00 85.44 N
+ATOM 13424 CA GLU M 489 -26.162 -34.216-130.237 1.00 87.41 C
+ATOM 13425 C GLU M 489 -27.453 -34.828-130.769 1.00 74.38 C
+ATOM 13426 O GLU M 489 -28.356 -34.105-131.205 1.00 85.97 O
+ATOM 13427 CB GLU M 489 -26.449 -33.088-129.249 1.00 94.23 C
+ATOM 13428 CG GLU M 489 -25.204 -32.401-128.704 1.00106.81 C
+ATOM 13429 CD GLU M 489 -24.426 -33.269-127.733 1.00123.55 C
+ATOM 13430 OE1 GLU M 489 -25.054 -34.080-127.019 1.00129.59 O
+ATOM 13431 OE2 GLU M 489 -23.184 -33.139-127.685 1.00131.55 O
+ATOM 13432 H GLU M 489 -25.379 -32.727-131.562 1.00 0.00 H
+ATOM 13433 HA GLU M 489 -25.581 -34.986-129.729 1.00 0.00 H
+ATOM 13434 1HB GLU M 489 -27.067 -32.330-129.731 1.00 0.00 H
+ATOM 13435 2HB GLU M 489 -27.013 -33.480-128.403 1.00 0.00 H
+ATOM 13436 1HG GLU M 489 -24.554 -32.136-129.537 1.00 0.00 H
+ATOM 13437 2HG GLU M 489 -25.500 -31.480-128.203 1.00 0.00 H
+ATOM 13438 N VAL M 490 -27.542 -36.161-130.742 1.00 60.89 N
+ATOM 13439 CA VAL M 490 -28.676 -36.889-131.300 1.00 72.04 C
+ATOM 13440 C VAL M 490 -29.073 -38.010-130.348 1.00 72.31 C
+ATOM 13441 O VAL M 490 -28.327 -38.381-129.438 1.00 61.32 O
+ATOM 13442 CB VAL M 490 -28.371 -37.466-132.699 1.00 70.55 C
+ATOM 13443 CG1 VAL M 490 -28.216 -36.342-133.720 1.00 78.16 C
+ATOM 13444 CG2 VAL M 490 -27.123 -38.346-132.654 1.00 59.40 C
+ATOM 13445 H VAL M 490 -26.787 -36.679-130.315 1.00 0.00 H
+ATOM 13446 HA VAL M 490 -29.515 -36.199-131.401 1.00 0.00 H
+ATOM 13447 HB VAL M 490 -29.221 -38.065-133.028 1.00 0.00 H
+ATOM 13448 1HG1 VAL M 490 -28.002 -36.768-134.701 1.00 0.00 H
+ATOM 13449 2HG1 VAL M 490 -29.140 -35.766-133.770 1.00 0.00 H
+ATOM 13450 3HG1 VAL M 490 -27.395 -35.690-133.421 1.00 0.00 H
+ATOM 13451 1HG2 VAL M 490 -26.923 -38.745-133.648 1.00 0.00 H
+ATOM 13452 2HG2 VAL M 490 -26.271 -37.752-132.323 1.00 0.00 H
+ATOM 13453 3HG2 VAL M 490 -27.284 -39.170-131.958 1.00 0.00 H
+ATOM 13454 N ILE M 491 -30.269 -38.558-130.574 1.00 76.74 N
+ATOM 13455 CA ILE M 491 -30.787 -39.646-129.752 1.00 82.14 C
+ATOM 13456 C ILE M 491 -31.208 -40.794-130.660 1.00 86.91 C
+ATOM 13457 O ILE M 491 -31.649 -40.581-131.793 1.00 85.07 O
+ATOM 13458 CB ILE M 491 -31.968 -39.180-128.863 1.00 81.61 C
+ATOM 13459 CG1 ILE M 491 -31.519 -38.065-127.917 1.00 80.84 C
+ATOM 13460 CG2 ILE M 491 -32.546 -40.330-128.047 1.00 75.61 C
+ATOM 13461 CD1 ILE M 491 -30.506 -38.513-126.892 1.00 92.44 C
+ATOM 13462 H ILE M 491 -30.830 -38.208-131.337 1.00 0.00 H
+ATOM 13463 HA ILE M 491 -29.989 -39.995-129.098 1.00 0.00 H
+ATOM 13464 HB ILE M 491 -32.759 -38.775-129.493 1.00 0.00 H
+ATOM 13465 1HG1 ILE M 491 -31.085 -37.250-128.495 1.00 0.00 H
+ATOM 13466 2HG1 ILE M 491 -32.385 -37.665-127.389 1.00 0.00 H
+ATOM 13467 1HG2 ILE M 491 -33.371 -39.964-127.436 1.00 0.00 H
+ATOM 13468 2HG2 ILE M 491 -32.909 -41.106-128.719 1.00 0.00 H
+ATOM 13469 3HG2 ILE M 491 -31.771 -40.743-127.401 1.00 0.00 H
+ATOM 13470 1HD1 ILE M 491 -30.234 -37.670-126.256 1.00 0.00 H
+ATOM 13471 2HD1 ILE M 491 -30.935 -39.307-126.279 1.00 0.00 H
+ATOM 13472 3HD1 ILE M 491 -29.617 -38.886-127.398 1.00 0.00 H
+ATOM 13473 N VAL M 492 -31.044 -42.022-130.166 1.00 89.01 N
+ATOM 13474 CA VAL M 492 -31.533 -43.221-130.840 1.00 75.37 C
+ATOM 13475 C VAL M 492 -32.313 -44.041-129.824 1.00 80.29 C
+ATOM 13476 O VAL M 492 -31.755 -44.464-128.804 1.00 80.47 O
+ATOM 13477 CB VAL M 492 -30.397 -44.058-131.449 1.00 60.42 C
+ATOM 13478 CG1 VAL M 492 -30.922 -45.412-131.897 1.00 61.41 C
+ATOM 13479 CG2 VAL M 492 -29.781 -43.326-132.615 1.00 58.38 C
+ATOM 13480 H VAL M 492 -30.558 -42.116-129.285 1.00 0.00 H
+ATOM 13481 HA VAL M 492 -32.192 -42.916-131.654 1.00 0.00 H
+ATOM 13482 HB VAL M 492 -29.637 -44.231-130.687 1.00 0.00 H
+ATOM 13483 1HG1 VAL M 492 -30.106 -45.995-132.326 1.00 0.00 H
+ATOM 13484 2HG1 VAL M 492 -31.335 -45.944-131.040 1.00 0.00 H
+ATOM 13485 3HG1 VAL M 492 -31.700 -45.271-132.647 1.00 0.00 H
+ATOM 13486 1HG2 VAL M 492 -28.977 -43.927-133.038 1.00 0.00 H
+ATOM 13487 2HG2 VAL M 492 -30.541 -43.148-133.376 1.00 0.00 H
+ATOM 13488 3HG2 VAL M 492 -29.379 -42.372-132.274 1.00 0.00 H
+ATOM 13489 N GLU M 493 -33.594 -44.267-130.099 1.00 77.46 N
+ATOM 13490 CA GLU M 493 -34.465 -45.021-129.209 1.00 75.24 C
+ATOM 13491 C GLU M 493 -35.064 -46.198-129.962 1.00 81.41 C
+ATOM 13492 O GLU M 493 -35.607 -46.026-131.057 1.00 80.28 O
+ATOM 13493 CB GLU M 493 -35.573 -44.131-128.640 1.00 80.93 C
+ATOM 13494 CG GLU M 493 -36.580 -44.871-127.775 1.00 92.03 C
+ATOM 13495 CD GLU M 493 -35.938 -45.587-126.600 1.00103.83 C
+ATOM 13496 OE1 GLU M 493 -34.921 -45.087-126.073 1.00105.72 O
+ATOM 13497 OE2 GLU M 493 -36.451 -46.656-126.207 1.00108.23 O
+ATOM 13498 H GLU M 493 -33.971 -43.898-130.960 1.00 0.00 H
+ATOM 13499 HA GLU M 493 -33.868 -45.399-128.379 1.00 0.00 H
+ATOM 13500 1HB GLU M 493 -35.129 -43.338-128.038 1.00 0.00 H
+ATOM 13501 2HB GLU M 493 -36.115 -43.657-129.458 1.00 0.00 H
+ATOM 13502 1HG GLU M 493 -37.311 -44.157-127.395 1.00 0.00 H
+ATOM 13503 2HG GLU M 493 -37.109 -45.597-128.391 1.00 0.00 H
+ATOM 13504 N HIS M 494 -34.970 -47.387-129.375 1.00 89.31 N
+ATOM 13505 CA HIS M 494 -35.487 -48.607-129.981 1.00 96.91 C
+ATOM 13506 C HIS M 494 -36.794 -49.010-129.310 1.00107.03 C
+ATOM 13507 O HIS M 494 -36.879 -49.051-128.078 1.00115.29 O
+ATOM 13508 CB HIS M 494 -34.464 -49.738-129.876 1.00105.64 C
+ATOM 13509 CG HIS M 494 -33.161 -49.436-130.547 1.00108.36 C
+ATOM 13510 ND1 HIS M 494 -33.012 -49.444-131.918 1.00111.86 N
+ATOM 13511 CD2 HIS M 494 -31.950 -49.110-130.038 1.00103.04 C
+ATOM 13512 CE1 HIS M 494 -31.763 -49.140-132.223 1.00107.41 C
+ATOM 13513 NE2 HIS M 494 -31.098 -48.933-131.101 1.00101.02 N
+ATOM 13514 H HIS M 494 -34.520 -47.438-128.472 1.00 0.00 H
+ATOM 13515 HA HIS M 494 -35.688 -48.431-131.037 1.00 0.00 H
+ATOM 13516 1HB HIS M 494 -34.265 -49.952-128.825 1.00 0.00 H
+ATOM 13517 2HB HIS M 494 -34.875 -50.643-130.322 1.00 0.00 H
+ATOM 13518 HD2 HIS M 494 -31.697 -49.010-128.982 1.00 0.00 H
+ATOM 13519 HE1 HIS M 494 -31.351 -49.071-133.230 1.00 0.00 H
+ATOM 13520 HE2 HIS M 494 -30.122 -48.684-131.030 1.00 0.00 H
+ATOM 13521 N THR M 495 -37.806 -49.308-130.123 1.00111.90 N
+ATOM 13522 CA THR M 495 -39.114 -49.709-129.627 1.00118.98 C
+ATOM 13523 C THR M 495 -39.643 -50.857-130.472 1.00126.89 C
+ATOM 13524 O THR M 495 -39.386 -50.928-131.677 1.00126.38 O
+ATOM 13525 CB THR M 495 -40.111 -48.536-129.644 1.00112.50 C
+ATOM 13526 OG1 THR M 495 -40.297 -48.083-130.991 1.00 0.00 O
+ATOM 13527 CG2 THR M 495 -39.597 -47.385-128.793 1.00 0.00 C
+ATOM 13528 H THR M 495 -37.654 -49.252-131.120 1.00 0.00 H
+ATOM 13529 HA THR M 495 -39.006 -50.040-128.594 1.00 0.00 H
+ATOM 13530 HB THR M 495 -41.072 -48.869-129.252 1.00 0.00 H
+ATOM 13531 HG1 THR M 495 -40.027 -48.774-131.601 1.00 0.00 H
+ATOM 13532 1HG2 THR M 495 -40.314 -46.566-128.816 1.00 0.00 H
+ATOM 13533 2HG2 THR M 495 -39.465 -47.724-127.765 1.00 0.00 H
+ATOM 13534 3HG2 THR M 495 -38.641 -47.041-129.186 1.00 0.00 H
+ATOM 13535 N LEU M 496 -40.390 -51.750-129.825 1.00139.39 N
+ATOM 13536 CA LEU M 496 -40.972 -52.940-130.464 1.00154.74 C
+ATOM 13537 C LEU M 496 -39.816 -53.775-131.012 1.00175.00 C
+ATOM 13538 O LEU M 496 -38.881 -54.081-130.253 1.00176.93 O
+ATOM 13539 CB LEU M 496 -41.939 -52.554-131.591 1.00139.41 C
+ATOM 13540 CG LEU M 496 -43.114 -51.658-131.181 1.00131.94 C
+ATOM 13541 CD1 LEU M 496 -43.915 -51.273-132.417 1.00 0.00 C
+ATOM 13542 CD2 LEU M 496 -43.985 -52.392-130.172 1.00 0.00 C
+ATOM 13543 H LEU M 496 -40.557 -51.588-128.842 1.00 0.00 H
+ATOM 13544 HA LEU M 496 -41.448 -53.548-129.695 1.00 0.00 H
+ATOM 13545 1HB LEU M 496 -41.379 -52.032-132.365 1.00 0.00 H
+ATOM 13546 2HB LEU M 496 -42.351 -53.466-132.022 1.00 0.00 H
+ATOM 13547 HG LEU M 496 -42.733 -50.740-130.731 1.00 0.00 H
+ATOM 13548 1HD1 LEU M 496 -44.751 -50.636-132.126 1.00 0.00 H
+ATOM 13549 2HD1 LEU M 496 -43.273 -50.732-133.113 1.00 0.00 H
+ATOM 13550 3HD1 LEU M 496 -44.296 -52.173-132.898 1.00 0.00 H
+ATOM 13551 1HD2 LEU M 496 -44.820 -51.755-129.880 1.00 0.00 H
+ATOM 13552 2HD2 LEU M 496 -44.367 -53.309-130.621 1.00 0.00 H
+ATOM 13553 3HD2 LEU M 496 -43.392 -52.639-129.291 1.00 0.00 H
+ATOM 13554 N ASN M 497 -39.824 -54.155-132.288 1.00180.09 N
+ATOM 13555 CA ASN M 497 -38.804 -55.025-132.874 1.00186.31 C
+ATOM 13556 C ASN M 497 -37.952 -54.201-133.838 1.00182.02 C
+ATOM 13557 O ASN M 497 -38.277 -54.072-135.020 1.00183.94 O
+ATOM 13558 CB ASN M 497 -39.446 -56.220-133.581 1.00189.11 C
+ATOM 13559 CG ASN M 497 -40.295 -57.064-132.650 1.00193.73 C
+ATOM 13560 OD1 ASN M 497 -41.509 -57.170-132.824 1.00192.76 O
+ATOM 13561 ND2 ASN M 497 -39.657 -57.675-131.658 1.00197.92 N
+ATOM 13562 H ASN M 497 -40.578 -53.819-132.870 1.00 0.00 H
+ATOM 13563 HA ASN M 497 -38.167 -55.400-132.072 1.00 0.00 H
+ATOM 13564 1HB ASN M 497 -40.072 -55.865-134.401 1.00 0.00 H
+ATOM 13565 2HB ASN M 497 -38.667 -56.849-134.012 1.00 0.00 H
+ATOM 13566 1HD2 ASN M 497 -40.166 -58.245-131.012 1.00 0.00 H
+ATOM 13567 2HD2 ASN M 497 -38.669 -57.565-131.557 1.00 0.00 H
+ATOM 13568 N GLN M 498 -36.858 -53.640-133.319 1.00176.62 N
+ATOM 13569 CA GLN M 498 -35.878 -52.879-134.097 1.00160.74 C
+ATOM 13570 C GLN M 498 -36.500 -51.706-134.848 1.00152.27 C
+ATOM 13571 O GLN M 498 -35.875 -51.145-135.755 1.00144.94 O
+ATOM 13572 CB GLN M 498 -35.124 -53.783-135.083 1.00152.81 C
+ATOM 13573 CG GLN M 498 -34.231 -54.825-134.429 1.00150.52 C
+ATOM 13574 CD GLN M 498 -33.404 -55.600-135.439 1.00146.07 C
+ATOM 13575 OE1 GLN M 498 -32.226 -55.877-135.210 1.00144.31 O
+ATOM 13576 NE2 GLN M 498 -34.016 -55.949-136.565 1.00142.59 N
+ATOM 13577 H GLN M 498 -36.714 -53.758-132.326 1.00 0.00 H
+ATOM 13578 HA GLN M 498 -35.152 -52.445-133.409 1.00 0.00 H
+ATOM 13579 1HB GLN M 498 -35.840 -54.308-135.716 1.00 0.00 H
+ATOM 13580 2HB GLN M 498 -34.500 -53.171-135.734 1.00 0.00 H
+ATOM 13581 1HG GLN M 498 -33.548 -54.324-133.742 1.00 0.00 H
+ATOM 13582 2HG GLN M 498 -34.855 -55.533-133.885 1.00 0.00 H
+ATOM 13583 1HE2 GLN M 498 -33.519 -56.461-137.267 1.00 0.00 H
+ATOM 13584 2HE2 GLN M 498 -34.973 -55.700-136.712 1.00 0.00 H
+ATOM 13585 N ASN M 499 -37.721 -51.316-134.491 1.00151.22 N
+ATOM 13586 CA ASN M 499 -38.448 -50.253-135.178 1.00137.64 C
+ATOM 13587 C ASN M 499 -38.587 -49.072-134.222 1.00129.15 C
+ATOM 13588 O ASN M 499 -39.639 -48.843-133.622 1.00127.33 O
+ATOM 13589 CB ASN M 499 -39.803 -50.751-135.666 1.00131.93 C
+ATOM 13590 CG ASN M 499 -40.609 -49.663-136.335 1.00129.17 C
+ATOM 13591 OD1 ASN M 499 -40.291 -49.235-137.443 1.00130.49 O
+ATOM 13592 ND2 ASN M 499 -41.658 -49.203-135.662 1.00127.12 N
+ATOM 13593 H ASN M 499 -38.156 -51.783-133.708 1.00 0.00 H
+ATOM 13594 HA ASN M 499 -37.863 -49.937-136.044 1.00 0.00 H
+ATOM 13595 1HB ASN M 499 -39.657 -51.569-136.373 1.00 0.00 H
+ATOM 13596 2HB ASN M 499 -40.371 -51.144-134.823 1.00 0.00 H
+ATOM 13597 1HD2 ASN M 499 -42.228 -48.482-136.056 1.00 0.00 H
+ATOM 13598 2HD2 ASN M 499 -41.877 -49.577-134.762 1.00 0.00 H
+ATOM 13599 N GLY M 500 -37.502 -48.314-134.084 1.00112.82 N
+ATOM 13600 CA GLY M 500 -37.499 -47.138-133.239 1.00 94.64 C
+ATOM 13601 C GLY M 500 -37.383 -45.851-134.028 1.00 73.43 C
+ATOM 13602 O GLY M 500 -37.928 -45.740-135.130 1.00 77.51 O
+ATOM 13603 H GLY M 500 -36.659 -48.565-134.581 1.00 0.00 H
+ATOM 13604 1HA GLY M 500 -38.416 -47.110-132.651 1.00 0.00 H
+ATOM 13605 2HA GLY M 500 -36.669 -47.197-132.536 1.00 0.00 H
+ATOM 13606 N TYR M 501 -36.668 -44.875-133.476 1.00 61.50 N
+ATOM 13607 CA TYR M 501 -36.510 -43.572-134.105 1.00 59.29 C
+ATOM 13608 C TYR M 501 -35.202 -42.950-133.632 1.00 74.14 C
+ATOM 13609 O TYR M 501 -34.493 -43.501-132.781 1.00 77.20 O
+ATOM 13610 CB TYR M 501 -37.695 -42.656-133.786 1.00 55.77 C
+ATOM 13611 CG TYR M 501 -37.834 -42.341-132.311 1.00 70.71 C
+ATOM 13612 CD1 TYR M 501 -37.199 -41.238-131.753 1.00 72.26 C
+ATOM 13613 CD2 TYR M 501 -38.593 -43.152-131.476 1.00 71.76 C
+ATOM 13614 CE1 TYR M 501 -37.317 -40.950-130.408 1.00 82.24 C
+ATOM 13615 CE2 TYR M 501 -38.718 -42.872-130.130 1.00 85.51 C
+ATOM 13616 CZ TYR M 501 -38.078 -41.770-129.601 1.00 91.63 C
+ATOM 13617 OH TYR M 501 -38.197 -41.485-128.259 1.00 99.17 O
+ATOM 13618 H TYR M 501 -36.220 -45.050-132.588 1.00 0.00 H
+ATOM 13619 HA TYR M 501 -36.467 -43.712-135.185 1.00 0.00 H
+ATOM 13620 1HB TYR M 501 -37.585 -41.716-134.329 1.00 0.00 H
+ATOM 13621 2HB TYR M 501 -38.618 -43.124-134.125 1.00 0.00 H
+ATOM 13622 HD1 TYR M 501 -36.595 -40.582-132.380 1.00 0.00 H
+ATOM 13623 HD2 TYR M 501 -39.101 -44.027-131.881 1.00 0.00 H
+ATOM 13624 HE1 TYR M 501 -36.811 -40.080-129.991 1.00 0.00 H
+ATOM 13625 HE2 TYR M 501 -39.319 -43.520-129.492 1.00 0.00 H
+ATOM 13626 HH TYR M 501 -38.754 -42.146-127.841 1.00 0.00 H
+ATOM 13627 N THR M 502 -34.897 -41.779-134.185 1.00 68.79 N
+ATOM 13628 CA THR M 502 -33.732 -41.000-133.796 1.00 58.46 C
+ATOM 13629 C THR M 502 -34.120 -39.528-133.791 1.00 66.94 C
+ATOM 13630 O THR M 502 -34.783 -39.053-134.717 1.00 74.74 O
+ATOM 13631 CB THR M 502 -32.548 -41.254-134.742 1.00 67.73 C
+ATOM 13632 OG1 THR M 502 -31.463 -40.378-134.413 1.00 76.79 O
+ATOM 13633 CG2 THR M 502 -32.950 -41.042-136.198 1.00 66.74 C
+ATOM 13634 H THR M 502 -35.508 -41.424-134.906 1.00 0.00 H
+ATOM 13635 HA THR M 502 -33.435 -41.300-132.791 1.00 0.00 H
+ATOM 13636 HB THR M 502 -32.198 -42.279-134.620 1.00 0.00 H
+ATOM 13637 HG1 THR M 502 -31.715 -39.823-133.671 1.00 0.00 H
+ATOM 13638 1HG2 THR M 502 -32.092 -41.229-136.843 1.00 0.00 H
+ATOM 13639 2HG2 THR M 502 -33.756 -41.729-136.457 1.00 0.00 H
+ATOM 13640 3HG2 THR M 502 -33.290 -40.016-136.336 1.00 0.00 H
+ATOM 13641 N LEU M 503 -33.743 -38.821-132.730 1.00 70.33 N
+ATOM 13642 CA LEU M 503 -33.977 -37.388-132.634 1.00 71.90 C
+ATOM 13643 C LEU M 503 -32.751 -36.654-133.151 1.00 69.50 C
+ATOM 13644 O LEU M 503 -31.630 -36.904-132.686 1.00 79.85 O
+ATOM 13645 CB LEU M 503 -34.277 -36.972-131.194 1.00 79.31 C
+ATOM 13646 CG LEU M 503 -35.484 -37.636-130.534 1.00 76.65 C
+ATOM 13647 CD1 LEU M 503 -35.644 -37.136-129.110 1.00 72.09 C
+ATOM 13648 CD2 LEU M 503 -36.746 -37.385-131.343 1.00 80.66 C
+ATOM 13649 H LEU M 503 -33.280 -39.296-131.968 1.00 0.00 H
+ATOM 13650 HA LEU M 503 -34.840 -37.137-133.249 1.00 0.00 H
+ATOM 13651 1HB LEU M 503 -33.407 -37.196-130.579 1.00 0.00 H
+ATOM 13652 2HB LEU M 503 -34.445 -35.895-131.171 1.00 0.00 H
+ATOM 13653 HG LEU M 503 -35.317 -38.711-130.468 1.00 0.00 H
+ATOM 13654 1HD1 LEU M 503 -36.508 -37.617-128.650 1.00 0.00 H
+ATOM 13655 2HD1 LEU M 503 -34.748 -37.376-128.537 1.00 0.00 H
+ATOM 13656 3HD1 LEU M 503 -35.792 -36.057-129.118 1.00 0.00 H
+ATOM 13657 1HD2 LEU M 503 -37.593 -37.868-130.855 1.00 0.00 H
+ATOM 13658 2HD2 LEU M 503 -36.928 -36.312-131.409 1.00 0.00 H
+ATOM 13659 3HD2 LEU M 503 -36.623 -37.795-132.346 1.00 0.00 H
+ATOM 13660 N VAL M 504 -32.973 -35.756-134.113 1.00 70.28 N
+ATOM 13661 CA VAL M 504 -31.910 -35.041-134.812 1.00 77.01 C
+ATOM 13662 C VAL M 504 -32.173 -33.545-134.699 1.00 81.10 C
+ATOM 13663 O VAL M 504 -33.315 -33.097-134.846 1.00 77.10 O
+ATOM 13664 CB VAL M 504 -31.825 -35.473-136.293 1.00 70.05 C
+ATOM 13665 CG1 VAL M 504 -30.748 -34.698-137.014 1.00 73.08 C
+ATOM 13666 CG2 VAL M 504 -31.566 -36.968-136.402 1.00 59.52 C
+ATOM 13667 H VAL M 504 -33.935 -35.572-134.360 1.00 0.00 H
+ATOM 13668 HA VAL M 504 -30.960 -35.278-134.332 1.00 0.00 H
+ATOM 13669 HB VAL M 504 -32.768 -35.237-136.785 1.00 0.00 H
+ATOM 13670 1HG1 VAL M 504 -30.705 -35.017-138.056 1.00 0.00 H
+ATOM 13671 2HG1 VAL M 504 -30.975 -33.633-136.971 1.00 0.00 H
+ATOM 13672 3HG1 VAL M 504 -29.785 -34.884-136.538 1.00 0.00 H
+ATOM 13673 1HG2 VAL M 504 -31.510 -37.252-137.453 1.00 0.00 H
+ATOM 13674 2HG2 VAL M 504 -30.624 -37.211-135.910 1.00 0.00 H
+ATOM 13675 3HG2 VAL M 504 -32.378 -37.514-135.921 1.00 0.00 H
+ATOM 13676 N ILE M 505 -31.116 -32.770-134.451 1.00 84.11 N
+ATOM 13677 CA ILE M 505 -31.229 -31.349-134.128 1.00 78.51 C
+ATOM 13678 C ILE M 505 -30.599 -30.517-135.237 1.00 76.20 C
+ATOM 13679 O ILE M 505 -29.465 -30.779-135.655 1.00 84.17 O
+ATOM 13680 CB ILE M 505 -30.571 -31.029-132.776 1.00 72.58 C
+ATOM 13681 CG1 ILE M 505 -31.395 -31.617-131.630 1.00 71.99 C
+ATOM 13682 CG2 ILE M 505 -30.399 -29.528-132.608 1.00 66.85 C
+ATOM 13683 CD1 ILE M 505 -30.765 -31.412-130.273 1.00 74.26 C
+ATOM 13684 H ILE M 505 -30.200 -33.194-134.491 1.00 0.00 H
+ATOM 13685 HA ILE M 505 -32.286 -31.092-134.062 1.00 0.00 H
+ATOM 13686 HB ILE M 505 -29.592 -31.504-132.726 1.00 0.00 H
+ATOM 13687 1HG1 ILE M 505 -32.385 -31.163-131.624 1.00 0.00 H
+ATOM 13688 2HG1 ILE M 505 -31.528 -32.687-131.789 1.00 0.00 H
+ATOM 13689 1HG2 ILE M 505 -29.932 -29.321-131.645 1.00 0.00 H
+ATOM 13690 2HG2 ILE M 505 -29.768 -29.143-133.407 1.00 0.00 H
+ATOM 13691 3HG2 ILE M 505 -31.374 -29.043-132.650 1.00 0.00 H
+ATOM 13692 1HD1 ILE M 505 -31.401 -31.854-129.506 1.00 0.00 H
+ATOM 13693 2HD1 ILE M 505 -29.785 -31.890-130.251 1.00 0.00 H
+ATOM 13694 3HD1 ILE M 505 -30.654 -30.346-130.081 1.00 0.00 H
+ATOM 13695 N THR M 506 -31.334 -29.503-135.694 1.00 68.49 N
+ATOM 13696 CA THR M 506 -30.852 -28.526-136.667 1.00 73.78 C
+ATOM 13697 C THR M 506 -31.338 -27.150-136.231 1.00 80.08 C
+ATOM 13698 O THR M 506 -32.543 -26.873-136.271 1.00 76.87 O
+ATOM 13699 CB THR M 506 -31.346 -28.850-138.078 1.00 74.08 C
+ATOM 13700 OG1 THR M 506 -32.750 -29.139-138.043 1.00 61.03 O
+ATOM 13701 CG2 THR M 506 -30.602 -30.042-138.646 1.00 90.46 C
+ATOM 13702 H THR M 506 -32.275 -29.419-135.338 1.00 0.00 H
+ATOM 13703 HA THR M 506 -29.762 -28.553-136.674 1.00 0.00 H
+ATOM 13704 HB THR M 506 -31.186 -27.989-138.726 1.00 0.00 H
+ATOM 13705 HG1 THR M 506 -33.069 -29.065-137.140 1.00 0.00 H
+ATOM 13706 1HG2 THR M 506 -30.969 -30.255-139.650 1.00 0.00 H
+ATOM 13707 2HG2 THR M 506 -29.536 -29.819-138.688 1.00 0.00 H
+ATOM 13708 3HG2 THR M 506 -30.766 -30.910-138.009 1.00 0.00 H
+ATOM 13709 N GLY M 507 -30.411 -26.294-135.813 1.00 80.93 N
+ATOM 13710 CA GLY M 507 -30.784 -24.945-135.414 1.00 85.50 C
+ATOM 13711 C GLY M 507 -31.754 -24.950-134.247 1.00 78.51 C
+ATOM 13712 O GLY M 507 -31.547 -25.631-133.236 1.00 66.42 O
+ATOM 13713 H GLY M 507 -29.440 -26.570-135.768 1.00 0.00 H
+ATOM 13714 1HA GLY M 507 -29.889 -24.387-135.138 1.00 0.00 H
+ATOM 13715 2HA GLY M 507 -31.238 -24.428-136.259 1.00 0.00 H
+ATOM 13716 N LYS M 508 -32.832 -24.178-134.384 1.00 71.33 N
+ATOM 13717 CA LYS M 508 -33.867 -24.112-133.361 1.00 72.03 C
+ATOM 13718 C LYS M 508 -34.867 -25.256-133.449 1.00 81.42 C
+ATOM 13719 O LYS M 508 -35.816 -25.285-132.658 1.00 89.29 O
+ATOM 13720 CB LYS M 508 -34.606 -22.776-133.451 1.00 76.68 C
+ATOM 13721 CG LYS M 508 -33.741 -21.558-133.155 1.00 91.57 C
+ATOM 13722 CD LYS M 508 -34.571 -20.283-133.132 1.00 84.66 C
+ATOM 13723 CE LYS M 508 -35.066 -19.919-134.524 1.00 0.00 C
+ATOM 13724 NZ LYS M 508 -33.948 -19.542-135.431 1.00 0.00 N
+ATOM 13725 H LYS M 508 -32.933 -23.623-135.222 1.00 0.00 H
+ATOM 13726 HA LYS M 508 -33.391 -24.176-132.382 1.00 0.00 H
+ATOM 13727 1HB LYS M 508 -35.020 -22.656-134.452 1.00 0.00 H
+ATOM 13728 2HB LYS M 508 -35.440 -22.773-132.749 1.00 0.00 H
+ATOM 13729 1HG LYS M 508 -33.256 -21.683-132.186 1.00 0.00 H
+ATOM 13730 2HG LYS M 508 -32.969 -21.465-133.918 1.00 0.00 H
+ATOM 13731 1HD LYS M 508 -35.430 -20.419-132.474 1.00 0.00 H
+ATOM 13732 2HD LYS M 508 -33.966 -19.462-132.746 1.00 0.00 H
+ATOM 13733 1HE LYS M 508 -35.597 -20.767-134.954 1.00 0.00 H
+ATOM 13734 2HE LYS M 508 -35.760 -19.081-134.456 1.00 0.00 H
+ATOM 13735 1HZ LYS M 508 -34.318 -19.308-136.342 1.00 0.00 H
+ATOM 13736 2HZ LYS M 508 -33.460 -18.744-135.051 1.00 0.00 H
+ATOM 13737 3HZ LYS M 508 -33.308 -20.319-135.518 1.00 0.00 H
+ATOM 13738 N LYS M 509 -34.685 -26.192-134.378 1.00 77.77 N
+ATOM 13739 CA LYS M 509 -35.668 -27.233-134.640 1.00 86.91 C
+ATOM 13740 C LYS M 509 -35.078 -28.603-134.342 1.00 84.44 C
+ATOM 13741 O LYS M 509 -33.903 -28.854-134.614 1.00 98.20 O
+ATOM 13742 CB LYS M 509 -36.145 -27.172-136.098 1.00103.78 C
+ATOM 13743 CG LYS M 509 -37.233 -28.173-136.450 1.00107.11 C
+ATOM 13744 CD LYS M 509 -37.659 -28.037-137.904 1.00116.61 C
+ATOM 13745 CE LYS M 509 -36.516 -28.350-138.855 1.00122.28 C
+ATOM 13746 NZ LYS M 509 -36.040 -29.752-138.702 1.00128.81 N
+ATOM 13747 H LYS M 509 -33.832 -26.174-134.918 1.00 0.00 H
+ATOM 13748 HA LYS M 509 -36.526 -27.071-133.987 1.00 0.00 H
+ATOM 13749 1HB LYS M 509 -36.528 -26.174-136.314 1.00 0.00 H
+ATOM 13750 2HB LYS M 509 -35.301 -27.350-136.765 1.00 0.00 H
+ATOM 13751 1HG LYS M 509 -36.865 -29.186-136.281 1.00 0.00 H
+ATOM 13752 2HG LYS M 509 -38.099 -28.009-135.810 1.00 0.00 H
+ATOM 13753 1HD LYS M 509 -38.484 -28.721-138.107 1.00 0.00 H
+ATOM 13754 2HD LYS M 509 -38.001 -27.019-138.089 1.00 0.00 H
+ATOM 13755 1HE LYS M 509 -36.846 -28.199-139.882 1.00 0.00 H
+ATOM 13756 2HE LYS M 509 -35.685 -27.672-138.660 1.00 0.00 H
+ATOM 13757 1HZ LYS M 509 -35.282 -29.923-139.348 1.00 0.00 H
+ATOM 13758 2HZ LYS M 509 -35.715 -29.897-137.756 1.00 0.00 H
+ATOM 13759 3HZ LYS M 509 -36.799 -30.389-138.898 1.00 0.00 H
+ATOM 13760 N ILE M 510 -35.897 -29.486-133.774 1.00 76.82 N
+ATOM 13761 CA ILE M 510 -35.538 -30.884-133.577 1.00 75.35 C
+ATOM 13762 C ILE M 510 -36.610 -31.745-134.229 1.00 76.93 C
+ATOM 13763 O ILE M 510 -37.803 -31.434-134.146 1.00 71.81 O
+ATOM 13764 CB ILE M 510 -35.371 -31.241-132.083 1.00 79.05 C
+ATOM 13765 CG1 ILE M 510 -34.929 -32.699-131.931 1.00 83.69 C
+ATOM 13766 CG2 ILE M 510 -36.657 -30.978-131.311 1.00 71.99 C
+ATOM 13767 CD1 ILE M 510 -34.750 -33.138-130.500 1.00 88.75 C
+ATOM 13768 H ILE M 510 -36.804 -29.164-133.470 1.00 0.00 H
+ATOM 13769 HA ILE M 510 -34.585 -31.069-134.072 1.00 0.00 H
+ATOM 13770 HB ILE M 510 -34.575 -30.635-131.651 1.00 0.00 H
+ATOM 13771 1HG1 ILE M 510 -35.665 -33.353-132.398 1.00 0.00 H
+ATOM 13772 2HG1 ILE M 510 -33.983 -32.849-132.452 1.00 0.00 H
+ATOM 13773 1HG2 ILE M 510 -36.512 -31.238-130.263 1.00 0.00 H
+ATOM 13774 2HG2 ILE M 510 -36.919 -29.924-131.390 1.00 0.00 H
+ATOM 13775 3HG2 ILE M 510 -37.462 -31.584-131.727 1.00 0.00 H
+ATOM 13776 1HD1 ILE M 510 -34.436 -34.182-130.476 1.00 0.00 H
+ATOM 13777 2HD1 ILE M 510 -33.990 -32.519-130.022 1.00 0.00 H
+ATOM 13778 3HD1 ILE M 510 -35.693 -33.032-129.966 1.00 0.00 H
+ATOM 13779 N THR M 511 -36.182 -32.818-134.889 1.00 85.55 N
+ATOM 13780 CA THR M 511 -37.074 -33.665-135.664 1.00 71.69 C
+ATOM 13781 C THR M 511 -36.913 -35.118-135.247 1.00 77.96 C
+ATOM 13782 O THR M 511 -35.795 -35.584-134.988 1.00 89.38 O
+ATOM 13783 CB THR M 511 -36.798 -33.527-137.159 1.00 68.55 C
+ATOM 13784 OG1 THR M 511 -36.531 -32.154-137.466 1.00 78.45 O
+ATOM 13785 CG2 THR M 511 -37.996 -33.991-137.963 1.00 76.54 C
+ATOM 13786 H THR M 511 -35.199 -33.048-134.846 1.00 0.00 H
+ATOM 13787 HA THR M 511 -38.101 -33.352-135.473 1.00 0.00 H
+ATOM 13788 HB THR M 511 -35.931 -34.131-137.426 1.00 0.00 H
+ATOM 13789 HG1 THR M 511 -36.586 -31.631-136.663 1.00 0.00 H
+ATOM 13790 1HG2 THR M 511 -37.783 -33.887-139.027 1.00 0.00 H
+ATOM 13791 2HG2 THR M 511 -38.204 -35.036-137.735 1.00 0.00 H
+ATOM 13792 3HG2 THR M 511 -38.863 -33.384-137.706 1.00 0.00 H
+ATOM 13793 N LYS M 512 -38.040 -35.823-135.176 1.00 75.64 N
+ATOM 13794 CA LYS M 512 -38.052 -37.256-134.916 1.00 76.64 C
+ATOM 13795 C LYS M 512 -38.090 -37.993-136.248 1.00 84.26 C
+ATOM 13796 O LYS M 512 -39.043 -37.845-137.021 1.00 94.64 O
+ATOM 13797 CB LYS M 512 -39.246 -37.657-134.051 1.00 74.46 C
+ATOM 13798 CG LYS M 512 -39.259 -39.140-133.725 1.00 75.52 C
+ATOM 13799 CD LYS M 512 -40.662 -39.664-133.489 1.00 74.71 C
+ATOM 13800 CE LYS M 512 -41.122 -39.437-132.069 1.00 69.50 C
+ATOM 13801 NZ LYS M 512 -42.382 -40.187-131.806 1.00 81.23 N
+ATOM 13802 H LYS M 512 -38.917 -35.340-135.308 1.00 0.00 H
+ATOM 13803 HA LYS M 512 -37.140 -37.518-134.379 1.00 0.00 H
+ATOM 13804 1HB LYS M 512 -39.226 -37.092-133.119 1.00 0.00 H
+ATOM 13805 2HB LYS M 512 -40.172 -37.403-134.568 1.00 0.00 H
+ATOM 13806 1HG LYS M 512 -38.815 -39.698-134.550 1.00 0.00 H
+ATOM 13807 2HG LYS M 512 -38.667 -39.320-132.828 1.00 0.00 H
+ATOM 13808 1HD LYS M 512 -41.356 -39.163-134.164 1.00 0.00 H
+ATOM 13809 2HD LYS M 512 -40.690 -40.734-133.696 1.00 0.00 H
+ATOM 13810 1HE LYS M 512 -40.348 -39.769-131.379 1.00 0.00 H
+ATOM 13811 2HE LYS M 512 -41.290 -38.372-131.907 1.00 0.00 H
+ATOM 13812 1HZ LYS M 512 -42.678 -40.026-130.854 1.00 0.00 H
+ATOM 13813 2HZ LYS M 512 -43.102 -39.870-132.440 1.00 0.00 H
+ATOM 13814 3HZ LYS M 512 -42.222 -41.174-131.946 1.00 0.00 H
+ATOM 13815 N ILE M 513 -37.061 -38.788-136.507 1.00 76.49 N
+ATOM 13816 CA ILE M 513 -36.865 -39.445-137.791 1.00 64.05 C
+ATOM 13817 C ILE M 513 -36.937 -40.951-137.574 1.00 68.96 C
+ATOM 13818 O ILE M 513 -36.182 -41.495-136.764 1.00 77.39 O
+ATOM 13819 CB ILE M 513 -35.522 -39.049-138.426 1.00 55.22 C
+ATOM 13820 CG1 ILE M 513 -35.490 -37.541-138.698 1.00 56.71 C
+ATOM 13821 CG2 ILE M 513 -35.267 -39.851-139.681 1.00 50.18 C
+ATOM 13822 CD1 ILE M 513 -34.134 -37.033-139.134 1.00 54.76 C
+ATOM 13823 H ILE M 513 -36.387 -38.938-135.770 1.00 0.00 H
+ATOM 13824 HA ILE M 513 -37.664 -39.134-138.464 1.00 0.00 H
+ATOM 13825 HB ILE M 513 -34.715 -39.238-137.718 1.00 0.00 H
+ATOM 13826 1HG1 ILE M 513 -36.214 -37.296-139.474 1.00 0.00 H
+ATOM 13827 2HG1 ILE M 513 -35.783 -37.002-137.797 1.00 0.00 H
+ATOM 13828 1HG2 ILE M 513 -34.312 -39.555-140.114 1.00 0.00 H
+ATOM 13829 2HG2 ILE M 513 -35.240 -40.912-139.435 1.00 0.00 H
+ATOM 13830 3HG2 ILE M 513 -36.065 -39.665-140.400 1.00 0.00 H
+ATOM 13831 1HD1 ILE M 513 -34.187 -35.958-139.308 1.00 0.00 H
+ATOM 13832 2HD1 ILE M 513 -33.400 -37.239-138.354 1.00 0.00 H
+ATOM 13833 3HD1 ILE M 513 -33.836 -37.534-140.054 1.00 0.00 H
+ATOM 13834 N PRO M 514 -37.822 -41.667-138.263 1.00 67.81 N
+ATOM 13835 CA PRO M 514 -37.902 -43.118-138.071 1.00 68.64 C
+ATOM 13836 C PRO M 514 -36.693 -43.828-138.659 1.00 72.67 C
+ATOM 13837 O PRO M 514 -36.135 -43.420-139.680 1.00 73.79 O
+ATOM 13838 CB PRO M 514 -39.189 -43.503-138.807 1.00 60.63 C
+ATOM 13839 CG PRO M 514 -39.353 -42.444-139.840 1.00 60.84 C
+ATOM 13840 CD PRO M 514 -38.824 -41.177-139.224 1.00 67.60 C
+ATOM 13841 HA PRO M 514 -37.986 -43.337-136.996 1.00 0.00 H
+ATOM 13842 1HB PRO M 514 -39.088 -44.509-139.241 1.00 0.00 H
+ATOM 13843 2HB PRO M 514 -40.030 -43.541-138.099 1.00 0.00 H
+ATOM 13844 1HG PRO M 514 -38.803 -42.716-140.753 1.00 0.00 H
+ATOM 13845 2HG PRO M 514 -40.412 -42.350-140.123 1.00 0.00 H
+ATOM 13846 1HD PRO M 514 -38.367 -40.552-140.005 1.00 0.00 H
+ATOM 13847 2HD PRO M 514 -39.645 -40.639-138.728 1.00 0.00 H
+ATOM 13848 N LEU M 515 -36.290 -44.909-137.993 1.00 71.74 N
+ATOM 13849 CA LEU M 515 -35.111 -45.653-138.414 1.00 69.66 C
+ATOM 13850 C LEU M 515 -35.352 -46.516-139.646 1.00 74.49 C
+ATOM 13851 O LEU M 515 -34.384 -47.027-140.217 1.00 84.67 O
+ATOM 13852 CB LEU M 515 -34.607 -46.538-137.270 1.00 70.98 C
+ATOM 13853 CG LEU M 515 -34.138 -45.871-135.973 1.00 62.64 C
+ATOM 13854 CD1 LEU M 515 -33.599 -46.923-135.010 1.00 68.13 C
+ATOM 13855 CD2 LEU M 515 -33.096 -44.792-136.232 1.00 54.16 C
+ATOM 13856 H LEU M 515 -36.806 -45.222-137.183 1.00 0.00 H
+ATOM 13857 HA LEU M 515 -34.329 -44.942-138.677 1.00 0.00 H
+ATOM 13858 1HB LEU M 515 -35.403 -47.224-136.985 1.00 0.00 H
+ATOM 13859 2HB LEU M 515 -33.762 -47.124-137.630 1.00 0.00 H
+ATOM 13860 HG LEU M 515 -34.990 -45.409-135.473 1.00 0.00 H
+ATOM 13861 1HD1 LEU M 515 -33.268 -46.439-134.091 1.00 0.00 H
+ATOM 13862 2HD1 LEU M 515 -34.386 -47.641-134.778 1.00 0.00 H
+ATOM 13863 3HD1 LEU M 515 -32.758 -47.441-135.470 1.00 0.00 H
+ATOM 13864 1HD2 LEU M 515 -32.792 -44.345-135.285 1.00 0.00 H
+ATOM 13865 2HD2 LEU M 515 -32.227 -45.235-136.720 1.00 0.00 H
+ATOM 13866 3HD2 LEU M 515 -33.521 -44.023-136.877 1.00 0.00 H
+ATOM 13867 N ASN M 516 -36.602 -46.695-140.067 1.00 80.80 N
+ATOM 13868 CA ASN M 516 -36.914 -47.555-141.199 1.00 82.54 C
+ATOM 13869 C ASN M 516 -38.070 -46.967-141.993 1.00 94.90 C
+ATOM 13870 O ASN M 516 -38.939 -46.285-141.444 1.00 94.99 O
+ATOM 13871 CB ASN M 516 -37.276 -48.977-140.750 1.00 74.15 C
+ATOM 13872 CG ASN M 516 -36.089 -49.734-140.193 1.00 86.56 C
+ATOM 13873 OD1 ASN M 516 -35.016 -49.760-140.797 1.00 96.29 O
+ATOM 13874 ND2 ASN M 516 -36.280 -50.368-139.042 1.00 86.90 N
+ATOM 13875 H ASN M 516 -37.354 -46.221-139.587 1.00 0.00 H
+ATOM 13876 HA ASN M 516 -36.033 -47.617-141.840 1.00 0.00 H
+ATOM 13877 1HB ASN M 516 -38.053 -48.931-139.986 1.00 0.00 H
+ATOM 13878 2HB ASN M 516 -37.681 -49.533-141.595 1.00 0.00 H
+ATOM 13879 1HD2 ASN M 516 -35.532 -50.885-138.626 1.00 0.00 H
+ATOM 13880 2HD2 ASN M 516 -37.171 -50.329-138.592 1.00 0.00 H
+ATOM 13881 N GLY M 517 -38.072 -47.243-143.296 1.00102.44 N
+ATOM 13882 CA GLY M 517 -39.170 -46.879-144.163 1.00108.76 C
+ATOM 13883 C GLY M 517 -38.987 -45.593-144.939 1.00104.75 C
+ATOM 13884 O GLY M 517 -39.811 -45.300-145.815 1.00116.67 O
+ATOM 13885 H GLY M 517 -37.275 -47.724-143.687 1.00 0.00 H
+ATOM 13886 1HA GLY M 517 -39.342 -47.676-144.887 1.00 0.00 H
+ATOM 13887 2HA GLY M 517 -40.081 -46.778-143.574 1.00 0.00 H
+ATOM 13888 N LEU M 518 -37.943 -44.813-144.650 1.00 80.31 N
+ATOM 13889 CA LEU M 518 -37.727 -43.570-145.380 1.00 77.68 C
+ATOM 13890 C LEU M 518 -37.104 -43.788-146.750 1.00 91.59 C
+ATOM 13891 O LEU M 518 -37.199 -42.900-147.605 1.00 94.21 O
+ATOM 13892 CB LEU M 518 -36.846 -42.616-144.577 1.00 81.37 C
+ATOM 13893 CG LEU M 518 -37.512 -41.914-143.397 1.00 86.03 C
+ATOM 13894 CD1 LEU M 518 -36.585 -40.842-142.858 1.00 86.18 C
+ATOM 13895 CD2 LEU M 518 -38.858 -41.327-143.797 1.00 81.67 C
+ATOM 13896 H LEU M 518 -37.293 -45.076-143.923 1.00 0.00 H
+ATOM 13897 HA LEU M 518 -38.693 -43.093-145.544 1.00 0.00 H
+ATOM 13898 1HB LEU M 518 -35.996 -43.173-144.187 1.00 0.00 H
+ATOM 13899 2HB LEU M 518 -36.470 -41.843-145.247 1.00 0.00 H
+ATOM 13900 HG LEU M 518 -37.670 -42.630-142.590 1.00 0.00 H
+ATOM 13901 1HD1 LEU M 518 -37.060 -40.340-142.015 1.00 0.00 H
+ATOM 13902 2HD1 LEU M 518 -35.652 -41.300-142.528 1.00 0.00 H
+ATOM 13903 3HD1 LEU M 518 -36.376 -40.115-143.642 1.00 0.00 H
+ATOM 13904 1HD2 LEU M 518 -39.310 -40.833-142.936 1.00 0.00 H
+ATOM 13905 2HD2 LEU M 518 -38.715 -40.601-144.598 1.00 0.00 H
+ATOM 13906 3HD2 LEU M 518 -39.514 -42.125-144.144 1.00 0.00 H
+ATOM 13907 N GLY M 519 -36.461 -44.933-146.977 1.00 96.69 N
+ATOM 13908 CA GLY M 519 -35.941 -45.231-148.298 1.00 89.23 C
+ATOM 13909 C GLY M 519 -37.019 -45.395-149.345 1.00 80.85 C
+ATOM 13910 O GLY M 519 -36.753 -45.196-150.534 1.00 95.28 O
+ATOM 13911 H GLY M 519 -36.329 -45.604-146.234 1.00 0.00 H
+ATOM 13912 1HA GLY M 519 -35.270 -44.432-148.614 1.00 0.00 H
+ATOM 13913 2HA GLY M 519 -35.353 -46.147-148.259 1.00 0.00 H
+ATOM 13914 N CYS M 520 -38.238 -45.744-148.929 1.00 75.72 N
+ATOM 13915 CA CYS M 520 -39.339 -45.910-149.870 1.00 81.98 C
+ATOM 13916 C CYS M 520 -39.967 -44.582-150.275 1.00 87.23 C
+ATOM 13917 O CYS M 520 -40.452 -44.453-151.404 1.00 98.43 O
+ATOM 13918 CB CYS M 520 -40.418 -46.819-149.270 1.00 91.94 C
+ATOM 13919 SG CYS M 520 -39.830 -48.331-148.451 1.00106.14 S
+ATOM 13920 H CYS M 520 -38.405 -45.897-147.945 1.00 0.00 H
+ATOM 13921 HA CYS M 520 -38.952 -46.376-150.776 1.00 0.00 H
+ATOM 13922 1HB CYS M 520 -40.994 -46.262-148.531 1.00 0.00 H
+ATOM 13923 2HB CYS M 520 -41.108 -47.131-150.054 1.00 0.00 H
+ATOM 13924 N ARG M 521 -39.959 -43.590-149.385 1.00 90.79 N
+ATOM 13925 CA ARG M 521 -40.810 -42.414-149.535 1.00 99.33 C
+ATOM 13926 C ARG M 521 -40.285 -41.407-150.553 1.00107.61 C
+ATOM 13927 O ARG M 521 -40.727 -40.253-150.562 1.00128.06 O
+ATOM 13928 CB ARG M 521 -41.004 -41.731-148.175 1.00101.49 C
+ATOM 13929 CG ARG M 521 -41.887 -42.507-147.209 1.00104.96 C
+ATOM 13930 CD ARG M 521 -41.977 -41.808-145.859 1.00119.34 C
+ATOM 13931 NE ARG M 521 -42.445 -40.427-145.963 1.00132.12 N
+ATOM 13932 CZ ARG M 521 -42.654 -39.628-144.918 1.00136.95 C
+ATOM 13933 NH1 ARG M 521 -42.445 -40.073-143.685 1.00130.44 N
+ATOM 13934 NH2 ARG M 521 -43.075 -38.384-145.105 1.00139.98 N
+ATOM 13935 H ARG M 521 -39.346 -43.655-148.585 1.00 0.00 H
+ATOM 13936 HA ARG M 521 -41.782 -42.736-149.910 1.00 0.00 H
+ATOM 13937 1HB ARG M 521 -40.035 -41.584-147.701 1.00 0.00 H
+ATOM 13938 2HB ARG M 521 -41.449 -40.747-148.322 1.00 0.00 H
+ATOM 13939 1HG ARG M 521 -42.892 -42.592-147.623 1.00 0.00 H
+ATOM 13940 2HG ARG M 521 -41.471 -43.504-147.056 1.00 0.00 H
+ATOM 13941 1HD ARG M 521 -42.673 -42.346-145.216 1.00 0.00 H
+ATOM 13942 2HD ARG M 521 -40.993 -41.790-145.393 1.00 0.00 H
+ATOM 13943 HE ARG M 521 -42.620 -40.058-146.888 1.00 0.00 H
+ATOM 13944 1HH1 ARG M 521 -42.126 -41.020-143.537 1.00 0.00 H
+ATOM 13945 2HH1 ARG M 521 -42.604 -39.465-142.895 1.00 0.00 H
+ATOM 13946 1HH2 ARG M 521 -43.238 -38.041-146.042 1.00 0.00 H
+ATOM 13947 2HH2 ARG M 521 -43.233 -37.780-144.312 1.00 0.00 H
+ATOM 13948 N HIS M 522 -39.361 -41.817-151.419 1.00 98.38 N
+ATOM 13949 CA HIS M 522 -38.924 -40.957-152.508 1.00107.62 C
+ATOM 13950 C HIS M 522 -39.160 -41.578-153.878 1.00111.59 C
+ATOM 13951 O HIS M 522 -38.898 -40.923-154.893 1.00117.64 O
+ATOM 13952 CB HIS M 522 -37.441 -40.580-152.349 1.00120.50 C
+ATOM 13953 CG HIS M 522 -36.485 -41.653-152.768 1.00127.54 C
+ATOM 13954 ND1 HIS M 522 -36.016 -42.620-151.904 1.00132.88 N
+ATOM 13955 CD2 HIS M 522 -35.894 -41.897-153.961 1.00129.15 C
+ATOM 13956 CE1 HIS M 522 -35.186 -43.418-152.551 1.00134.93 C
+ATOM 13957 NE2 HIS M 522 -35.095 -43.001-153.801 1.00132.39 N
+ATOM 13958 H HIS M 522 -38.954 -42.736-151.324 1.00 0.00 H
+ATOM 13959 HA HIS M 522 -39.507 -40.036-152.501 1.00 0.00 H
+ATOM 13960 1HB HIS M 522 -37.226 -39.689-152.941 1.00 0.00 H
+ATOM 13961 2HB HIS M 522 -37.237 -40.337-151.306 1.00 0.00 H
+ATOM 13962 HD2 HIS M 522 -36.031 -41.325-154.879 1.00 0.00 H
+ATOM 13963 HE1 HIS M 522 -34.665 -44.275-152.126 1.00 0.00 H
+ATOM 13964 HE2 HIS M 522 -34.531 -43.423-154.525 1.00 0.00 H
+ATOM 13965 N PHE M 523 -39.647 -42.815-153.936 1.00109.76 N
+ATOM 13966 CA PHE M 523 -40.062 -43.418-155.195 1.00101.88 C
+ATOM 13967 C PHE M 523 -41.479 -42.979-155.540 1.00 99.99 C
+ATOM 13968 O PHE M 523 -42.345 -42.885-154.665 1.00109.48 O
+ATOM 13969 CB PHE M 523 -39.990 -44.943-155.111 1.00 90.55 C
+ATOM 13970 CG PHE M 523 -38.600 -45.474-154.918 1.00 87.03 C
+ATOM 13971 CD1 PHE M 523 -38.321 -46.369-153.898 1.00 78.73 C
+ATOM 13972 CD2 PHE M 523 -37.576 -45.096-155.769 1.00 91.55 C
+ATOM 13973 CE1 PHE M 523 -37.040 -46.860-153.719 1.00 71.26 C
+ATOM 13974 CE2 PHE M 523 -36.296 -45.587-155.598 1.00 88.07 C
+ATOM 13975 CZ PHE M 523 -36.029 -46.471-154.570 1.00 79.46 C
+ATOM 13976 H PHE M 523 -39.731 -43.350-153.083 1.00 0.00 H
+ATOM 13977 HA PHE M 523 -39.384 -43.081-155.980 1.00 0.00 H
+ATOM 13978 1HB PHE M 523 -40.605 -45.291-154.282 1.00 0.00 H
+ATOM 13979 2HB PHE M 523 -40.396 -45.377-156.024 1.00 0.00 H
+ATOM 13980 HD1 PHE M 523 -39.125 -46.686-153.233 1.00 0.00 H
+ATOM 13981 HD2 PHE M 523 -37.788 -44.398-156.580 1.00 0.00 H
+ATOM 13982 HE1 PHE M 523 -36.832 -47.554-152.905 1.00 0.00 H
+ATOM 13983 HE2 PHE M 523 -35.497 -45.278-156.271 1.00 0.00 H
+ATOM 13984 HZ PHE M 523 -35.020 -46.858-154.432 1.00 0.00 H
+ATOM 13985 N GLN M 524 -41.715 -42.708-156.823 1.00 93.69 N
+ATOM 13986 CA GLN M 524 -43.006 -42.199-157.270 1.00 93.25 C
+ATOM 13987 C GLN M 524 -43.682 -43.108-158.288 1.00 92.36 C
+ATOM 13988 O GLN M 524 -44.700 -42.714-158.869 1.00 96.18 O
+ATOM 13989 CB GLN M 524 -42.839 -40.799-157.866 1.00 92.57 C
+ATOM 13990 CG GLN M 524 -42.335 -39.759-156.880 1.00 85.18 C
+ATOM 13991 CD GLN M 524 -42.177 -38.389-157.513 1.00 0.00 C
+ATOM 13992 OE1 GLN M 524 -41.896 -38.272-158.710 1.00 0.00 O
+ATOM 13993 NE2 GLN M 524 -42.356 -37.344-156.714 1.00 0.00 N
+ATOM 13994 H GLN M 524 -40.983 -42.858-157.503 1.00 0.00 H
+ATOM 13995 HA GLN M 524 -43.677 -42.156-156.412 1.00 0.00 H
+ATOM 13996 1HB GLN M 524 -42.138 -40.839-158.700 1.00 0.00 H
+ATOM 13997 2HB GLN M 524 -43.795 -40.454-158.259 1.00 0.00 H
+ATOM 13998 1HG GLN M 524 -43.048 -39.675-156.060 1.00 0.00 H
+ATOM 13999 2HG GLN M 524 -41.363 -40.074-156.500 1.00 0.00 H
+ATOM 14000 1HE2 GLN M 524 -42.265 -36.415-157.076 1.00 0.00 H
+ATOM 14001 2HE2 GLN M 524 -42.583 -37.484-155.750 1.00 0.00 H
+ATOM 14002 N SER M 525 -43.154 -44.310-158.514 1.00 95.88 N
+ATOM 14003 CA SER M 525 -43.734 -45.261-159.451 1.00 89.99 C
+ATOM 14004 C SER M 525 -43.541 -46.675-158.926 1.00 89.81 C
+ATOM 14005 O SER M 525 -42.499 -46.993-158.345 1.00104.79 O
+ATOM 14006 CB SER M 525 -43.107 -45.135-160.842 1.00 99.26 C
+ATOM 14007 OG SER M 525 -43.566 -46.168-161.694 1.00111.20 O
+ATOM 14008 H SER M 525 -42.316 -44.564-158.010 1.00 0.00 H
+ATOM 14009 HA SER M 525 -44.801 -45.052-159.540 1.00 0.00 H
+ATOM 14010 1HB SER M 525 -43.360 -44.165-161.269 1.00 0.00 H
+ATOM 14011 2HB SER M 525 -42.022 -45.182-160.757 1.00 0.00 H
+ATOM 14012 HG SER M 525 -44.169 -46.697-161.167 1.00 0.00 H
+ATOM 14013 N CYS M 526 -44.550 -47.522-159.141 1.00 80.39 N
+ATOM 14014 CA CYS M 526 -44.489 -48.895-158.644 1.00 78.24 C
+ATOM 14015 C CYS M 526 -43.365 -49.684-159.299 1.00 89.36 C
+ATOM 14016 O CYS M 526 -42.722 -50.516-158.648 1.00 82.98 O
+ATOM 14017 CB CYS M 526 -45.841 -49.573-158.852 1.00 86.16 C
+ATOM 14018 SG CYS M 526 -45.859 -51.377-158.981 1.00104.65 S
+ATOM 14019 H CYS M 526 -45.367 -47.219-159.651 1.00 0.00 H
+ATOM 14020 HA CYS M 526 -44.264 -48.867-157.578 1.00 0.00 H
+ATOM 14021 1HB CYS M 526 -46.506 -49.320-158.026 1.00 0.00 H
+ATOM 14022 2HB CYS M 526 -46.299 -49.198-159.767 1.00 0.00 H
+ATOM 14023 N SER M 527 -43.118 -49.446-160.585 1.00112.64 N
+ATOM 14024 CA SER M 527 -41.982 -50.081-161.240 1.00115.80 C
+ATOM 14025 C SER M 527 -40.658 -49.646-160.623 1.00111.11 C
+ATOM 14026 O SER M 527 -39.666 -50.380-160.717 1.00120.40 O
+ATOM 14027 CB SER M 527 -41.989 -49.753-162.720 1.00124.81 C
+ATOM 14028 OG SER M 527 -41.752 -48.389-162.934 1.00 0.00 O
+ATOM 14029 H SER M 527 -43.711 -48.827-161.119 1.00 0.00 H
+ATOM 14030 HA SER M 527 -42.064 -51.160-161.105 1.00 0.00 H
+ATOM 14031 1HB SER M 527 -41.224 -50.341-163.227 1.00 0.00 H
+ATOM 14032 2HB SER M 527 -42.951 -50.029-163.149 1.00 0.00 H
+ATOM 14033 HG SER M 527 -42.461 -47.923-162.483 1.00 0.00 H
+ATOM 14034 N GLN M 528 -40.625 -48.474-159.988 1.00 82.37 N
+ATOM 14035 CA GLN M 528 -39.450 -48.019-159.258 1.00 74.28 C
+ATOM 14036 C GLN M 528 -39.475 -48.484-157.809 1.00 96.02 C
+ATOM 14037 O GLN M 528 -38.433 -48.857-157.259 1.00 93.92 O
+ATOM 14038 CB GLN M 528 -39.353 -46.492-159.311 1.00 92.89 C
+ATOM 14039 CG GLN M 528 -39.416 -45.908-160.713 1.00107.96 C
+ATOM 14040 CD GLN M 528 -39.413 -44.391-160.715 1.00115.93 C
+ATOM 14041 OE1 GLN M 528 -39.187 -43.758-159.683 1.00108.28 O
+ATOM 14042 NE2 GLN M 528 -39.669 -43.800-161.878 1.00128.97 N
+ATOM 14043 H GLN M 528 -41.445 -47.885-160.017 1.00 0.00 H
+ATOM 14044 HA GLN M 528 -38.564 -48.443-159.730 1.00 0.00 H
+ATOM 14045 1HB GLN M 528 -40.165 -46.055-158.730 1.00 0.00 H
+ATOM 14046 2HB GLN M 528 -38.416 -46.171-158.856 1.00 0.00 H
+ATOM 14047 1HG GLN M 528 -38.549 -46.250-161.277 1.00 0.00 H
+ATOM 14048 2HG GLN M 528 -40.333 -46.247-161.196 1.00 0.00 H
+ATOM 14049 1HE2 GLN M 528 -39.681 -42.801-161.940 1.00 0.00 H
+ATOM 14050 2HE2 GLN M 528 -39.850 -44.353-162.691 1.00 0.00 H
+ATOM 14051 N CYS M 529 -40.654 -48.467-157.182 1.00 89.40 N
+ATOM 14052 CA CYS M 529 -40.787 -48.982-155.824 1.00 70.55 C
+ATOM 14053 C CYS M 529 -40.402 -50.454-155.751 1.00 79.01 C
+ATOM 14054 O CYS M 529 -39.983 -50.937-154.695 1.00 82.28 O
+ATOM 14055 CB CYS M 529 -42.220 -48.771-155.332 1.00 76.57 C
+ATOM 14056 SG CYS M 529 -42.517 -49.070-153.569 1.00107.56 S
+ATOM 14057 H CYS M 529 -41.468 -48.094-157.649 1.00 0.00 H
+ATOM 14058 HA CYS M 529 -40.104 -48.432-155.177 1.00 0.00 H
+ATOM 14059 1HB CYS M 529 -42.527 -47.745-155.534 1.00 0.00 H
+ATOM 14060 2HB CYS M 529 -42.894 -49.428-155.881 1.00 0.00 H
+ATOM 14061 N LEU M 530 -40.524 -51.180-156.862 1.00 94.53 N
+ATOM 14062 CA LEU M 530 -40.123 -52.580-156.884 1.00 89.03 C
+ATOM 14063 C LEU M 530 -38.608 -52.741-156.918 1.00 83.98 C
+ATOM 14064 O LEU M 530 -38.099 -53.796-156.528 1.00 88.47 O
+ATOM 14065 CB LEU M 530 -40.741 -53.282-158.100 1.00 84.55 C
+ATOM 14066 CG LEU M 530 -40.602 -54.809-158.128 1.00 76.31 C
+ATOM 14067 CD1 LEU M 530 -41.259 -55.402-156.888 1.00 0.00 C
+ATOM 14068 CD2 LEU M 530 -41.239 -55.354-159.398 1.00 0.00 C
+ATOM 14069 H LEU M 530 -40.898 -50.762-157.702 1.00 0.00 H
+ATOM 14070 HA LEU M 530 -40.472 -53.054-155.967 1.00 0.00 H
+ATOM 14071 1HB LEU M 530 -41.803 -53.045-158.135 1.00 0.00 H
+ATOM 14072 2HB LEU M 530 -40.273 -52.890-159.003 1.00 0.00 H
+ATOM 14073 HG LEU M 530 -39.546 -55.079-158.107 1.00 0.00 H
+ATOM 14074 1HD1 LEU M 530 -41.160 -56.488-156.908 1.00 0.00 H
+ATOM 14075 2HD1 LEU M 530 -40.772 -55.010-155.996 1.00 0.00 H
+ATOM 14076 3HD1 LEU M 530 -42.315 -55.134-156.873 1.00 0.00 H
+ATOM 14077 1HD2 LEU M 530 -41.139 -56.440-159.418 1.00 0.00 H
+ATOM 14078 2HD2 LEU M 530 -42.295 -55.086-159.419 1.00 0.00 H
+ATOM 14079 3HD2 LEU M 530 -40.738 -54.928-160.267 1.00 0.00 H
+ATOM 14080 N SER M 531 -37.879 -51.718-157.355 1.00 85.94 N
+ATOM 14081 CA SER M 531 -36.433 -51.791-157.506 1.00 86.35 C
+ATOM 14082 C SER M 531 -35.683 -51.366-156.252 1.00 94.01 C
+ATOM 14083 O SER M 531 -34.453 -51.251-156.290 1.00100.01 O
+ATOM 14084 CB SER M 531 -35.981 -50.921-158.677 1.00 81.11 C
+ATOM 14085 OG SER M 531 -35.976 -49.553-158.306 1.00 80.59 O
+ATOM 14086 H SER M 531 -38.355 -50.859-157.590 1.00 0.00 H
+ATOM 14087 HA SER M 531 -36.158 -52.827-157.711 1.00 0.00 H
+ATOM 14088 1HB SER M 531 -34.982 -51.224-158.991 1.00 0.00 H
+ATOM 14089 2HB SER M 531 -36.650 -51.073-159.523 1.00 0.00 H
+ATOM 14090 HG SER M 531 -36.265 -49.526-157.391 1.00 0.00 H
+ATOM 14091 N ALA M 532 -36.393 -51.113-155.156 1.00 89.43 N
+ATOM 14092 CA ALA M 532 -35.738 -50.705-153.928 1.00 86.18 C
+ATOM 14093 C ALA M 532 -34.828 -51.824-153.425 1.00 95.41 C
+ATOM 14094 O ALA M 532 -35.080 -53.005-153.687 1.00104.55 O
+ATOM 14095 CB ALA M 532 -36.773 -50.349-152.865 1.00 80.34 C
+ATOM 14096 H ALA M 532 -37.399 -51.203-155.170 1.00 0.00 H
+ATOM 14097 HA ALA M 532 -35.135 -49.822-154.143 1.00 0.00 H
+ATOM 14098 1HB ALA M 532 -36.265 -50.045-151.950 1.00 0.00 H
+ATOM 14099 2HB ALA M 532 -37.396 -49.529-153.224 1.00 0.00 H
+ATOM 14100 3HB ALA M 532 -37.398 -51.217-152.661 1.00 0.00 H
+ATOM 14101 N PRO M 533 -33.751 -51.480-152.722 1.00 88.79 N
+ATOM 14102 CA PRO M 533 -32.893 -52.513-152.156 1.00 85.62 C
+ATOM 14103 C PRO M 533 -33.692 -53.423-151.236 1.00 77.09 C
+ATOM 14104 O PRO M 533 -34.638 -52.975-150.565 1.00 76.73 O
+ATOM 14105 CB PRO M 533 -31.833 -51.714-151.385 1.00 83.58 C
+ATOM 14106 CG PRO M 533 -32.371 -50.322-151.280 1.00 70.64 C
+ATOM 14107 CD PRO M 533 -33.236 -50.125-152.469 1.00 78.83 C
+ATOM 14108 HA PRO M 533 -32.431 -53.087-152.973 1.00 0.00 H
+ATOM 14109 1HB PRO M 533 -31.665 -52.168-150.397 1.00 0.00 H
+ATOM 14110 2HB PRO M 533 -30.873 -51.747-151.921 1.00 0.00 H
+ATOM 14111 1HG PRO M 533 -32.932 -50.202-150.342 1.00 0.00 H
+ATOM 14112 2HG PRO M 533 -31.545 -49.597-151.251 1.00 0.00 H
+ATOM 14113 1HD PRO M 533 -34.043 -49.419-152.223 1.00 0.00 H
+ATOM 14114 2HD PRO M 533 -32.630 -49.746-153.305 1.00 0.00 H
+ATOM 14115 N PRO M 534 -33.340 -54.708-151.184 1.00 80.72 N
+ATOM 14116 CA PRO M 534 -34.225 -55.682-150.519 1.00 80.93 C
+ATOM 14117 C PRO M 534 -34.436 -55.427-149.036 1.00 88.31 C
+ATOM 14118 O PRO M 534 -35.510 -55.754-148.515 1.00 89.36 O
+ATOM 14119 CB PRO M 534 -33.509 -57.021-150.760 1.00 84.83 C
+ATOM 14120 CG PRO M 534 -32.589 -56.770-151.914 1.00 78.89 C
+ATOM 14121 CD PRO M 534 -32.154 -55.349-151.771 1.00 76.67 C
+ATOM 14122 HA PRO M 534 -35.210 -55.669-151.008 1.00 0.00 H
+ATOM 14123 1HB PRO M 534 -32.968 -57.327-149.852 1.00 0.00 H
+ATOM 14124 2HB PRO M 534 -34.246 -57.808-150.976 1.00 0.00 H
+ATOM 14125 1HG PRO M 534 -31.740 -57.469-151.882 1.00 0.00 H
+ATOM 14126 2HG PRO M 534 -33.113 -56.950-152.864 1.00 0.00 H
+ATOM 14127 1HD PRO M 534 -31.284 -55.297-151.099 1.00 0.00 H
+ATOM 14128 2HD PRO M 534 -31.905 -54.940-152.761 1.00 0.00 H
+ATOM 14129 N PHE M 535 -33.453 -54.850-148.338 1.00 91.79 N
+ATOM 14130 CA PHE M 535 -33.560 -54.707-146.891 1.00 82.43 C
+ATOM 14131 C PHE M 535 -34.519 -53.603-146.469 1.00 68.15 C
+ATOM 14132 O PHE M 535 -34.993 -53.622-145.329 1.00 88.02 O
+ATOM 14133 CB PHE M 535 -32.179 -54.460-146.271 1.00 80.77 C
+ATOM 14134 CG PHE M 535 -31.497 -53.209-146.756 1.00 76.04 C
+ATOM 14135 CD1 PHE M 535 -31.765 -51.982-146.167 1.00 71.20 C
+ATOM 14136 CD2 PHE M 535 -30.557 -53.266-147.774 1.00 71.46 C
+ATOM 14137 CE1 PHE M 535 -31.132 -50.833-146.601 1.00 71.05 C
+ATOM 14138 CE2 PHE M 535 -29.918 -52.119-148.211 1.00 71.23 C
+ATOM 14139 CZ PHE M 535 -30.208 -50.902-147.624 1.00 67.81 C
+ATOM 14140 H PHE M 535 -32.626 -54.507-148.806 1.00 0.00 H
+ATOM 14141 HA PHE M 535 -33.965 -55.633-146.481 1.00 0.00 H
+ATOM 14142 1HB PHE M 535 -32.274 -54.392-145.188 1.00 0.00 H
+ATOM 14143 2HB PHE M 535 -31.526 -55.304-146.490 1.00 0.00 H
+ATOM 14144 HD1 PHE M 535 -32.485 -51.929-145.350 1.00 0.00 H
+ATOM 14145 HD2 PHE M 535 -30.329 -54.227-148.237 1.00 0.00 H
+ATOM 14146 HE1 PHE M 535 -31.363 -49.875-146.135 1.00 0.00 H
+ATOM 14147 HE2 PHE M 535 -29.187 -52.174-149.018 1.00 0.00 H
+ATOM 14148 HZ PHE M 535 -29.708 -49.998-147.970 1.00 0.00 H
+ATOM 14149 N VAL M 536 -34.811 -52.642-147.348 1.00 62.54 N
+ATOM 14150 CA VAL M 536 -35.761 -51.590-147.005 1.00 68.66 C
+ATOM 14151 C VAL M 536 -37.190 -52.117-146.976 1.00 76.11 C
+ATOM 14152 O VAL M 536 -38.048 -51.536-146.299 1.00 82.08 O
+ATOM 14153 CB VAL M 536 -35.627 -50.407-147.981 1.00 69.71 C
+ATOM 14154 CG1 VAL M 536 -36.308 -49.171-147.420 1.00 80.44 C
+ATOM 14155 CG2 VAL M 536 -34.166 -50.115-148.246 1.00 64.13 C
+ATOM 14156 H VAL M 536 -34.376 -52.634-148.260 1.00 0.00 H
+ATOM 14157 HA VAL M 536 -35.539 -51.238-145.997 1.00 0.00 H
+ATOM 14158 HB VAL M 536 -36.121 -50.663-148.918 1.00 0.00 H
+ATOM 14159 1HG1 VAL M 536 -36.202 -48.346-148.125 1.00 0.00 H
+ATOM 14160 2HG1 VAL M 536 -37.366 -49.379-147.261 1.00 0.00 H
+ATOM 14161 3HG1 VAL M 536 -35.844 -48.899-146.472 1.00 0.00 H
+ATOM 14162 1HG2 VAL M 536 -34.082 -49.277-148.938 1.00 0.00 H
+ATOM 14163 2HG2 VAL M 536 -33.669 -49.863-147.309 1.00 0.00 H
+ATOM 14164 3HG2 VAL M 536 -33.692 -50.995-148.683 1.00 0.00 H
+ATOM 14165 N GLN M 537 -37.464 -53.213-147.688 1.00 77.52 N
+ATOM 14166 CA GLN M 537 -38.767 -53.879-147.663 1.00 75.10 C
+ATOM 14167 C GLN M 537 -39.884 -52.933-148.105 1.00 71.57 C
+ATOM 14168 O GLN M 537 -40.878 -52.735-147.403 1.00 73.55 O
+ATOM 14169 CB GLN M 537 -39.054 -54.464-146.278 1.00 65.04 C
+ATOM 14170 CG GLN M 537 -38.041 -55.503-145.820 1.00 73.31 C
+ATOM 14171 CD GLN M 537 -38.179 -55.839-144.346 1.00102.37 C
+ATOM 14172 OE1 GLN M 537 -38.379 -54.955-143.510 1.00106.98 O
+ATOM 14173 NE2 GLN M 537 -38.078 -57.123-144.021 1.00111.65 N
+ATOM 14174 H GLN M 537 -36.729 -53.592-148.268 1.00 0.00 H
+ATOM 14175 HA GLN M 537 -38.752 -54.695-148.386 1.00 0.00 H
+ATOM 14176 1HB GLN M 537 -39.071 -53.662-145.540 1.00 0.00 H
+ATOM 14177 2HB GLN M 537 -40.039 -54.930-146.277 1.00 0.00 H
+ATOM 14178 1HG GLN M 537 -38.189 -56.418-146.394 1.00 0.00 H
+ATOM 14179 2HG GLN M 537 -37.036 -55.115-145.989 1.00 0.00 H
+ATOM 14180 1HE2 GLN M 537 -38.161 -57.405-143.064 1.00 0.00 H
+ATOM 14181 2HE2 GLN M 537 -37.919 -57.808-144.732 1.00 0.00 H
+ATOM 14182 N CYS M 538 -39.710 -52.349-149.286 1.00 76.08 N
+ATOM 14183 CA CYS M 538 -40.680 -51.419-149.840 1.00 76.07 C
+ATOM 14184 C CYS M 538 -41.742 -52.160-150.643 1.00 83.62 C
+ATOM 14185 O CYS M 538 -41.544 -53.289-151.096 1.00 86.33 O
+ATOM 14186 CB CYS M 538 -39.999 -50.378-150.730 1.00 96.12 C
+ATOM 14187 SG CYS M 538 -38.792 -49.328-149.892 1.00132.39 S
+ATOM 14188 H CYS M 538 -38.875 -52.561-149.813 1.00 0.00 H
+ATOM 14189 HA CYS M 538 -41.170 -50.899-149.017 1.00 0.00 H
+ATOM 14190 1HB CYS M 538 -39.484 -50.880-151.549 1.00 0.00 H
+ATOM 14191 2HB CYS M 538 -40.753 -49.725-151.169 1.00 0.00 H
+ATOM 14192 N GLY M 539 -42.881 -51.497-150.813 1.00 89.35 N
+ATOM 14193 CA GLY M 539 -43.971 -52.024-151.610 1.00 84.36 C
+ATOM 14194 C GLY M 539 -44.889 -50.897-152.017 1.00 80.71 C
+ATOM 14195 O GLY M 539 -44.860 -49.809-151.433 1.00 80.73 O
+ATOM 14196 H GLY M 539 -42.987 -50.596-150.370 1.00 0.00 H
+ATOM 14197 1HA GLY M 539 -43.569 -52.527-152.490 1.00 0.00 H
+ATOM 14198 2HA GLY M 539 -44.515 -52.771-151.033 1.00 0.00 H
+ATOM 14199 N TRP M 540 -45.710 -51.161-153.029 1.00 78.37 N
+ATOM 14200 CA TRP M 540 -46.566 -50.136-153.615 1.00 73.82 C
+ATOM 14201 C TRP M 540 -47.969 -50.215-153.017 1.00 81.62 C
+ATOM 14202 O TRP M 540 -48.660 -51.228-153.170 1.00 89.13 O
+ATOM 14203 CB TRP M 540 -46.605 -50.277-155.137 1.00 78.30 C
+ATOM 14204 CG TRP M 540 -47.277 -49.127-155.822 1.00 88.77 C
+ATOM 14205 CD1 TRP M 540 -48.530 -49.111-156.362 1.00 96.43 C
+ATOM 14206 CD2 TRP M 540 -46.743 -47.811-156.009 1.00 85.79 C
+ATOM 14207 NE1 TRP M 540 -48.801 -47.872-156.889 1.00 92.65 N
+ATOM 14208 CE2 TRP M 540 -47.720 -47.055-156.682 1.00 82.91 C
+ATOM 14209 CE3 TRP M 540 -45.530 -47.201-155.677 1.00 84.75 C
+ATOM 14210 CZ2 TRP M 540 -47.523 -45.720-157.028 1.00 83.47 C
+ATOM 14211 CZ3 TRP M 540 -45.336 -45.875-156.025 1.00 82.21 C
+ATOM 14212 CH2 TRP M 540 -46.327 -45.151-156.692 1.00 69.85 C
+ATOM 14213 H TRP M 540 -45.740 -52.099-153.401 1.00 0.00 H
+ATOM 14214 HA TRP M 540 -46.154 -49.158-153.366 1.00 0.00 H
+ATOM 14215 1HB TRP M 540 -45.588 -50.360-155.521 1.00 0.00 H
+ATOM 14216 2HB TRP M 540 -47.132 -51.193-155.404 1.00 0.00 H
+ATOM 14217 HD1 TRP M 540 -49.214 -49.958-156.373 1.00 0.00 H
+ATOM 14218 HE1 TRP M 540 -49.657 -47.605-157.354 1.00 0.00 H
+ATOM 14219 HE3 TRP M 540 -44.754 -47.758-155.153 1.00 0.00 H
+ATOM 14220 HZ2 TRP M 540 -48.285 -45.137-157.546 1.00 0.00 H
+ATOM 14221 HZ3 TRP M 540 -44.386 -45.409-155.764 1.00 0.00 H
+ATOM 14222 HH2 TRP M 540 -46.139 -44.108-156.950 1.00 0.00 H
+ATOM 14223 N CYS M 541 -48.374 -49.145-152.329 1.00 81.00 N
+ATOM 14224 CA CYS M 541 -49.717 -48.987-151.769 1.00 81.98 C
+ATOM 14225 C CYS M 541 -50.484 -48.031-152.676 1.00 87.67 C
+ATOM 14226 O CYS M 541 -50.419 -46.813-152.499 1.00 87.99 O
+ATOM 14227 CB CYS M 541 -49.647 -48.456-150.338 1.00 89.28 C
+ATOM 14228 SG CYS M 541 -51.049 -48.795-149.214 1.00109.76 S
+ATOM 14229 H CYS M 541 -47.696 -48.408-152.197 1.00 0.00 H
+ATOM 14230 HA CYS M 541 -50.202 -49.963-151.753 1.00 0.00 H
+ATOM 14231 1HB CYS M 541 -48.766 -48.863-149.841 1.00 0.00 H
+ATOM 14232 2HB CYS M 541 -49.540 -47.372-150.357 1.00 0.00 H
+ATOM 14233 N HIS M 542 -51.194 -48.592-153.660 1.00 99.90 N
+ATOM 14234 CA HIS M 542 -52.035 -47.849-154.600 1.00107.83 C
+ATOM 14235 C HIS M 542 -51.306 -46.690-155.272 1.00102.14 C
+ATOM 14236 O HIS M 542 -51.014 -46.750-156.471 1.00 92.56 O
+ATOM 14237 CB HIS M 542 -53.294 -47.325-153.903 1.00123.38 C
+ATOM 14238 CG HIS M 542 -54.265 -46.661-154.833 1.00140.33 C
+ATOM 14239 ND1 HIS M 542 -54.171 -45.330-155.182 1.00150.86 N
+ATOM 14240 CD2 HIS M 542 -55.340 -47.148-155.498 1.00136.23 C
+ATOM 14241 CE1 HIS M 542 -55.150 -45.024-156.014 1.00146.81 C
+ATOM 14242 NE2 HIS M 542 -55.874 -46.109-156.223 1.00132.92 N
+ATOM 14243 H HIS M 542 -51.132 -49.597-153.743 1.00 0.00 H
+ATOM 14244 HA HIS M 542 -52.347 -48.509-155.409 1.00 0.00 H
+ATOM 14245 1HB HIS M 542 -53.806 -48.151-153.407 1.00 0.00 H
+ATOM 14246 2HB HIS M 542 -53.012 -46.606-153.134 1.00 0.00 H
+ATOM 14247 HD2 HIS M 542 -55.714 -48.171-155.462 1.00 0.00 H
+ATOM 14248 HE1 HIS M 542 -55.330 -44.043-156.454 1.00 0.00 H
+ATOM 14249 HE2 HIS M 542 -56.688 -46.171-156.818 1.00 0.00 H
+ATOM 14250 N ASP M 543 -51.023 -45.626-154.512 1.00102.31 N
+ATOM 14251 CA ASP M 543 -50.416 -44.418-155.052 1.00102.95 C
+ATOM 14252 C ASP M 543 -49.100 -44.032-154.393 1.00 97.59 C
+ATOM 14253 O ASP M 543 -48.452 -43.089-154.860 1.00 97.33 O
+ATOM 14254 CB ASP M 543 -51.386 -43.231-154.928 1.00115.15 C
+ATOM 14255 CG ASP M 543 -51.665 -42.851-153.480 1.00129.16 C
+ATOM 14256 OD1 ASP M 543 -51.714 -43.753-152.616 1.00134.77 O
+ATOM 14257 OD2 ASP M 543 -51.827 -41.644-153.204 1.00137.36 O
+ATOM 14258 H ASP M 543 -51.241 -45.669-153.527 1.00 0.00 H
+ATOM 14259 HA ASP M 543 -50.198 -44.583-156.108 1.00 0.00 H
+ATOM 14260 1HB ASP M 543 -50.970 -42.366-155.444 1.00 0.00 H
+ATOM 14261 2HB ASP M 543 -52.330 -43.480-155.414 1.00 0.00 H
+ATOM 14262 N LYS M 544 -48.691 -44.711-153.326 1.00 98.19 N
+ATOM 14263 CA LYS M 544 -47.486 -44.358-152.594 1.00 92.19 C
+ATOM 14264 C LYS M 544 -46.594 -45.583-152.454 1.00 89.61 C
+ATOM 14265 O LYS M 544 -47.029 -46.722-152.650 1.00 93.75 O
+ATOM 14266 CB LYS M 544 -47.832 -43.786-151.218 1.00 88.90 C
+ATOM 14267 CG LYS M 544 -48.629 -42.489-151.259 1.00 86.06 C
+ATOM 14268 CD LYS M 544 -48.931 -41.982-149.857 1.00 85.17 C
+ATOM 14269 CE LYS M 544 -49.685 -40.661-149.895 1.00 0.00 C
+ATOM 14270 NZ LYS M 544 -51.043 -40.812-150.484 1.00 0.00 N
+ATOM 14271 H LYS M 544 -49.241 -45.500-153.017 1.00 0.00 H
+ATOM 14272 HA LYS M 544 -46.945 -43.600-153.162 1.00 0.00 H
+ATOM 14273 1HB LYS M 544 -48.411 -44.517-150.655 1.00 0.00 H
+ATOM 14274 2HB LYS M 544 -46.913 -43.597-150.662 1.00 0.00 H
+ATOM 14275 1HG LYS M 544 -48.061 -41.729-151.797 1.00 0.00 H
+ATOM 14276 2HG LYS M 544 -49.568 -42.655-151.785 1.00 0.00 H
+ATOM 14277 1HD LYS M 544 -49.533 -42.719-149.324 1.00 0.00 H
+ATOM 14278 2HD LYS M 544 -47.997 -41.840-149.312 1.00 0.00 H
+ATOM 14279 1HE LYS M 544 -49.782 -40.268-148.884 1.00 0.00 H
+ATOM 14280 2HE LYS M 544 -49.124 -39.939-150.489 1.00 0.00 H
+ATOM 14281 1HZ LYS M 544 -51.509 -39.916-150.492 1.00 0.00 H
+ATOM 14282 2HZ LYS M 544 -50.964 -41.159-151.430 1.00 0.00 H
+ATOM 14283 3HZ LYS M 544 -51.579 -41.465-149.931 1.00 0.00 H
+ATOM 14284 N CYS M 545 -45.329 -45.334-152.122 1.00 80.01 N
+ATOM 14285 CA CYS M 545 -44.336 -46.385-151.922 1.00 68.11 C
+ATOM 14286 C CYS M 545 -43.922 -46.373-150.456 1.00 70.03 C
+ATOM 14287 O CYS M 545 -43.239 -45.448-150.005 1.00 68.44 O
+ATOM 14288 CB CYS M 545 -43.134 -46.178-152.838 1.00 70.77 C
+ATOM 14289 SG CYS M 545 -41.812 -47.399-152.636 1.00 90.86 S
+ATOM 14290 H CYS M 545 -45.054 -44.369-152.006 1.00 0.00 H
+ATOM 14291 HA CYS M 545 -44.794 -47.344-152.165 1.00 0.00 H
+ATOM 14292 1HB CYS M 545 -43.459 -46.210-153.878 1.00 0.00 H
+ATOM 14293 2HB CYS M 545 -42.706 -45.192-152.659 1.00 0.00 H
+ATOM 14294 N VAL M 546 -44.351 -47.387-149.710 1.00 72.52 N
+ATOM 14295 CA VAL M 546 -44.100 -47.499-148.282 1.00 68.52 C
+ATOM 14296 C VAL M 546 -43.821 -48.963-147.960 1.00 78.19 C
+ATOM 14297 O VAL M 546 -43.786 -49.819-148.847 1.00 83.13 O
+ATOM 14298 CB VAL M 546 -45.282 -46.980-147.438 1.00 59.72 C
+ATOM 14299 CG1 VAL M 546 -45.544 -45.508-147.721 1.00 65.25 C
+ATOM 14300 CG2 VAL M 546 -46.523 -47.815-147.699 1.00 58.22 C
+ATOM 14301 H VAL M 546 -44.879 -48.112-150.175 1.00 0.00 H
+ATOM 14302 HA VAL M 546 -43.225 -46.896-148.036 1.00 0.00 H
+ATOM 14303 HB VAL M 546 -45.019 -47.046-146.382 1.00 0.00 H
+ATOM 14304 1HG1 VAL M 546 -46.382 -45.164-147.114 1.00 0.00 H
+ATOM 14305 2HG1 VAL M 546 -44.656 -44.927-147.475 1.00 0.00 H
+ATOM 14306 3HG1 VAL M 546 -45.784 -45.377-148.776 1.00 0.00 H
+ATOM 14307 1HG2 VAL M 546 -47.349 -47.438-147.096 1.00 0.00 H
+ATOM 14308 2HG2 VAL M 546 -46.787 -47.754-148.755 1.00 0.00 H
+ATOM 14309 3HG2 VAL M 546 -46.325 -48.854-147.433 1.00 0.00 H
+ATOM 14310 N ARG M 547 -43.627 -49.252-146.679 1.00 71.54 N
+ATOM 14311 CA ARG M 547 -43.486 -50.627-146.227 1.00 70.92 C
+ATOM 14312 C ARG M 547 -44.814 -51.132-145.676 1.00 74.87 C
+ATOM 14313 O ARG M 547 -45.722 -50.354-145.372 1.00 69.99 O
+ATOM 14314 CB ARG M 547 -42.394 -50.753-145.166 1.00 70.48 C
+ATOM 14315 CG ARG M 547 -42.625 -49.906-143.945 1.00 92.06 C
+ATOM 14316 CD ARG M 547 -41.563 -50.188-142.904 1.00106.39 C
+ATOM 14317 NE ARG M 547 -41.815 -49.456-141.672 1.00117.13 N
+ATOM 14318 CZ ARG M 547 -41.092 -49.592-140.568 1.00135.78 C
+ATOM 14319 NH1 ARG M 547 -40.075 -50.444-140.544 1.00142.91 N
+ATOM 14320 NH2 ARG M 547 -41.393 -48.885-139.489 1.00143.03 N
+ATOM 14321 H ARG M 547 -43.576 -48.504-146.002 1.00 0.00 H
+ATOM 14322 HA ARG M 547 -43.206 -51.245-147.081 1.00 0.00 H
+ATOM 14323 1HB ARG M 547 -42.316 -51.791-144.847 1.00 0.00 H
+ATOM 14324 2HB ARG M 547 -41.434 -50.470-145.597 1.00 0.00 H
+ATOM 14325 1HG ARG M 547 -42.583 -48.852-144.220 1.00 0.00 H
+ATOM 14326 2HG ARG M 547 -43.605 -50.133-143.525 1.00 0.00 H
+ATOM 14327 1HD ARG M 547 -41.552 -51.253-142.675 1.00 0.00 H
+ATOM 14328 2HD ARG M 547 -40.588 -49.889-143.289 1.00 0.00 H
+ATOM 14329 HE ARG M 547 -42.589 -48.805-141.662 1.00 0.00 H
+ATOM 14330 1HH1 ARG M 547 -39.852 -50.988-141.366 1.00 0.00 H
+ATOM 14331 2HH1 ARG M 547 -39.524 -50.549-139.705 1.00 0.00 H
+ATOM 14332 1HH2 ARG M 547 -42.173 -48.242-139.507 1.00 0.00 H
+ATOM 14333 2HH2 ARG M 547 -40.844 -48.988-138.649 1.00 0.00 H
+ATOM 14334 N SER M 548 -44.909 -52.459-145.541 1.00 81.56 N
+ATOM 14335 CA SER M 548 -46.184 -53.089-145.201 1.00 83.31 C
+ATOM 14336 C SER M 548 -46.765 -52.546-143.903 1.00 83.79 C
+ATOM 14337 O SER M 548 -47.985 -52.584-143.707 1.00 86.84 O
+ATOM 14338 CB SER M 548 -46.013 -54.608-145.115 1.00 90.30 C
+ATOM 14339 OG SER M 548 -44.989 -54.960-144.202 1.00104.49 O
+ATOM 14340 H SER M 548 -44.093 -53.040-145.674 1.00 0.00 H
+ATOM 14341 HA SER M 548 -46.904 -52.859-145.988 1.00 0.00 H
+ATOM 14342 1HB SER M 548 -46.952 -55.063-144.801 1.00 0.00 H
+ATOM 14343 2HB SER M 548 -45.772 -55.003-146.101 1.00 0.00 H
+ATOM 14344 HG SER M 548 -44.648 -54.132-143.855 1.00 0.00 H
+ATOM 14345 N GLU M 549 -45.919 -52.030-143.010 1.00 91.92 N
+ATOM 14346 CA GLU M 549 -46.421 -51.452-141.768 1.00 95.96 C
+ATOM 14347 C GLU M 549 -47.190 -50.158-142.017 1.00 92.21 C
+ATOM 14348 O GLU M 549 -48.121 -49.840-141.268 1.00 88.37 O
+ATOM 14349 CB GLU M 549 -45.264 -51.188-140.802 1.00 83.64 C
+ATOM 14350 CG GLU M 549 -44.593 -52.445-140.266 1.00 74.06 C
+ATOM 14351 CD GLU M 549 -45.527 -53.311-139.468 1.00 0.00 C
+ATOM 14352 OE1 GLU M 549 -46.172 -52.801-138.584 1.00 0.00 O
+ATOM 14353 OE2 GLU M 549 -45.596 -54.486-139.743 1.00 0.00 O
+ATOM 14354 H GLU M 549 -44.924 -52.034-143.184 1.00 0.00 H
+ATOM 14355 HA GLU M 549 -47.113 -52.160-141.312 1.00 0.00 H
+ATOM 14356 1HB GLU M 549 -44.502 -50.589-141.302 1.00 0.00 H
+ATOM 14357 2HB GLU M 549 -45.626 -50.612-139.950 1.00 0.00 H
+ATOM 14358 1HG GLU M 549 -44.206 -53.023-141.104 1.00 0.00 H
+ATOM 14359 2HG GLU M 549 -43.750 -52.155-139.640 1.00 0.00 H
+ATOM 14360 N GLU M 550 -46.826 -49.410-143.057 1.00 88.25 N
+ATOM 14361 CA GLU M 550 -47.418 -48.107-143.330 1.00 84.45 C
+ATOM 14362 C GLU M 550 -48.548 -48.156-144.354 1.00 88.07 C
+ATOM 14363 O GLU M 550 -49.145 -47.117-144.644 1.00 86.80 O
+ATOM 14364 CB GLU M 550 -46.337 -47.131-143.802 1.00 78.79 C
+ATOM 14365 CG GLU M 550 -45.207 -46.943-142.806 1.00 98.73 C
+ATOM 14366 CD GLU M 550 -44.145 -45.979-143.300 1.00128.23 C
+ATOM 14367 OE1 GLU M 550 -44.446 -45.171-144.204 1.00138.98 O
+ATOM 14368 OE2 GLU M 550 -43.006 -46.036-142.789 1.00136.25 O
+ATOM 14369 H GLU M 550 -46.112 -49.765-143.676 1.00 0.00 H
+ATOM 14370 HA GLU M 550 -47.859 -47.727-142.408 1.00 0.00 H
+ATOM 14371 1HB GLU M 550 -45.909 -47.487-144.739 1.00 0.00 H
+ATOM 14372 2HB GLU M 550 -46.786 -46.157-143.996 1.00 0.00 H
+ATOM 14373 1HG GLU M 550 -45.620 -46.565-141.871 1.00 0.00 H
+ATOM 14374 2HG GLU M 550 -44.750 -47.911-142.605 1.00 0.00 H
+ATOM 14375 N CYS M 551 -48.859 -49.324-144.908 1.00 88.79 N
+ATOM 14376 CA CYS M 551 -49.970 -49.472-145.850 1.00 95.22 C
+ATOM 14377 C CYS M 551 -51.177 -49.931-145.040 1.00 95.59 C
+ATOM 14378 O CYS M 551 -51.321 -51.117-144.728 1.00 95.75 O
+ATOM 14379 CB CYS M 551 -49.601 -50.443-146.970 1.00105.95 C
+ATOM 14380 SG CYS M 551 -50.756 -50.634-148.383 1.00130.59 S
+ATOM 14381 H CYS M 551 -48.307 -50.135-144.667 1.00 0.00 H
+ATOM 14382 HA CYS M 551 -50.182 -48.498-146.291 1.00 0.00 H
+ATOM 14383 1HB CYS M 551 -48.648 -50.147-147.409 1.00 0.00 H
+ATOM 14384 2HB CYS M 551 -49.475 -51.444-146.557 1.00 0.00 H
+ATOM 14385 N LEU M 552 -52.041 -48.979-144.681 1.00 91.71 N
+ATOM 14386 CA LEU M 552 -53.115 -49.254-143.731 1.00 94.21 C
+ATOM 14387 C LEU M 552 -54.275 -49.996-144.386 1.00103.85 C
+ATOM 14388 O LEU M 552 -54.688 -51.060-143.915 1.00112.15 O
+ATOM 14389 CB LEU M 552 -53.599 -47.949-143.096 1.00 96.24 C
+ATOM 14390 CG LEU M 552 -52.509 -47.046-142.517 1.00 93.56 C
+ATOM 14391 CD1 LEU M 552 -53.121 -45.845-141.817 1.00 96.98 C
+ATOM 14392 CD2 LEU M 552 -51.621 -47.830-141.567 1.00 86.61 C
+ATOM 14393 H LEU M 552 -51.954 -48.051-145.070 1.00 0.00 H
+ATOM 14394 HA LEU M 552 -52.726 -49.904-142.948 1.00 0.00 H
+ATOM 14395 1HB LEU M 552 -54.138 -47.375-143.849 1.00 0.00 H
+ATOM 14396 2HB LEU M 552 -54.291 -48.191-142.289 1.00 0.00 H
+ATOM 14397 HG LEU M 552 -51.897 -46.648-143.327 1.00 0.00 H
+ATOM 14398 1HD1 LEU M 552 -52.328 -45.216-141.413 1.00 0.00 H
+ATOM 14399 2HD1 LEU M 552 -53.711 -45.270-142.531 1.00 0.00 H
+ATOM 14400 3HD1 LEU M 552 -53.763 -46.185-141.005 1.00 0.00 H
+ATOM 14401 1HD2 LEU M 552 -50.850 -47.173-141.164 1.00 0.00 H
+ATOM 14402 2HD2 LEU M 552 -52.223 -48.227-140.749 1.00 0.00 H
+ATOM 14403 3HD2 LEU M 552 -51.151 -48.654-142.104 1.00 0.00 H
+ATOM 14404 N SER M 553 -54.828 -49.437-145.459 1.00102.65 N
+ATOM 14405 CA SER M 553 -55.883 -50.091-146.216 1.00 99.97 C
+ATOM 14406 C SER M 553 -55.477 -50.161-147.681 1.00 87.87 C
+ATOM 14407 O SER M 553 -54.556 -49.471-148.126 1.00 75.36 O
+ATOM 14408 CB SER M 553 -57.226 -49.361-146.074 1.00105.14 C
+ATOM 14409 OG SER M 553 -57.214 -48.128-146.770 1.00110.24 O
+ATOM 14410 H SER M 553 -54.501 -48.528-145.754 1.00 0.00 H
+ATOM 14411 HA SER M 553 -56.008 -51.104-145.831 1.00 0.00 H
+ATOM 14412 1HB SER M 553 -58.026 -49.991-146.462 1.00 0.00 H
+ATOM 14413 2HB SER M 553 -57.433 -49.183-145.020 1.00 0.00 H
+ATOM 14414 HG SER M 553 -56.343 -48.057-147.167 1.00 0.00 H
+ATOM 14415 N GLY M 554 -56.174 -51.011-148.427 1.00 92.11 N
+ATOM 14416 CA GLY M 554 -55.885 -51.168-149.839 1.00104.42 C
+ATOM 14417 C GLY M 554 -54.992 -52.354-150.140 1.00 97.09 C
+ATOM 14418 O GLY M 554 -55.015 -53.354-149.417 1.00 95.29 O
+ATOM 14419 H GLY M 554 -56.915 -51.558-148.013 1.00 0.00 H
+ATOM 14420 1HA GLY M 554 -56.818 -51.286-150.390 1.00 0.00 H
+ATOM 14421 2HA GLY M 554 -55.403 -50.266-150.214 1.00 0.00 H
+ATOM 14422 N THR M 555 -54.196 -52.254-151.201 1.00 87.82 N
+ATOM 14423 CA THR M 555 -53.342 -53.344-151.648 1.00 84.52 C
+ATOM 14424 C THR M 555 -51.880 -52.940-151.546 1.00 78.35 C
+ATOM 14425 O THR M 555 -51.518 -51.799-151.850 1.00 82.17 O
+ATOM 14426 CB THR M 555 -53.663 -53.749-153.090 1.00 97.53 C
+ATOM 14427 OG1 THR M 555 -53.419 -52.641-153.965 1.00103.06 O
+ATOM 14428 CG2 THR M 555 -55.116 -54.165-153.205 1.00104.70 C
+ATOM 14429 H THR M 555 -54.190 -51.383-151.712 1.00 0.00 H
+ATOM 14430 HA THR M 555 -53.517 -54.207-151.005 1.00 0.00 H
+ATOM 14431 HB THR M 555 -53.025 -54.582-153.385 1.00 0.00 H
+ATOM 14432 HG1 THR M 555 -53.108 -51.891-153.452 1.00 0.00 H
+ATOM 14433 1HG2 THR M 555 -55.332 -54.451-154.234 1.00 0.00 H
+ATOM 14434 2HG2 THR M 555 -55.305 -55.012-152.545 1.00 0.00 H
+ATOM 14435 3HG2 THR M 555 -55.757 -53.332-152.918 1.00 0.00 H
+ATOM 14436 N TRP M 556 -51.047 -53.886-151.118 1.00 69.68 N
+ATOM 14437 CA TRP M 556 -49.608 -53.687-150.997 1.00 65.54 C
+ATOM 14438 C TRP M 556 -48.926 -54.799-151.775 1.00 73.39 C
+ATOM 14439 O TRP M 556 -49.111 -55.980-151.463 1.00 74.69 O
+ATOM 14440 CB TRP M 556 -49.173 -53.699-149.528 1.00 67.97 C
+ATOM 14441 CG TRP M 556 -47.749 -53.281-149.280 1.00 66.58 C
+ATOM 14442 CD1 TRP M 556 -47.260 -52.005-149.251 1.00 69.71 C
+ATOM 14443 CD2 TRP M 556 -46.637 -54.140-149.001 1.00 67.78 C
+ATOM 14444 NE1 TRP M 556 -45.913 -52.018-148.981 1.00 66.77 N
+ATOM 14445 CE2 TRP M 556 -45.506 -53.317-148.823 1.00 66.33 C
+ATOM 14446 CE3 TRP M 556 -46.486 -55.525-148.889 1.00 77.59 C
+ATOM 14447 CZ2 TRP M 556 -44.245 -53.834-148.541 1.00 66.64 C
+ATOM 14448 CZ3 TRP M 556 -45.234 -56.035-148.610 1.00 81.23 C
+ATOM 14449 CH2 TRP M 556 -44.130 -55.193-148.440 1.00 77.27 C
+ATOM 14450 H TRP M 556 -51.443 -54.781-150.868 1.00 0.00 H
+ATOM 14451 HA TRP M 556 -49.356 -52.715-151.422 1.00 0.00 H
+ATOM 14452 1HB TRP M 556 -49.815 -53.032-148.953 1.00 0.00 H
+ATOM 14453 2HB TRP M 556 -49.295 -54.702-149.121 1.00 0.00 H
+ATOM 14454 HD1 TRP M 556 -47.852 -51.107-149.418 1.00 0.00 H
+ATOM 14455 HE1 TRP M 556 -45.319 -51.204-148.911 1.00 0.00 H
+ATOM 14456 HE3 TRP M 556 -47.341 -56.188-149.017 1.00 0.00 H
+ATOM 14457 HZ2 TRP M 556 -43.374 -53.193-148.402 1.00 0.00 H
+ATOM 14458 HZ3 TRP M 556 -45.128 -57.117-148.526 1.00 0.00 H
+ATOM 14459 HH2 TRP M 556 -43.156 -55.633-148.223 1.00 0.00 H
+ATOM 14460 N THR M 557 -48.154 -54.429-152.789 1.00 80.82 N
+ATOM 14461 CA THR M 557 -47.527 -55.394-153.677 1.00 89.48 C
+ATOM 14462 C THR M 557 -46.013 -55.269-153.613 1.00 85.64 C
+ATOM 14463 O THR M 557 -45.471 -54.166-153.482 1.00 84.22 O
+ATOM 14464 CB THR M 557 -48.001 -55.208-155.122 1.00100.50 C
+ATOM 14465 OG1 THR M 557 -47.276 -56.099-155.979 1.00108.43 O
+ATOM 14466 CG2 THR M 557 -47.786 -53.773-155.578 1.00 98.15 C
+ATOM 14467 H THR M 557 -47.999 -53.443-152.946 1.00 0.00 H
+ATOM 14468 HA THR M 557 -47.807 -56.396-153.352 1.00 0.00 H
+ATOM 14469 HB THR M 557 -49.062 -55.448-155.191 1.00 0.00 H
+ATOM 14470 HG1 THR M 557 -46.656 -56.612-155.455 1.00 0.00 H
+ATOM 14471 1HG2 THR M 557 -48.130 -53.663-156.606 1.00 0.00 H
+ATOM 14472 2HG2 THR M 557 -48.348 -53.098-154.933 1.00 0.00 H
+ATOM 14473 3HG2 THR M 557 -46.726 -53.529-155.522 1.00 0.00 H
+ATOM 14474 N GLN M 558 -45.338 -56.411-153.705 1.00 88.94 N
+ATOM 14475 CA GLN M 558 -43.885 -56.444-153.728 1.00 92.83 C
+ATOM 14476 C GLN M 558 -43.343 -57.392-154.792 1.00 90.28 C
+ATOM 14477 O GLN M 558 -42.124 -57.565-154.877 1.00 85.18 O
+ATOM 14478 CB GLN M 558 -43.347 -56.846-152.341 1.00 99.12 C
+ATOM 14479 CG GLN M 558 -41.938 -56.362-152.019 1.00101.70 C
+ATOM 14480 CD GLN M 558 -41.468 -56.821-150.647 1.00101.15 C
+ATOM 14481 OE1 GLN M 558 -42.185 -57.531-149.941 1.00 97.12 O
+ATOM 14482 NE2 GLN M 558 -40.263 -56.410-150.261 1.00 96.61 N
+ATOM 14483 H GLN M 558 -45.851 -57.279-153.760 1.00 0.00 H
+ATOM 14484 HA GLN M 558 -43.520 -55.447-153.973 1.00 0.00 H
+ATOM 14485 1HB GLN M 558 -44.008 -56.456-151.567 1.00 0.00 H
+ATOM 14486 2HB GLN M 558 -43.345 -57.932-152.253 1.00 0.00 H
+ATOM 14487 1HG GLN M 558 -41.250 -56.756-152.767 1.00 0.00 H
+ATOM 14488 2HG GLN M 558 -41.926 -55.272-152.038 1.00 0.00 H
+ATOM 14489 1HE2 GLN M 558 -39.904 -56.682-149.367 1.00 0.00 H
+ATOM 14490 2HE2 GLN M 558 -39.716 -55.829-150.863 1.00 0.00 H
+ATOM 14491 N GLN M 559 -44.203 -57.993-155.616 1.00 94.70 N
+ATOM 14492 CA GLN M 559 -43.804 -59.024-156.566 1.00102.97 C
+ATOM 14493 C GLN M 559 -43.884 -58.553-158.014 1.00100.40 C
+ATOM 14494 O GLN M 559 -42.860 -58.497-158.700 1.00104.82 O
+ATOM 14495 CB GLN M 559 -44.673 -60.271-156.383 1.00109.15 C
+ATOM 14496 CG GLN M 559 -44.456 -60.993-155.064 1.00105.48 C
+ATOM 14497 CD GLN M 559 -45.375 -62.188-154.900 1.00 90.01 C
+ATOM 14498 OE1 GLN M 559 -46.483 -62.216-155.443 1.00 0.00 O
+ATOM 14499 NE2 GLN M 559 -44.920 -63.185-154.149 1.00 0.00 N
+ATOM 14500 H GLN M 559 -45.173 -57.714-155.572 1.00 0.00 H
+ATOM 14501 HA GLN M 559 -42.760 -59.279-156.382 1.00 0.00 H
+ATOM 14502 1HB GLN M 559 -45.726 -59.993-156.444 1.00 0.00 H
+ATOM 14503 2HB GLN M 559 -44.473 -60.976-157.189 1.00 0.00 H
+ATOM 14504 1HG GLN M 559 -43.425 -61.345-155.020 1.00 0.00 H
+ATOM 14505 2HG GLN M 559 -44.648 -60.299-154.245 1.00 0.00 H
+ATOM 14506 1HE2 GLN M 559 -45.483 -64.000-154.004 1.00 0.00 H
+ATOM 14507 2HE2 GLN M 559 -44.016 -63.121-153.727 1.00 0.00 H
+ATOM 14508 N ILE M 560 -45.079 -58.223-158.506 1.00 97.91 N
+ATOM 14509 CA ILE M 560 -45.279 -57.831-159.898 1.00 99.30 C
+ATOM 14510 C ILE M 560 -45.639 -56.354-159.967 1.00 93.51 C
+ATOM 14511 O ILE M 560 -46.199 -55.782-159.027 1.00 78.25 O
+ATOM 14512 CB ILE M 560 -46.385 -58.670-160.564 1.00 97.54 C
+ATOM 14513 CG1 ILE M 560 -47.718 -58.469-159.839 1.00 93.20 C
+ATOM 14514 CG2 ILE M 560 -46.000 -60.141-160.579 1.00 81.32 C
+ATOM 14515 CD1 ILE M 560 -48.901 -59.081-160.555 1.00 0.00 C
+ATOM 14516 H ILE M 560 -45.873 -58.248-157.883 1.00 0.00 H
+ATOM 14517 HA ILE M 560 -44.347 -57.989-160.439 1.00 0.00 H
+ATOM 14518 HB ILE M 560 -46.530 -58.332-161.590 1.00 0.00 H
+ATOM 14519 1HG1 ILE M 560 -47.659 -58.905-158.842 1.00 0.00 H
+ATOM 14520 2HG1 ILE M 560 -47.909 -57.403-159.717 1.00 0.00 H
+ATOM 14521 1HG2 ILE M 560 -46.792 -60.720-161.053 1.00 0.00 H
+ATOM 14522 2HG2 ILE M 560 -45.074 -60.269-161.138 1.00 0.00 H
+ATOM 14523 3HG2 ILE M 560 -45.857 -60.491-159.556 1.00 0.00 H
+ATOM 14524 1HD1 ILE M 560 -49.809 -58.896-159.980 1.00 0.00 H
+ATOM 14525 2HD1 ILE M 560 -49.000 -58.632-161.544 1.00 0.00 H
+ATOM 14526 3HD1 ILE M 560 -48.748 -60.154-160.657 1.00 0.00 H
+ATOM 14527 N CYS M 561 -45.319 -55.737-161.101 1.00114.21 N
+ATOM 14528 CA CYS M 561 -45.825 -54.413-161.423 1.00133.31 C
+ATOM 14529 C CYS M 561 -46.210 -54.388-162.896 1.00136.75 C
+ATOM 14530 O CYS M 561 -45.507 -54.954-163.741 1.00144.02 O
+ATOM 14531 CB CYS M 561 -44.805 -53.305-161.119 1.00154.90 C
+ATOM 14532 SG CYS M 561 -45.632 -51.704-160.983 1.00181.50 S
+ATOM 14533 H CYS M 561 -44.707 -56.203-161.756 1.00 0.00 H
+ATOM 14534 HA CYS M 561 -46.710 -54.224-160.816 1.00 0.00 H
+ATOM 14535 1HB CYS M 561 -44.285 -53.534-160.189 1.00 0.00 H
+ATOM 14536 2HB CYS M 561 -44.058 -53.271-161.912 1.00 0.00 H
+ATOM 14537 N LEU M 562 -47.340 -53.742-163.198 1.00126.64 N
+ATOM 14538 CA LEU M 562 -47.934 -53.744-164.536 1.00108.50 C
+ATOM 14539 C LEU M 562 -47.972 -52.317-165.069 1.00114.66 C
+ATOM 14540 O LEU M 562 -48.941 -51.580-164.826 1.00113.39 O
+ATOM 14541 CB LEU M 562 -49.334 -54.354-164.508 1.00 91.90 C
+ATOM 14542 CG LEU M 562 -49.475 -55.872-164.664 1.00 92.42 C
+ATOM 14543 CD1 LEU M 562 -48.634 -56.634-163.654 1.00 97.10 C
+ATOM 14544 CD2 LEU M 562 -50.933 -56.282-164.546 1.00 89.53 C
+ATOM 14545 H LEU M 562 -47.798 -53.230-162.457 1.00 0.00 H
+ATOM 14546 HA LEU M 562 -47.307 -54.348-165.191 1.00 0.00 H
+ATOM 14547 1HB LEU M 562 -49.804 -54.101-163.559 1.00 0.00 H
+ATOM 14548 2HB LEU M 562 -49.923 -53.910-165.311 1.00 0.00 H
+ATOM 14549 HG LEU M 562 -49.099 -56.174-165.642 1.00 0.00 H
+ATOM 14550 1HD1 LEU M 562 -48.767 -57.705-163.804 1.00 0.00 H
+ATOM 14551 2HD1 LEU M 562 -47.583 -56.377-163.788 1.00 0.00 H
+ATOM 14552 3HD1 LEU M 562 -48.947 -56.368-162.645 1.00 0.00 H
+ATOM 14553 1HD2 LEU M 562 -51.017 -57.363-164.660 1.00 0.00 H
+ATOM 14554 2HD2 LEU M 562 -51.315 -55.989-163.568 1.00 0.00 H
+ATOM 14555 3HD2 LEU M 562 -51.514 -55.789-165.325 1.00 0.00 H
+ATOM 14556 N PRO M 563 -46.942 -51.884-165.800 1.00117.18 N
+ATOM 14557 CA PRO M 563 -46.939 -50.514-166.334 1.00121.67 C
+ATOM 14558 C PRO M 563 -47.941 -50.323-167.463 1.00126.42 C
+ATOM 14559 O PRO M 563 -48.631 -51.268-167.861 1.00123.96 O
+ATOM 14560 CB PRO M 563 -45.497 -50.333-166.829 1.00124.69 C
+ATOM 14561 CG PRO M 563 -44.708 -51.426-166.155 1.00118.68 C
+ATOM 14562 CD PRO M 563 -45.662 -52.567-166.035 1.00114.57 C
+ATOM 14563 HA PRO M 563 -47.166 -49.808-165.521 1.00 0.00 H
+ATOM 14564 1HB PRO M 563 -45.463 -50.409-167.926 1.00 0.00 H
+ATOM 14565 2HB PRO M 563 -45.132 -49.330-166.565 1.00 0.00 H
+ATOM 14566 1HG PRO M 563 -43.822 -51.681-166.756 1.00 0.00 H
+ATOM 14567 2HG PRO M 563 -44.340 -51.081-165.177 1.00 0.00 H
+ATOM 14568 1HD PRO M 563 -45.667 -53.141-166.973 1.00 0.00 H
+ATOM 14569 2HD PRO M 563 -45.366 -53.206-165.190 1.00 0.00 H
+ATOM 14570 N ALA M 564 -48.024 -49.102-167.988 1.00131.87 N
+ATOM 14571 CA ALA M 564 -48.956 -48.758-169.050 1.00145.71 C
+ATOM 14572 C ALA M 564 -48.197 -48.350-170.306 1.00158.46 C
+ATOM 14573 O ALA M 564 -47.098 -47.791-170.234 1.00156.23 O
+ATOM 14574 CB ALA M 564 -49.895 -47.624-168.619 1.00145.11 C
+ATOM 14575 H ALA M 564 -47.407 -48.389-167.625 1.00 0.00 H
+ATOM 14576 HA ALA M 564 -49.558 -49.640-169.271 1.00 0.00 H
+ATOM 14577 1HB ALA M 564 -50.580 -47.389-169.434 1.00 0.00 H
+ATOM 14578 2HB ALA M 564 -50.465 -47.937-167.744 1.00 0.00 H
+ATOM 14579 3HB ALA M 564 -49.309 -46.740-168.373 1.00 0.00 H
+ATOM 14580 N HIS M 565 -48.797 -48.632-171.460 1.00165.85 N
+ATOM 14581 CA HIS M 565 -48.186 -48.308-172.746 1.00177.34 C
+ATOM 14582 C HIS M 565 -49.144 -47.517-173.632 1.00182.30 C
+ATOM 14583 O HIS M 565 -50.217 -47.106-173.191 1.00181.63 O
+ATOM 14584 OXT HIS M 565 -48.855 -47.289-174.774 1.00 0.00 O
+ATOM 14585 CB HIS M 565 -47.746 -49.584-173.472 1.00180.72 C
+ATOM 14586 CG HIS M 565 -46.718 -50.376-172.726 1.00 0.00 C
+ATOM 14587 ND1 HIS M 565 -45.394 -49.998-172.658 1.00 0.00 N
+ATOM 14588 CD2 HIS M 565 -46.819 -51.525-172.018 1.00 0.00 C
+ATOM 14589 CE1 HIS M 565 -44.724 -50.882-171.938 1.00 0.00 C
+ATOM 14590 NE2 HIS M 565 -45.566 -51.818-171.539 1.00 0.00 N
+ATOM 14591 H HIS M 565 -49.701 -49.083-171.444 1.00 0.00 H
+ATOM 14592 HA HIS M 565 -47.306 -47.686-172.584 1.00 0.00 H
+ATOM 14593 1HB HIS M 565 -48.613 -50.223-173.642 1.00 0.00 H
+ATOM 14594 2HB HIS M 565 -47.336 -49.324-174.447 1.00 0.00 H
+ATOM 14595 HD1 HIS M 565 -45.001 -49.151-173.016 1.00 0.00 H
+ATOM 14596 HD2 HIS M 565 -47.657 -52.186-171.794 1.00 0.00 H
+ATOM 14597 HE1 HIS M 565 -43.655 -50.761-171.764 1.00 0.00 H
+TER
+HETATM14599 C1 NAG M 606 -51.453 -34.072-109.096 1.00157.41 C
+HETATM14600 C2 NAG M 606 -52.825 -34.294-109.679 1.00173.49 C
+HETATM14601 C3 NAG M 606 -53.289 -32.997-110.327 1.00180.46 C
+HETATM14602 C4 NAG M 606 -53.228 -31.838-109.335 1.00181.40 C
+HETATM14603 C5 NAG M 606 -51.889 -31.781-108.589 1.00174.49 C
+HETATM14604 C6 NAG M 606 -51.912 -30.846-107.403 1.00169.64 C
+HETATM14605 C7 NAG M 606 -53.854 -36.243-110.770 1.00167.48 C
+HETATM14606 C8 NAG M 606 -55.009 -36.026-109.843 1.00166.18 C
+HETATM14607 N2 NAG M 606 -52.834 -35.382-110.646 1.00174.55 N
+HETATM14608 O1 NAG M 606 -51.020 -35.261-108.432 1.00 0.00 O
+HETATM14609 O3 NAG M 606 -54.614 -33.135-110.819 1.00178.44 O
+HETATM14610 O4 NAG M 606 -53.436 -30.606-110.021 1.00183.12 O
+HETATM14611 O5 NAG M 606 -51.532 -33.073-108.075 1.00167.86 O
+HETATM14612 O6 NAG M 606 -51.412 -29.563-107.750 1.00167.41 O
+HETATM14613 O7 NAG M 606 -53.846 -37.155-111.598 1.00160.73 O
+HETATM14614 H1 NAG M 606 -50.754 -33.826-109.895 1.00 0.00 H
+HETATM14615 H2 NAG M 606 -53.525 -34.538-108.880 1.00 0.00 H
+HETATM14616 H3 NAG M 606 -52.625 -32.745-111.154 1.00 0.00 H
+HETATM14617 H4 NAG M 606 -54.000 -31.966-108.577 1.00 0.00 H
+HETATM14618 H5 NAG M 606 -51.106 -31.449-109.271 1.00 0.00 H
+HETATM14619 H61 NAG M 606 -52.938 -30.735-107.048 1.00 0.00 H
+HETATM14620 H62 NAG M 606 -51.294 -31.257-106.605 1.00 0.00 H
+HETATM14621 H81 NAG M 606 -55.429 -35.034-110.011 1.00 0.00 H
+HETATM14622 H82 NAG M 606 -55.774 -36.780-110.033 1.00 0.00 H
+HETATM14623 H83 NAG M 606 -54.668 -36.106-108.811 1.00 0.00 H
+HETATM14624 HN2 NAG M 606 -52.077 -35.510-111.240 1.00 0.00 H
+HETATM14625 HO1 NAG M 606 -51.659 -35.986-108.466 1.00 0.00 H
+HETATM14626 HO3 NAG M 606 -55.001 -34.009-110.668 1.00 0.00 H
+HETATM14627 HO4 NAG M 606 -53.577 -30.706-110.973 1.00 0.00 H
+HETATM14628 HO6 NAG M 606 -51.138 -29.484-108.675 1.00 0.00 H
+TER
+HETATM14630 C FMT M 612 -31.194 -41.163-153.036 1.00 88.87 C
+HETATM14631 O1 FMT M 612 -31.624 -42.289-152.788 1.00 81.33 O
+HETATM14632 O2 FMT M 612 -31.825 -40.124-152.843 1.00 91.22 O
+HETATM14633 H FMT M 612 -30.201 -41.043-153.445 1.00 0.00 H
+HETATM14634 HO2 FMT M 612 -31.386 -39.294-153.075 1.00 0.00 H
+HETATM14635 O HOH M 701 -23.691 -54.226-141.796 1.00 99.00 O
+HETATM14636 H1 HOH M 701 -23.541 -53.885-140.914 1.00 0.00 H
+HETATM14637 H2 HOH M 701 -23.707 -55.177-141.686 1.00 0.00 H
+HETATM14638 O HOH M 702 -25.145 -33.732-121.433 1.00 78.54 O
+HETATM14639 H1 HOH M 702 -24.957 -33.476-120.530 1.00 0.00 H
+HETATM14640 H2 HOH M 702 -24.872 -34.648-121.484 1.00 0.00 H
+HETATM14641 O HOH M 703 -22.944 -30.260-125.399 1.00 98.01 O
+HETATM14642 H1 HOH M 703 -22.771 -30.033-124.485 1.00 0.00 H
+HETATM14643 H2 HOH M 703 -23.218 -31.177-125.370 1.00 0.00 H
+HETATM14644 O HOH M 704 -30.425 -22.271-120.963 1.00 80.45 O
+HETATM14645 H1 HOH M 704 -30.192 -22.101-120.050 1.00 0.00 H
+HETATM14646 H2 HOH M 704 -29.912 -21.636-121.464 1.00 0.00 H
+HETATM14647 O HOH M 705 -5.577 -26.151 -97.147 1.00 77.41 O
+HETATM14648 H1 HOH M 705 -5.519 -25.902 -96.225 1.00 0.00 H
+HETATM14649 H2 HOH M 705 -5.413 -25.339 -97.626 1.00 0.00 H
+HETATM14650 O HOH M 706 -15.287 -40.680-146.798 1.00 64.77 O
+HETATM14651 H1 HOH M 706 -15.189 -40.425-145.881 1.00 0.00 H
+HETATM14652 H2 HOH M 706 -16.153 -41.086-146.843 1.00 0.00 H
+HETATM14653 O HOH M 707 -26.865 -40.240-128.072 1.00 57.14 O
+HETATM14654 H1 HOH M 707 -26.677 -39.959-127.177 1.00 0.00 H
+HETATM14655 H2 HOH M 707 -26.129 -39.910-128.587 1.00 0.00 H
+HETATM14656 O HOH M 708 -23.381 -34.034-123.644 1.00 75.08 O
+HETATM14657 H1 HOH M 708 -23.210 -33.781-122.737 1.00 0.00 H
+HETATM14658 H2 HOH M 708 -22.891 -34.847-123.763 1.00 0.00 H
+HETATM14659 O HOH M 709 -34.901 -39.959-149.876 1.00 77.78 O
+HETATM14660 H1 HOH M 709 -34.690 -39.716-148.975 1.00 0.00 H
+HETATM14661 H2 HOH M 709 -34.441 -39.314-150.413 1.00 0.00 H
+HETATM14662 O HOH M 710 -38.807 -52.254-142.947 1.00 94.71 O
+HETATM14663 H1 HOH M 710 -38.567 -51.936-142.077 1.00 0.00 H
+HETATM14664 H2 HOH M 710 -38.906 -51.461-143.473 1.00 0.00 H
+HETATM14665 O HOH M 711 -31.617 -32.931-152.216 1.00 92.88 O
+HETATM14666 H1 HOH M 711 -31.427 -32.729-151.300 1.00 0.00 H
+HETATM14667 H2 HOH M 711 -31.466 -33.873-152.290 1.00 0.00 H
+HETATM14668 O HOH M 712 -28.322 -21.254-141.820 1.00 83.17 O
+HETATM14669 H1 HOH M 712 -28.135 -21.111-140.892 1.00 0.00 H
+HETATM14670 H2 HOH M 712 -28.216 -22.197-141.944 1.00 0.00 H
+HETATM14671 O HOH M 713 -25.540 -57.394-132.838 1.00 54.96 O
+HETATM14672 H1 HOH M 713 -25.373 -57.020-131.973 1.00 0.00 H
+HETATM14673 H2 HOH M 713 -24.744 -57.210-133.337 1.00 0.00 H
+HETATM14674 O HOH M 714 -26.926 -48.539-148.490 1.00 68.66 O
+HETATM14675 H1 HOH M 714 -26.759 -48.243-147.595 1.00 0.00 H
+HETATM14676 H2 HOH M 714 -27.867 -48.712-148.514 1.00 0.00 H
+HETATM14677 O HOH M 715 -43.396 -35.990-150.899 1.00 85.84 O
+HETATM14678 H1 HOH M 715 -43.137 -35.774-150.003 1.00 0.00 H
+HETATM14679 H2 HOH M 715 -43.053 -36.872-151.042 1.00 0.00 H
+HETATM14680 O HOH M 716 -27.800 -25.068-136.730 1.00 71.37 O
+HETATM14681 H1 HOH M 716 -27.610 -24.898-135.807 1.00 0.00 H
+HETATM14682 H2 HOH M 716 -27.667 -24.224-137.162 1.00 0.00 H
+HETATM14683 O HOH M 717 -21.199 -35.065-128.953 1.00 75.67 O
+HETATM14684 H1 HOH M 717 -21.044 -34.813-128.043 1.00 0.00 H
+HETATM14685 H2 HOH M 717 -21.022 -36.005-128.975 1.00 0.00 H
+HETATM14686 O HOH M 718 -29.812 -10.774-125.269 1.00 88.02 O
+HETATM14687 H1 HOH M 718 -29.592 -10.689-124.341 1.00 0.00 H
+HETATM14688 H2 HOH M 718 -28.987 -11.015-125.690 1.00 0.00 H
+HETATM14689 O HOH M 719 -58.008 -44.516-157.896 1.00 71.55 O
+HETATM14690 H1 HOH M 719 -57.688 -44.270-157.028 1.00 0.00 H
+HETATM14691 H2 HOH M 719 -57.260 -44.940-158.317 1.00 0.00 H
+HETATM14692 O HOH M 720 -20.440 -32.204-128.915 1.00 76.53 O
+HETATM14693 H1 HOH M 720 -20.295 -31.974-127.997 1.00 0.00 H
+HETATM14694 H2 HOH M 720 -19.560 -32.289-129.283 1.00 0.00 H
+HETATM14695 O HOH M 721 -21.569 -37.393-129.796 1.00 81.50 O
+HETATM14696 H1 HOH M 721 -21.418 -37.130-128.888 1.00 0.00 H
+HETATM14697 H2 HOH M 721 -20.787 -37.099-130.264 1.00 0.00 H
+HETATM14698 O HOH M 722 -9.059 -31.532-102.240 1.00 66.33 O
+HETATM14699 H1 HOH M 722 -8.976 -31.249-101.329 1.00 0.00 H
+HETATM14700 H2 HOH M 722 -8.976 -30.726-102.750 1.00 0.00 H
+HETATM14701 O HOH M 723 -23.258 -38.366-151.095 1.00 58.97 O
+HETATM14702 H1 HOH M 723 -23.114 -38.133-150.178 1.00 0.00 H
+HETATM14703 H2 HOH M 723 -23.869 -37.704-151.418 1.00 0.00 H
+HETATM14704 O HOH M 724 -34.853 -23.317-138.374 1.00 79.37 O
+HETATM14705 H1 HOH M 724 -34.622 -23.163-137.458 1.00 0.00 H
+HETATM14706 H2 HOH M 724 -35.150 -22.465-138.693 1.00 0.00 H
+HETATM14707 O HOH M 725 -54.013 -46.258-148.203 1.00 74.96 O
+HETATM14708 H1 HOH M 725 -53.700 -45.985-147.341 1.00 0.00 H
+HETATM14709 H2 HOH M 725 -53.745 -47.174-148.277 1.00 0.00 H
+HETATM14710 O HOH M 726 -46.961 -44.562-170.816 1.00 75.11 O
+HETATM14711 H1 HOH M 726 -46.712 -44.328-169.922 1.00 0.00 H
+HETATM14712 H2 HOH M 726 -47.846 -44.917-170.733 1.00 0.00 H
+HETATM14713 O HOH M 727 -45.043 -19.678-123.906 1.00 63.51 O
+HETATM14714 H1 HOH M 727 -44.718 -19.536-123.017 1.00 0.00 H
+HETATM14715 H2 HOH M 727 -44.976 -18.820-124.325 1.00 0.00 H
+HETATM14716 O HOH M 728 -35.121 -48.649-143.994 1.00 59.68 O
+HETATM14717 H1 HOH M 728 -34.902 -48.349-143.112 1.00 0.00 H
+HETATM14718 H2 HOH M 728 -35.590 -49.472-143.858 1.00 0.00 H
+HETATM14719 O HOH M 729 -26.194 -40.683-114.836 1.00 75.68 O
+HETATM14720 H1 HOH M 729 -25.992 -40.365-113.956 1.00 0.00 H
+HETATM14721 H2 HOH M 729 -25.358 -41.008-115.171 1.00 0.00 H
+HETATM14722 O HOH M 730 -23.992 -36.002-151.381 1.00 58.97 O
+HETATM14723 H1 HOH M 730 -23.844 -35.783-150.461 1.00 0.00 H
+HETATM14724 H2 HOH M 730 -24.048 -35.155-151.824 1.00 0.00 H
+TER
+HETATM14726 C1 NAG A 1 -43.396 -30.273-138.856 1.00114.12 C
+HETATM14727 C2 NAG A 1 -43.704 -30.257-140.341 1.00127.70 C
+HETATM14728 C3 NAG A 1 -44.943 -29.397-140.602 1.00144.41 C
+HETATM14729 C4 NAG A 1 -46.094 -29.759-139.664 1.00155.37 C
+HETATM14730 C5 NAG A 1 -45.631 -29.952-138.218 1.00145.76 C
+HETATM14731 C6 NAG A 1 -46.680 -30.585-137.333 1.00140.68 C
+HETATM14732 C7 NAG A 1 -41.650 -30.559-141.657 1.00116.49 C
+HETATM14733 C8 NAG A 1 -40.552 -29.870-142.411 1.00117.60 C
+HETATM14734 N2 NAG A 1 -42.570 -29.761-141.104 1.00124.84 N
+HETATM14735 O1 NAG A 1 -42.273 -31.123-138.611 1.00 0.00 O
+HETATM14736 O3 NAG A 1 -45.353 -29.559-141.955 1.00149.26 O
+HETATM14737 O4 NAG A 1 -47.018 -28.677-139.653 1.00170.79 O
+HETATM14738 O5 NAG A 1 -44.483 -30.806-138.162 1.00134.63 O
+HETATM14739 O6 NAG A 1 -46.152 -30.917-136.056 1.00136.03 O
+HETATM14740 O7 NAG A 1 -41.701 -31.781-141.553 1.00101.45 O
+HETATM14741 H1 NAG A 1 -43.167 -29.261-138.521 1.00 0.00 H
+HETATM14742 H2 NAG A 1 -43.938 -31.268-140.675 1.00 0.00 H
+HETATM14743 H3 NAG A 1 -44.706 -28.350-140.413 1.00 0.00 H
+HETATM14744 H4 NAG A 1 -46.582 -30.666-140.019 1.00 0.00 H
+HETATM14745 H5 NAG A 1 -45.370 -28.985-137.787 1.00 0.00 H
+HETATM14746 H61 NAG A 1 -47.507 -29.887-137.194 1.00 0.00 H
+HETATM14747 H62 NAG A 1 -47.049 -31.496-137.802 1.00 0.00 H
+HETATM14748 H81 NAG A 1 -40.010 -29.205-141.738 1.00 0.00 H
+HETATM14749 H82 NAG A 1 -39.865 -30.615-142.815 1.00 0.00 H
+HETATM14750 H83 NAG A 1 -40.980 -29.289-143.228 1.00 0.00 H
+HETATM14751 HN2 NAG A 1 -42.452 -28.806-141.233 1.00 0.00 H
+HETATM14752 HO1 NAG A 1 -41.909 -31.532-139.408 1.00 0.00 H
+HETATM14753 HO3 NAG A 1 -44.798 -30.165-142.465 1.00 0.00 H
+HETATM14754 HO4 NAG A 1 -46.761 -27.936-140.219 1.00 0.00 H
+HETATM14755 HO6 NAG A 1 -45.217 -30.692-135.946 1.00 0.00 H
+TER
+HETATM14757 C1 NAG A 2 -48.317 -29.078-140.109 1.00175.73 C
+HETATM14758 C2 NAG A 2 -49.305 -27.963-139.756 1.00185.05 C
+HETATM14759 C3 NAG A 2 -50.695 -28.290-140.298 1.00187.84 C
+HETATM14760 C4 NAG A 2 -50.627 -28.626-141.782 1.00184.02 C
+HETATM14761 C5 NAG A 2 -49.593 -29.721-142.022 1.00171.10 C
+HETATM14762 C6 NAG A 2 -49.390 -30.040-143.484 1.00163.81 C
+HETATM14763 C7 NAG A 2 -49.619 -26.567-137.755 1.00194.84 C
+HETATM14764 C8 NAG A 2 -49.628 -26.538-136.255 1.00193.76 C
+HETATM14765 N2 NAG A 2 -49.355 -27.752-138.317 1.00191.25 N
+HETATM14766 O1 NAG A 2 -47.013 -28.724-139.642 1.00 0.00 O
+HETATM14767 O3 NAG A 2 -51.556 -27.175-140.095 1.00192.02 O
+HETATM14768 O4 NAG A 2 -51.898 -29.069-142.244 1.00190.43 O
+HETATM14769 O5 NAG A 2 -48.322 -29.298-141.513 1.00169.75 O
+HETATM14770 O6 NAG A 2 -48.248 -30.863-143.677 1.00158.77 O
+HETATM14771 O7 NAG A 2 -49.840 -25.563-138.426 1.00196.04 O
+HETATM14772 H1 NAG A 2 -48.634 -30.008-139.636 1.00 0.00 H
+HETATM14773 H2 NAG A 2 -48.996 -27.036-140.239 1.00 0.00 H
+HETATM14774 H3 NAG A 2 -51.093 -29.161-139.777 1.00 0.00 H
+HETATM14775 H4 NAG A 2 -50.331 -27.740-142.343 1.00 0.00 H
+HETATM14776 H5 NAG A 2 -49.903 -30.633-141.510 1.00 0.00 H
+HETATM14777 H61 NAG A 2 -50.266 -30.566-143.866 1.00 0.00 H
+HETATM14778 H62 NAG A 2 -49.250 -29.114-144.041 1.00 0.00 H
+HETATM14779 H81 NAG A 2 -48.649 -26.838-135.880 1.00 0.00 H
+HETATM14780 H82 NAG A 2 -49.853 -25.527-135.912 1.00 0.00 H
+HETATM14781 H83 NAG A 2 -50.387 -27.226-135.882 1.00 0.00 H
+HETATM14782 HN2 NAG A 2 -49.192 -28.493-137.712 1.00 0.00 H
+HETATM14783 HO1 NAG A 2 -46.974 -27.867-139.196 1.00 0.00 H
+HETATM14784 HO3 NAG A 2 -51.130 -26.422-139.662 1.00 0.00 H
+HETATM14785 HO4 NAG A 2 -52.581 -29.084-141.559 1.00 0.00 H
+HETATM14786 HO6 NAG A 2 -47.783 -31.089-142.859 1.00 0.00 H
+TER
+HETATM14788 C1 NAG B 1 -25.581 2.342-109.034 1.00158.80 C
+HETATM14789 C2 NAG B 1 -26.013 3.587-108.282 1.00151.22 C
+HETATM14790 C3 NAG B 1 -26.176 4.754-109.254 1.00154.46 C
+HETATM14791 C4 NAG B 1 -24.972 4.900-110.181 1.00163.49 C
+HETATM14792 C5 NAG B 1 -24.466 3.557-110.713 1.00162.24 C
+HETATM14793 C6 NAG B 1 -23.088 3.641-111.334 1.00170.27 C
+HETATM14794 C7 NAG B 1 -27.321 3.324-106.216 1.00139.41 C
+HETATM14795 C8 NAG B 1 -26.029 3.534-105.482 1.00133.60 C
+HETATM14796 N2 NAG B 1 -27.250 3.357-107.552 1.00146.38 N
+HETATM14797 O1 NAG B 1 -25.377 1.273-108.108 1.00 0.00 O
+HETATM14798 O3 NAG B 1 -26.356 5.956-108.513 1.00151.08 O
+HETATM14799 O4 NAG B 1 -25.396 5.639-111.321 1.00169.50 O
+HETATM14800 O5 NAG B 1 -24.372 2.583-109.667 1.00152.32 O
+HETATM14801 O6 NAG B 1 -23.135 4.122-112.671 1.00176.73 O
+HETATM14802 O7 NAG B 1 -28.380 3.131-105.627 1.00132.59 O
+HETATM14803 H1 NAG B 1 -26.355 2.062-109.749 1.00 0.00 H
+HETATM14804 H2 NAG B 1 -25.235 3.873-107.573 1.00 0.00 H
+HETATM14805 H3 NAG B 1 -27.043 4.579-109.891 1.00 0.00 H
+HETATM14806 H4 NAG B 1 -24.173 5.426-109.660 1.00 0.00 H
+HETATM14807 H5 NAG B 1 -25.154 3.183-111.472 1.00 0.00 H
+HETATM14808 H61 NAG B 1 -22.467 4.321-110.749 1.00 0.00 H
+HETATM14809 H62 NAG B 1 -22.633 2.651-111.343 1.00 0.00 H
+HETATM14810 H81 NAG B 1 -25.620 4.512-105.738 1.00 0.00 H
+HETATM14811 H82 NAG B 1 -26.210 3.486-104.407 1.00 0.00 H
+HETATM14812 H83 NAG B 1 -25.319 2.758-105.766 1.00 0.00 H
+HETATM14813 HN2 NAG B 1 -28.080 3.218-108.035 1.00 0.00 H
+HETATM14814 HO1 NAG B 1 -25.543 1.514-107.186 1.00 0.00 H
+HETATM14815 HO3 NAG B 1 -26.345 5.832-107.554 1.00 0.00 H
+HETATM14816 HO4 NAG B 1 -26.327 5.899-111.296 1.00 0.00 H
+HETATM14817 HO6 NAG B 1 -24.028 4.323-112.986 1.00 0.00 H
+TER
+HETATM14819 C1 NAG B 2 -24.671 6.862-111.508 1.00176.51 C
+HETATM14820 C2 NAG B 2 -25.395 7.649-112.605 1.00176.22 C
+HETATM14821 C3 NAG B 2 -24.726 9.005-112.822 1.00175.94 C
+HETATM14822 C4 NAG B 2 -24.588 9.752-111.501 1.00179.43 C
+HETATM14823 C5 NAG B 2 -23.878 8.871-110.478 1.00177.50 C
+HETATM14824 C6 NAG B 2 -23.777 9.504-109.110 1.00165.64 C
+HETATM14825 C7 NAG B 2 -26.560 6.498-114.443 1.00167.22 C
+HETATM14826 C8 NAG B 2 -26.397 5.727-115.718 1.00160.38 C
+HETATM14827 N2 NAG B 2 -25.428 6.893-113.848 1.00174.22 N
+HETATM14828 O1 NAG B 2 -25.349 5.623-111.284 1.00 0.00 O
+HETATM14829 O3 NAG B 2 -25.498 9.773-113.739 1.00170.42 O
+HETATM14830 O4 NAG B 2 -23.846 10.951-111.693 1.00178.82 O
+HETATM14831 O5 NAG B 2 -24.605 7.645-110.317 1.00179.91 O
+HETATM14832 O6 NAG B 2 -22.768 8.883-108.325 1.00154.90 O
+HETATM14833 O7 NAG B 2 -27.665 6.752-113.973 1.00163.44 O
+HETATM14834 H1 NAG B 2 -23.645 6.665-111.819 1.00 0.00 H
+HETATM14835 H2 NAG B 2 -26.418 7.857-112.290 1.00 0.00 H
+HETATM14836 H3 NAG B 2 -23.723 8.856-113.222 1.00 0.00 H
+HETATM14837 H4 NAG B 2 -25.577 9.999-111.117 1.00 0.00 H
+HETATM14838 H5 NAG B 2 -22.868 8.651-110.826 1.00 0.00 H
+HETATM14839 H61 NAG B 2 -23.531 10.561-109.217 1.00 0.00 H
+HETATM14840 H62 NAG B 2 -24.730 9.403-108.592 1.00 0.00 H
+HETATM14841 H81 NAG B 2 -25.826 4.819-115.523 1.00 0.00 H
+HETATM14842 H82 NAG B 2 -27.380 5.460-116.110 1.00 0.00 H
+HETATM14843 H83 NAG B 2 -25.868 6.339-116.449 1.00 0.00 H
+HETATM14844 HN2 NAG B 2 -24.599 6.649-114.290 1.00 0.00 H
+HETATM14845 HO1 NAG B 2 -26.126 5.494-111.845 1.00 0.00 H
+HETATM14846 HO3 NAG B 2 -25.132 10.649-113.925 1.00 0.00 H
+HETATM14847 HO4 NAG B 2 -23.558 11.092-112.605 1.00 0.00 H
+HETATM14848 HO6 NAG B 2 -22.671 9.260-107.439 1.00 0.00 H
+TER
+HETATM14850 C1 FUC B 3 -22.651 3.144-113.626 1.00184.07 C
+HETATM14851 C2 FUC B 3 -21.115 3.207-113.862 1.00190.17 C
+HETATM14852 C3 FUC B 3 -20.430 1.925-113.436 1.00188.40 C
+HETATM14853 C4 FUC B 3 -21.028 0.775-114.228 1.00186.97 C
+HETATM14854 C5 FUC B 3 -22.524 0.617-113.891 1.00182.20 C
+HETATM14855 C6 FUC B 3 -23.368 0.117-115.061 1.00179.64 C
+HETATM14856 O1 FUC B 3 -22.990 3.945-112.493 1.00 0.00 O
+HETATM14857 O2 FUC B 3 -20.521 4.344-113.237 1.00190.49 O
+HETATM14858 O3 FUC B 3 -19.040 1.990-113.752 1.00188.65 O
+HETATM14859 O4 FUC B 3 -20.875 1.012-115.619 1.00185.30 O
+HETATM14860 O5 FUC B 3 -23.182 1.832-113.374 1.00182.60 O
+HETATM14861 H1 FUC B 3 -23.168 3.524-114.507 1.00 0.00 H
+HETATM14862 H2 FUC B 3 -20.912 3.261-114.931 1.00 0.00 H
+HETATM14863 H3 FUC B 3 -20.574 1.750-112.370 1.00 0.00 H
+HETATM14864 H4 FUC B 3 -20.496 -0.136-113.952 1.00 0.00 H
+HETATM14865 H5 FUC B 3 -22.478 -0.133-113.101 1.00 0.00 H
+HETATM14866 H61 FUC B 3 -24.376 -0.107-114.713 1.00 0.00 H
+HETATM14867 H62 FUC B 3 -23.413 0.885-115.832 1.00 0.00 H
+HETATM14868 H63 FUC B 3 -22.918 -0.785-115.474 1.00 0.00 H
+HETATM14869 HO1 FUC B 3 -22.164 4.324-112.162 1.00 0.00 H
+HETATM14870 HO2 FUC B 3 -21.234 4.827-112.798 1.00 0.00 H
+HETATM14871 HO3 FUC B 3 -18.671 2.725-113.243 1.00 0.00 H
+HETATM14872 HO4 FUC B 3 -21.763 1.013-116.002 1.00 0.00 H
+TER
+HETATM14874 C1 NAG C 1 -11.963 -15.344-124.565 1.00135.96 C
+HETATM14875 C2 NAG C 1 -11.582 -13.923-124.964 1.00159.39 C
+HETATM14876 C3 NAG C 1 -12.859 -13.071-125.042 1.00173.75 C
+HETATM14877 C4 NAG C 1 -13.971 -13.776-125.822 1.00180.88 C
+HETATM14878 C5 NAG C 1 -14.063 -15.275-125.513 1.00172.13 C
+HETATM14879 C6 NAG C 1 -14.925 -16.045-126.488 1.00177.64 C
+HETATM14880 C7 NAG C 1 -10.022 -12.149-124.274 1.00167.50 C
+HETATM14881 C8 NAG C 1 -9.058 -11.686-123.224 1.00164.10 C
+HETATM14882 N2 NAG C 1 -10.620 -13.328-124.046 1.00165.35 N
+HETATM14883 O1 NAG C 1 -10.792 -16.163-124.544 1.00 0.00 O
+HETATM14884 O3 NAG C 1 -12.573 -11.815-125.649 1.00177.39 O
+HETATM14885 O4 NAG C 1 -15.224 -13.224-125.433 1.00192.36 O
+HETATM14886 O5 NAG C 1 -12.769 -15.888-125.538 1.00155.50 O
+HETATM14887 O6 NAG C 1 -15.028 -15.391-127.745 1.00180.49 O
+HETATM14888 O7 NAG C 1 -10.251 -11.484-125.284 1.00171.28 O
+HETATM14889 H1 NAG C 1 -12.419 -15.334-123.575 1.00 0.00 H
+HETATM14890 H2 NAG C 1 -11.140 -13.930-125.961 1.00 0.00 H
+HETATM14891 H3 NAG C 1 -13.248 -12.906-124.038 1.00 0.00 H
+HETATM14892 H4 NAG C 1 -13.816 -13.629-126.890 1.00 0.00 H
+HETATM14893 H5 NAG C 1 -14.495 -15.417-124.522 1.00 0.00 H
+HETATM14894 H61 NAG C 1 -14.492 -17.032-126.654 1.00 0.00 H
+HETATM14895 H62 NAG C 1 -15.929 -16.153-126.078 1.00 0.00 H
+HETATM14896 H81 NAG C 1 -8.255 -12.416-123.121 1.00 0.00 H
+HETATM14897 H82 NAG C 1 -8.637 -10.723-123.516 1.00 0.00 H
+HETATM14898 H83 NAG C 1 -9.579 -11.582-122.272 1.00 0.00 H
+HETATM14899 HN2 NAG C 1 -10.385 -13.788-123.224 1.00 0.00 H
+HETATM14900 HO1 NAG C 1 -9.979 -15.694-124.778 1.00 0.00 H
+HETATM14901 HO3 NAG C 1 -11.647 -11.704-125.907 1.00 0.00 H
+HETATM14902 HO4 NAG C 1 -15.155 -12.525-124.768 1.00 0.00 H
+HETATM14903 HO6 NAG C 1 -14.538 -14.558-127.796 1.00 0.00 H
+TER
+HETATM14905 C1 NAG C 2 -15.851 -12.472-126.482 1.00204.91 C
+HETATM14906 C2 NAG C 2 -17.299 -12.154-126.041 1.00208.33 C
+HETATM14907 C3 NAG C 2 -17.980 -11.165-126.996 1.00207.26 C
+HETATM14908 C4 NAG C 2 -17.092 -9.952-127.233 1.00211.51 C
+HETATM14909 C5 NAG C 2 -15.710 -10.402-127.692 1.00212.72 C
+HETATM14910 C6 NAG C 2 -14.748 -9.253-127.890 1.00213.18 C
+HETATM14911 C7 NAG C 2 -18.514 -14.293-126.682 1.00211.35 C
+HETATM14912 C8 NAG C 2 -18.068 -14.157-128.114 1.00210.43 C
+HETATM14913 N2 NAG C 2 -18.121 -13.343-125.806 1.00211.05 N
+HETATM14914 O1 NAG C 2 -15.245 -13.350-125.531 1.00 0.00 O
+HETATM14915 O3 NAG C 2 -19.224 -10.751-126.442 1.00203.04 O
+HETATM14916 O4 NAG C 2 -17.669 -9.107-128.222 1.00213.41 O
+HETATM14917 O5 NAG C 2 -15.133 -11.256-126.696 1.00210.25 O
+HETATM14918 O6 NAG C 2 -14.380 -8.668-126.649 1.00212.42 O
+HETATM14919 O7 NAG C 2 -19.210 -15.239-126.321 1.00211.28 O
+HETATM14920 H1 NAG C 2 -15.866 -12.950-127.461 1.00 0.00 H
+HETATM14921 H2 NAG C 2 -17.280 -11.582-125.113 1.00 0.00 H
+HETATM14922 H3 NAG C 2 -18.150 -11.647-127.959 1.00 0.00 H
+HETATM14923 H4 NAG C 2 -16.983 -9.394-126.304 1.00 0.00 H
+HETATM14924 H5 NAG C 2 -15.798 -10.948-128.632 1.00 0.00 H
+HETATM14925 H61 NAG C 2 -13.846 -9.616-128.384 1.00 0.00 H
+HETATM14926 H62 NAG C 2 -15.218 -8.489-128.509 1.00 0.00 H
+HETATM14927 H81 NAG C 2 -16.978 -14.164-128.158 1.00 0.00 H
+HETATM14928 H82 NAG C 2 -18.460 -14.991-128.698 1.00 0.00 H
+HETATM14929 H83 NAG C 2 -18.442 -13.219-128.524 1.00 0.00 H
+HETATM14930 HN2 NAG C 2 -18.461 -13.530-124.916 1.00 0.00 H
+HETATM14931 HO1 NAG C 2 -15.824 -13.591-124.794 1.00 0.00 H
+HETATM14932 HO3 NAG C 2 -19.711 -10.123-126.994 1.00 0.00 H
+HETATM14933 HO4 NAG C 2 -18.509 -9.432-128.574 1.00 0.00 H
+HETATM14934 HO6 NAG C 2 -14.793 -9.085-125.880 1.00 0.00 H
+TER
+HETATM14936 C1 NAG D 1 1.571 -52.926-107.189 1.00159.99 C
+HETATM14937 C2 NAG D 1 0.948 -53.566-105.918 1.00144.61 C
+HETATM14938 C3 NAG D 1 1.223 -52.713-104.646 1.00150.21 C
+HETATM14939 C4 NAG D 1 2.629 -52.116-104.605 1.00160.18 C
+HETATM14940 C5 NAG D 1 3.059 -51.597-105.967 1.00155.01 C
+HETATM14941 C6 NAG D 1 4.517 -51.211-106.023 1.00157.19 C
+HETATM14942 C7 NAG D 1 -1.502 -52.973-106.235 1.00123.23 C
+HETATM14943 C8 NAG D 1 -1.172 -51.500-106.289 1.00110.81 C
+HETATM14944 N2 NAG D 1 -0.481 -53.848-106.070 1.00127.87 N
+HETATM14945 O1 NAG D 1 1.338 -53.777-108.314 1.00 0.00 O
+HETATM14946 O3 NAG D 1 0.984 -53.475-103.466 1.00140.13 O
+HETATM14947 O4 NAG D 1 2.598 -50.938-103.809 1.00178.45 O
+HETATM14948 O5 NAG D 1 2.882 -52.613-106.947 1.00159.24 O
+HETATM14949 O6 NAG D 1 5.383 -52.291-105.700 1.00156.65 O
+HETATM14950 O7 NAG D 1 -2.658 -53.365-106.344 1.00130.58 O
+HETATM14951 H1 NAG D 1 1.114 -51.953-107.367 1.00 0.00 H
+HETATM14952 H2 NAG D 1 1.455 -54.505-105.697 1.00 0.00 H
+HETATM14953 H3 NAG D 1 0.569 -51.841-104.644 1.00 0.00 H
+HETATM14954 H4 NAG D 1 3.320 -52.840-104.173 1.00 0.00 H
+HETATM14955 H5 NAG D 1 2.454 -50.730-106.234 1.00 0.00 H
+HETATM14956 H61 NAG D 1 4.765 -50.874-107.030 1.00 0.00 H
+HETATM14957 H62 NAG D 1 4.707 -50.406-105.314 1.00 0.00 H
+HETATM14958 H81 NAG D 1 -0.499 -51.309-107.125 1.00 0.00 H
+HETATM14959 H82 NAG D 1 -2.090 -50.926-106.424 1.00 0.00 H
+HETATM14960 H83 NAG D 1 -0.690 -51.201-105.359 1.00 0.00 H
+HETATM14961 HN2 NAG D 1 -0.798 -54.765-106.059 1.00 0.00 H
+HETATM14962 HO1 NAG D 1 0.847 -54.583-108.102 1.00 0.00 H
+HETATM14963 HO3 NAG D 1 0.695 -54.382-103.635 1.00 0.00 H
+HETATM14964 HO4 NAG D 1 1.725 -50.731-103.448 1.00 0.00 H
+HETATM14965 HO6 NAG D 1 4.922 -53.116-105.491 1.00 0.00 H
+TER
+HETATM14967 C1 NAG D 2 3.042 -51.106-102.456 1.00205.88 C
+HETATM14968 C2 NAG D 2 3.555 -49.751-101.961 1.00210.59 C
+HETATM14969 C3 NAG D 2 3.964 -49.865-100.491 1.00213.52 C
+HETATM14970 C4 NAG D 2 2.792 -50.366 -99.655 1.00212.79 C
+HETATM14971 C5 NAG D 2 2.261 -51.686-100.212 1.00220.25 C
+HETATM14972 C6 NAG D 2 0.985 -52.134 -99.534 1.00209.31 C
+HETATM14973 C7 NAG D 2 4.544 -48.622-103.935 1.00194.56 C
+HETATM14974 C8 NAG D 2 5.824 -48.221-104.607 1.00189.02 C
+HETATM14975 N2 NAG D 2 4.673 -49.278-102.770 1.00205.54 N
+HETATM14976 O1 NAG D 2 2.607 -50.984-103.812 1.00 0.00 O
+HETATM14977 O3 NAG D 2 4.448 -48.632 -99.970 1.00211.77 O
+HETATM14978 O4 NAG D 2 3.198 -50.557 -98.304 1.00203.57 O
+HETATM14979 O5 NAG D 2 1.956 -51.555-101.611 1.00234.24 O
+HETATM14980 O6 NAG D 2 0.979 -51.813 -98.149 1.00202.24 O
+HETATM14981 O7 NAG D 2 3.446 -48.365-104.428 1.00188.95 O
+HETATM14982 H1 NAG D 2 3.843 -51.842-102.395 1.00 0.00 H
+HETATM14983 H2 NAG D 2 2.751 -49.016-102.013 1.00 0.00 H
+HETATM14984 H3 NAG D 2 4.752 -50.611-100.389 1.00 0.00 H
+HETATM14985 H4 NAG D 2 1.984 -49.636 -99.686 1.00 0.00 H
+HETATM14986 H5 NAG D 2 3.015 -52.464-100.086 1.00 0.00 H
+HETATM14987 H61 NAG D 2 0.133 -51.640-100.003 1.00 0.00 H
+HETATM14988 H62 NAG D 2 0.880 -53.214 -99.635 1.00 0.00 H
+HETATM14989 H81 NAG D 2 6.415 -49.111-104.825 1.00 0.00 H
+HETATM14990 H82 NAG D 2 5.598 -47.699-105.538 1.00 0.00 H
+HETATM14991 H83 NAG D 2 6.390 -47.562-103.949 1.00 0.00 H
+HETATM14992 HN2 NAG D 2 5.585 -49.432-102.475 1.00 0.00 H
+HETATM14993 HO1 NAG D 2 2.706 -50.095-104.178 1.00 0.00 H
+HETATM14994 HO3 NAG D 2 4.449 -47.908-100.611 1.00 0.00 H
+HETATM14995 HO4 NAG D 2 4.127 -50.344 -98.140 1.00 0.00 H
+HETATM14996 HO6 NAG D 2 0.175 -52.087 -97.685 1.00 0.00 H
+TER
+HETATM14998 C1 FUC D 3 6.595 -51.682-105.223 1.00150.14 C
+HETATM14999 C2 FUC D 3 7.309 -52.504-104.126 1.00147.30 C
+HETATM15000 C3 FUC D 3 8.680 -52.933-104.572 1.00149.81 C
+HETATM15001 C4 FUC D 3 9.467 -51.698-104.962 1.00154.13 C
+HETATM15002 C5 FUC D 3 8.831 -51.045-106.198 1.00138.89 C
+HETATM15003 C6 FUC D 3 9.023 -49.533-106.260 1.00133.55 C
+HETATM15004 O1 FUC D 3 5.502 -52.437-105.745 1.00 0.00 O
+HETATM15005 O2 FUC D 3 6.551 -53.638-103.691 1.00131.54 O
+HETATM15006 O3 FUC D 3 9.346 -53.547-103.477 1.00154.10 O
+HETATM15007 O4 FUC D 3 9.464 -50.785-103.888 1.00156.29 O
+HETATM15008 O5 FUC D 3 7.396 -51.307-106.350 1.00135.02 O
+HETATM15009 H1 FUC D 3 6.222 -50.753-104.793 1.00 0.00 H
+HETATM15010 H2 FUC D 3 7.490 -51.873-103.257 1.00 0.00 H
+HETATM15011 H3 FUC D 3 8.627 -53.617-105.419 1.00 0.00 H
+HETATM15012 H4 FUC D 3 10.493 -51.987-105.192 1.00 0.00 H
+HETATM15013 H5 FUC D 3 9.375 -51.533-107.006 1.00 0.00 H
+HETATM15014 H61 FUC D 3 8.662 -49.159-107.218 1.00 0.00 H
+HETATM15015 H62 FUC D 3 8.463 -49.061-105.454 1.00 0.00 H
+HETATM15016 H63 FUC D 3 10.081 -49.296-106.153 1.00 0.00 H
+HETATM15017 HO1 FUC D 3 5.492 -53.280-105.270 1.00 0.00 H
+HETATM15018 HO2 FUC D 3 7.076 -54.082-103.012 1.00 0.00 H
+HETATM15019 HO3 FUC D 3 8.832 -54.331-103.241 1.00 0.00 H
+HETATM15020 HO4 FUC D 3 9.871 -51.236-103.136 1.00 0.00 H
+TER
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diff --git a/7_Simple_Metrics/data/PB_DO04GTLU.in b/7_Simple_Metrics/data/PB_DO04GTLU.in
new file mode 100644
index 0000000..955b8ce
--- /dev/null
+++ b/7_Simple_Metrics/data/PB_DO04GTLU.in
@@ -0,0 +1,64 @@
+#
+# Note that most of the comments here were taken from sample
+# input files that came with APBS. You can find APBS at
+# http://agave.wustl.edu/apbs/
+# Note that APBS is BSD & MIT'd code.
+#
+read
+mol pqr PB_DO04GTLU.pqr # read molecule 1
+end
+elec
+mg-auto
+dime 97 99 83 # number of find grid points
+# calculated by psize.py
+cglen 48.140600 49.903500 41.262400 # coarse mesh lengths (A)
+fglen 48.140600 49.355000 41.262400 # fine mesh lengths (A)
+# calculated by psize.py
+cgcent 38.581000 62.214500 44.882000 # (could also give (x,y,z) form psize.py) #known center
+fgcent 38.581000 62.214500 44.882000 # (could also give (x,y,z) form psize.py) #known center
+npbe # solve the full nonlinear PBE with npbe
+#lpbe # solve the linear PBE with lpbe
+bcfl sdh # Boundary condition flag
+# 0 => Zero
+# 1 => Single DH sphere
+# 2 => Multiple DH spheres
+# 4 => Focusing
+#
+#ion 1 0.000 2.0 # Counterion declaration:
+ion 1 0.150000 2.000000 # Counterion declaration:
+ion -1 0.150000 2.000000 # ion
+ion 2 0.000000 2.000000 # ion
+ion -2 0.000000 2.000000 # ion
+pdie 4.000000 # Solute dielectric
+sdie 80.000000 # Solvent dielectric
+chgm spl2 # Charge disc method
+# 0 is linear splines
+# 1 is cubic b-splines
+mol 1 # which molecule to use
+srfm smol # Surface calculation method
+# 0 => Mol surface for epsilon;
+# inflated VdW for kappa; no
+# smoothing
+# 1 => As 0 with harmoic average
+# smoothing
+# 2 => Cubic spline
+srad 1.400000 # Solvent radius (1.4 for water)
+swin 0.3 # Surface cubic spline window .. default 0.3
+temp 310.000000 # System temperature (298.15 default)
+sdens 10.000000 # Specify the number of grid points per square-angstrom to use in Vacc object. Ignored when srad is 0.0 (see srad) or srfm is spl2 (see srfm). There is a direct correlation between the value used for the Vacc sphere density, the accuracy of the Vacc object, and the APBS calculation time. APBS default value is 10.0.
+gamma 0.105 # Surface tension parameter for apolar forces (in kJ/mol/A^2)
+# only used for force calculations, so we don't care, but
+# it's always required, and 0.105 is the default
+calcenergy no # Energy I/O to stdout
+# 0 => don't write out energy
+# 1 => write out total energy
+# 2 => write out total energy and all
+# components
+calcforce no # Atomic forces I/O (to stdout)
+# 0 => don't write out forces
+# 1 => write out net forces on molecule
+# 2 => write out atom-level forces
+write pot dx PB_DO04GTLU # What to write .. this says write the potential in dx
+# format to a file.
+end
+quit
diff --git a/7_Simple_Metrics/data/PB_DO04GTLU.pqr b/7_Simple_Metrics/data/PB_DO04GTLU.pqr
new file mode 100644
index 0000000..008777e
--- /dev/null
+++ b/7_Simple_Metrics/data/PB_DO04GTLU.pqr
@@ -0,0 +1,292 @@
+ATOM 1 N VAL A 1 26.872 48.196 36.147 -0.199 1.802
+ATOM 2 CA VAL A 1 28.092 48.984 36.158 0.201 2.012
+ATOM 3 C VAL A 1 27.995 49.965 37.307 0.688 1.917
+ATOM 4 O VAL A 1 26.993 50.658 37.456 -0.688 1.541
+ATOM 5 CB VAL A 1 28.335 49.705 34.828 -0.096 2.012
+ATOM 6 CG1 VAL A 1 29.627 50.502 34.901 -0.289 2.012
+ATOM 7 CG2 VAL A 1 28.387 48.705 33.683 -0.289 2.012
+ATOM 8 1H VAL A 1 26.907 47.537 35.396 0.295 0.902
+ATOM 9 2H VAL A 1 26.782 47.707 37.015 0.295 0.902
+ATOM 10 3H VAL A 1 26.085 48.801 36.023 0.295 0.902
+ATOM 11 HA VAL A 1 28.935 48.314 36.330 0.114 1.421
+ATOM 12 HB VAL A 1 27.522 50.409 34.653 0.096 1.421
+ATOM 13 1HG1 VAL A 1 29.794 51.013 33.952 0.096 1.421
+ATOM 14 2HG1 VAL A 1 29.555 51.239 35.701 0.096 1.421
+ATOM 15 3HG1 VAL A 1 30.460 49.828 35.100 0.096 1.421
+ATOM 16 1HG2 VAL A 1 28.559 49.234 32.746 0.096 1.421
+ATOM 17 2HG2 VAL A 1 29.198 47.997 33.855 0.096 1.421
+ATOM 18 3HG2 VAL A 1 27.441 48.167 33.627 0.096 1.421
+ATOM 19 N GLN A 2 29.037 50.001 38.128 -0.605 1.802
+ATOM 20 CA GLN A 2 29.096 50.888 39.277 0.090 2.012
+ATOM 21 C GLN A 2 30.456 51.555 39.329 0.688 1.917
+ATOM 22 O GLN A 2 31.468 50.938 38.987 -0.688 1.541
+ATOM 23 CB GLN A 2 28.851 50.137 40.594 -0.178 2.012
+ATOM 24 CG GLN A 2 27.449 49.584 40.786 -0.178 2.012
+ATOM 25 CD GLN A 2 26.403 50.677 40.936 0.543 1.968
+ATOM 26 OE1 GLN A 2 26.711 51.870 40.845 -0.543 1.549
+ATOM 27 NE2 GLN A 2 25.154 50.275 41.165 -0.612 1.802
+ATOM 28 H GLN A 2 29.816 49.385 37.941 0.399 0.902
+ATOM 29 HA GLN A 2 28.317 51.643 39.171 0.116 1.421
+ATOM 30 1HB GLN A 2 29.541 49.297 40.668 0.089 1.421
+ATOM 31 2HB GLN A 2 29.053 50.801 41.434 0.089 1.421
+ATOM 32 1HG GLN A 2 27.186 48.979 39.918 0.089 1.421
+ATOM 33 2HG GLN A 2 27.432 48.971 41.687 0.089 1.421
+ATOM 34 1HE2 GLN A 2 24.422 50.950 41.273 0.316 0.902
+ATOM 35 2HE2 GLN A 2 24.946 49.299 41.230 0.296 0.902
+ATOM 36 N LEU A 3 30.479 52.810 39.767 -0.605 1.802
+ATOM 37 CA LEU A 3 31.733 53.467 40.107 0.090 2.012
+ATOM 38 C LEU A 3 31.527 54.310 41.362 0.688 1.917
+ATOM 39 O LEU A 3 30.481 54.948 41.522 -0.688 1.541
+ATOM 40 CB LEU A 3 32.248 54.332 38.945 -0.193 2.012
+ATOM 41 CG LEU A 3 32.463 53.683 37.554 -0.096 2.012
+ATOM 42 CD1 LEU A 3 31.222 53.775 36.663 -0.289 2.012
+ATOM 43 CD2 LEU A 3 33.679 54.255 36.820 -0.289 2.012
+ATOM 44 H LEU A 3 29.613 53.320 39.867 0.399 0.902
+ATOM 45 HA LEU A 3 32.479 52.701 40.317 0.116 1.421
+ATOM 46 1HB LEU A 3 31.548 55.151 38.785 0.096 1.421
+ATOM 47 2HB LEU A 3 33.212 54.755 39.227 0.096 1.421
+ATOM 48 HG LEU A 3 32.618 52.610 37.673 0.096 1.421
+ATOM 49 1HD1 LEU A 3 31.429 53.305 35.701 0.096 1.421
+ATOM 50 2HD1 LEU A 3 30.389 53.263 37.145 0.096 1.421
+ATOM 51 3HD1 LEU A 3 30.963 54.822 36.507 0.096 1.421
+ATOM 52 1HD2 LEU A 3 33.784 53.765 35.852 0.096 1.421
+ATOM 53 2HD2 LEU A 3 33.544 55.327 36.671 0.096 1.421
+ATOM 54 3HD2 LEU A 3 34.577 54.082 37.413 0.096 1.421
+ATOM 55 N LYS A 4 32.506 54.294 42.274 -0.605 1.802
+ATOM 56 CA LYS A 4 32.473 55.208 43.409 0.090 2.012
+ATOM 57 C LYS A 4 33.835 55.855 43.620 0.688 1.917
+ATOM 58 O LYS A 4 34.875 55.218 43.443 -0.688 1.541
+ATOM 59 CB LYS A 4 32.011 54.510 44.700 -0.157 2.012
+ATOM 60 CG LYS A 4 31.526 55.511 45.769 -0.157 2.012
+ATOM 61 CD LYS A 4 30.625 54.860 46.812 -0.157 2.012
+ATOM 62 CE LYS A 4 30.835 55.476 48.202 0.196 2.012
+ATOM 63 NZ LYS A 4 29.863 54.932 49.188 -0.266 1.802
+ATOM 64 H LYS A 4 33.277 53.648 42.185 0.399 0.902
+ATOM 65 HA LYS A 4 31.765 56.008 43.189 0.116 1.421
+ATOM 66 1HB LYS A 4 31.200 53.818 44.470 0.087 1.421
+ATOM 67 2HB LYS A 4 32.833 53.925 45.112 0.087 1.421
+ATOM 68 1HG LYS A 4 32.387 55.943 46.280 0.087 1.421
+ATOM 69 2HG LYS A 4 30.970 56.315 45.288 0.087 1.421
+ATOM 70 1HD LYS A 4 29.581 54.988 46.523 0.087 1.421
+ATOM 71 2HD LYS A 4 30.841 53.793 46.864 0.087 1.421
+ATOM 72 1HE LYS A 4 31.847 55.264 48.544 0.051 1.421
+ATOM 73 2HE LYS A 4 30.714 56.558 48.143 0.051 1.421
+ATOM 74 1HZ LYS A 4 30.026 55.356 50.091 0.305 0.902
+ATOM 75 2HZ LYS A 4 28.922 55.139 48.884 0.305 0.902
+ATOM 76 3HZ LYS A 4 29.980 53.932 49.260 0.305 0.902
+ATOM 77 N GLU A 5 33.812 57.132 43.989 -0.605 1.802
+ATOM 78 CA GLU A 5 35.007 57.915 44.281 0.090 2.012
+ATOM 79 C GLU A 5 35.211 57.956 45.789 0.688 1.917
+ATOM 80 O GLU A 5 34.237 58.052 46.542 -0.688 1.541
+ATOM 81 CB GLU A 5 34.870 59.346 43.745 -0.162 2.012
+ATOM 82 CG GLU A 5 34.465 59.461 42.276 -0.237 2.012
+ATOM 83 CD GLU A 5 32.973 59.277 42.045 0.434 1.917
+ATOM 84 OE1 GLU A 5 32.250 58.886 42.979 -0.595 1.493
+ATOM 85 OE2 GLU A 5 32.511 59.521 40.922 -0.595 1.493
+ATOM 86 H GLU A 5 32.905 57.570 44.067 0.399 0.902
+ATOM 87 HA GLU A 5 35.858 57.443 43.790 0.116 1.421
+ATOM 88 1HB GLU A 5 34.124 59.884 44.330 0.039 1.421
+ATOM 89 2HB GLU A 5 35.818 59.871 43.862 0.039 1.421
+ATOM 90 1HG GLU A 5 34.755 60.444 41.906 0.039 1.421
+ATOM 91 2HG GLU A 5 35.007 58.712 41.701 0.039 1.421
+ATOM 92 N SER A 6 36.473 57.898 46.230 -0.605 1.802
+ATOM 93 CA SER A 6 36.743 57.784 47.667 0.090 2.012
+ATOM 94 C SER A 6 38.164 58.264 47.972 0.688 1.917
+ATOM 95 O SER A 6 39.095 57.463 48.063 -0.688 1.541
+ATOM 96 CB SER A 6 36.556 56.364 48.155 0.039 2.012
+ATOM 97 OG SER A 6 37.575 55.541 47.622 -0.509 1.543
+ATOM 98 H SER A 6 37.249 57.932 45.585 0.399 0.902
+ATOM 99 HA SER A 6 36.040 58.423 48.203 0.116 1.421
+ATOM 100 1HB SER A 6 36.586 56.347 49.244 0.069 1.421
+ATOM 101 2HB SER A 6 35.576 56.000 47.849 0.069 1.421
+ATOM 102 HG SER A 6 38.124 56.115 47.082 0.332 0.902
+ATOM 103 N GLY A 7 38.301 59.567 48.152 -0.605 1.802
+ATOM 104 CA GLY A 7 39.472 60.139 48.765 -0.026 2.012
+ATOM 105 C GLY A 7 39.021 61.033 49.898 0.688 1.917
+ATOM 106 O GLY A 7 37.846 61.029 50.282 -0.688 1.541
+ATOM 107 H GLY A 7 37.557 60.178 47.848 0.399 0.902
+ATOM 108 1HA GLY A 7 40.121 59.341 49.125 0.116 1.421
+ATOM 109 2HA GLY A 7 40.036 60.699 48.020 0.116 1.421
+ATOM 110 N PRO A 8 39.943 61.839 50.446 -0.373 1.802
+ATOM 111 CA PRO A 8 39.571 62.767 51.519 0.026 2.012
+ATOM 112 C PRO A 8 38.624 63.844 51.022 0.688 1.917
+ATOM 113 O PRO A 8 38.241 63.849 49.848 -0.688 1.541
+ATOM 114 CB PRO A 8 40.921 63.344 51.965 -0.232 2.012
+ATOM 115 CG PRO A 8 41.768 63.270 50.786 -0.232 2.012
+ATOM 116 CD PRO A 8 41.340 62.030 50.023 0.000 2.012
+ATOM 117 HA PRO A 8 39.096 62.204 52.336 0.116 1.421
+ATOM 118 1HB PRO A 8 40.789 64.375 52.324 0.116 1.421
+ATOM 119 2HB PRO A 8 41.320 62.759 52.807 0.116 1.421
+ATOM 120 1HG PRO A 8 41.652 64.179 50.178 0.116 1.421
+ATOM 121 2HG PRO A 8 42.826 63.218 51.081 0.116 1.421
+ATOM 122 1HD PRO A 8 41.414 62.220 48.942 0.116 1.421
+ATOM 123 2HD PRO A 8 41.979 61.182 50.312 0.116 1.421
+ATOM 124 N ASP A 9 38.197 64.741 51.901 -0.605 1.802
+ATOM 125 CA ASP A 9 37.351 65.841 51.469 0.090 2.012
+ATOM 126 C ASP A 9 37.905 67.193 51.874 0.688 1.917
+ATOM 127 O ASP A 9 37.285 68.217 51.568 -0.688 1.541
+ATOM 128 CB ASP A 9 35.917 65.678 51.998 -0.289 2.012
+ATOM 129 CG ASP A 9 35.863 65.556 53.496 0.686 1.917
+ATOM 130 OD1 ASP A 9 36.834 65.017 54.074 -0.810 1.493
+ATOM 131 OD2 ASP A 9 34.849 65.987 54.092 -0.810 1.493
+ATOM 132 H ASP A 9 38.453 64.671 52.875 0.399 0.902
+ATOM 133 HA ASP A 9 37.316 65.843 50.379 0.116 1.421
+ATOM 134 1HB ASP A 9 35.317 66.536 51.694 0.111 1.421
+ATOM 135 2HB ASP A 9 35.465 64.789 51.557 0.111 1.421
+ATOM 136 N LEU A 10 39.059 67.230 52.528 0.000 1.802
+ATOM 137 CA LEU A 10 39.708 68.489 52.858 0.000 2.012
+ATOM 138 C LEU A 10 41.211 68.259 52.836 0.000 1.917
+ATOM 139 O LEU A 10 41.720 67.413 53.579 0.000 1.541
+ATOM 140 CB LEU A 10 39.242 69.006 54.220 0.000 2.012
+ATOM 141 CG LEU A 10 39.912 70.257 54.801 0.000 2.012
+ATOM 142 CD1 LEU A 10 39.672 71.472 53.914 0.000 2.012
+ATOM 143 CD2 LEU A 10 39.433 70.521 56.231 0.000 2.012
+ATOM 144 H LEU A 10 39.498 66.363 52.804 0.000 0.902
+ATOM 145 HA LEU A 10 39.440 69.225 52.101 0.000 1.421
+ATOM 146 1HB LEU A 10 38.179 69.233 54.160 0.000 1.421
+ATOM 147 2HB LEU A 10 39.383 68.217 54.958 0.000 1.421
+ATOM 148 HG LEU A 10 40.993 70.118 54.815 0.000 1.421
+ATOM 149 1HD1 LEU A 10 40.159 72.344 54.351 0.000 1.421
+ATOM 150 2HD1 LEU A 10 40.085 71.286 52.923 0.000 1.421
+ATOM 151 3HD1 LEU A 10 38.602 71.657 53.833 0.000 1.421
+ATOM 152 1HD2 LEU A 10 39.924 71.413 56.620 0.000 1.421
+ATOM 153 2HD2 LEU A 10 38.353 70.672 56.231 0.000 1.421
+ATOM 154 3HD2 LEU A 10 39.680 69.667 56.861 0.000 1.421
+ATOM 155 N VAL A 11 41.905 68.993 51.963 0.000 1.802
+ATOM 156 CA VAL A 11 43.357 68.977 51.839 0.000 2.012
+ATOM 157 C VAL A 11 43.819 70.429 51.737 0.000 1.917
+ATOM 158 O VAL A 11 43.010 71.350 51.596 0.000 1.541
+ATOM 159 CB VAL A 11 43.830 68.137 50.628 0.000 2.012
+ATOM 160 CG1 VAL A 11 43.414 66.683 50.776 0.000 2.012
+ATOM 161 CG2 VAL A 11 43.236 68.673 49.353 0.000 2.012
+ATOM 162 H VAL A 11 41.366 69.594 51.356 0.000 0.902
+ATOM 163 HA VAL A 11 43.776 68.529 52.741 0.000 1.421
+ATOM 164 HB VAL A 11 44.917 68.186 50.566 0.000 1.421
+ATOM 165 1HG1 VAL A 11 43.760 66.116 49.911 0.000 1.421
+ATOM 166 2HG1 VAL A 11 43.856 66.268 51.682 0.000 1.421
+ATOM 167 3HG1 VAL A 11 42.328 66.620 50.840 0.000 1.421
+ATOM 168 1HG2 VAL A 11 43.579 68.072 48.511 0.000 1.421
+ATOM 169 2HG2 VAL A 11 42.148 68.629 49.412 0.000 1.421
+ATOM 170 3HG2 VAL A 11 43.550 69.707 49.212 0.000 1.421
+ATOM 171 N GLN A 12 45.129 70.637 51.824 0.000 1.802
+ATOM 172 CA GLN A 12 45.675 71.984 51.952 0.000 2.012
+ATOM 173 C GLN A 12 46.535 72.374 50.756 0.000 1.917
+ATOM 174 O GLN A 12 47.137 71.511 50.111 0.000 1.541
+ATOM 175 CB GLN A 12 46.548 72.129 53.209 0.000 2.012
+ATOM 176 CG GLN A 12 46.028 71.534 54.486 0.000 2.012
+ATOM 177 CD GLN A 12 46.912 71.947 55.629 0.000 1.968
+ATOM 178 OE1 GLN A 12 47.030 73.135 55.930 0.000 1.549
+ATOM 179 NE2 GLN A 12 47.573 70.981 56.250 0.000 1.802
+ATOM 180 H GLN A 12 45.761 69.850 51.801 0.000 0.902
+ATOM 181 HA GLN A 12 44.846 72.687 52.035 0.000 1.421
+ATOM 182 1HB GLN A 12 47.520 71.668 53.032 0.000 1.421
+ATOM 183 2HB GLN A 12 46.719 73.186 53.413 0.000 1.421
+ATOM 184 1HG GLN A 12 45.014 71.895 54.656 0.000 1.421
+ATOM 185 2HG GLN A 12 46.028 70.448 54.395 0.000 1.421
+ATOM 186 1HE2 GLN A 12 48.176 71.200 57.018 0.000 0.902
+ATOM 187 2HE2 GLN A 12 47.470 70.032 55.952 0.000 0.902
+ATOM 188 N PRO A 13 46.649 73.672 50.461 0.000 1.802
+ATOM 189 CA PRO A 13 47.506 74.119 49.357 0.000 2.012
+ATOM 190 C PRO A 13 48.910 73.538 49.408 0.000 1.917
+ATOM 191 O PRO A 13 49.497 73.368 50.472 0.000 1.541
+ATOM 192 CB PRO A 13 47.521 75.640 49.535 0.000 2.012
+ATOM 193 CG PRO A 13 46.141 75.926 49.982 0.000 2.012
+ATOM 194 CD PRO A 13 45.762 74.755 50.897 0.000 2.012
+ATOM 195 HA PRO A 13 47.041 73.837 48.401 0.000 1.421
+ATOM 196 1HB PRO A 13 48.290 75.925 50.268 0.000 1.421
+ATOM 197 2HB PRO A 13 47.786 76.127 48.585 0.000 1.421
+ATOM 198 1HG PRO A 13 46.104 76.892 50.506 0.000 1.421
+ATOM 199 2HG PRO A 13 45.470 76.010 49.114 0.000 1.421
+ATOM 200 1HD PRO A 13 45.951 75.032 51.945 0.000 1.421
+ATOM 201 2HD PRO A 13 44.702 74.501 50.748 0.000 1.421
+ATOM 202 N SER A 14 49.422 73.217 48.225 0.000 1.802
+ATOM 203 CA SER A 14 50.770 72.712 47.984 0.000 2.012
+ATOM 204 C SER A 14 50.885 71.234 48.341 0.000 1.917
+ATOM 205 O SER A 14 51.890 70.596 48.017 0.000 1.541
+ATOM 206 CB SER A 14 51.809 73.540 48.730 0.000 2.012
+ATOM 207 OG SER A 14 52.034 73.006 50.019 0.000 1.543
+ATOM 208 H SER A 14 48.797 73.345 47.442 0.000 0.902
+ATOM 209 HA SER A 14 50.980 72.781 46.916 0.000 1.421
+ATOM 210 1HB SER A 14 52.740 73.550 48.165 0.000 1.421
+ATOM 211 2HB SER A 14 51.464 74.570 48.810 0.000 1.421
+ATOM 212 HG SER A 14 51.459 72.240 50.092 0.000 0.902
+ATOM 213 N GLN A 15 49.846 70.666 48.946 0.000 1.802
+ATOM 214 CA GLN A 15 49.773 69.222 49.142 0.000 2.012
+ATOM 215 C GLN A 15 49.519 68.520 47.801 0.000 1.917
+ATOM 216 O GLN A 15 49.559 69.121 46.725 0.000 1.541
+ATOM 217 CB GLN A 15 48.685 68.867 50.151 0.000 2.012
+ATOM 218 CG GLN A 15 49.126 68.782 51.596 0.000 2.012
+ATOM 219 CD GLN A 15 48.011 68.291 52.496 0.000 1.968
+ATOM 220 OE1 GLN A 15 47.601 68.985 53.421 0.000 1.549
+ATOM 221 NE2 GLN A 15 47.503 67.091 52.218 0.000 1.802
+ATOM 222 H GLN A 15 49.089 71.246 49.278 0.000 0.902
+ATOM 223 HA GLN A 15 50.731 68.877 49.531 0.000 1.421
+ATOM 224 1HB GLN A 15 47.888 69.609 50.103 0.000 1.421
+ATOM 225 2HB GLN A 15 48.250 67.902 49.892 0.000 1.421
+ATOM 226 1HG GLN A 15 49.963 68.088 51.669 0.000 1.421
+ATOM 227 2HG GLN A 15 49.432 69.773 51.931 0.000 1.421
+ATOM 228 1HE2 GLN A 15 46.764 66.717 52.780 0.000 0.902
+ATOM 229 2HE2 GLN A 15 47.860 66.563 51.447 0.000 0.902
+ATOM 230 N THR A 16 49.247 67.214 47.867 0.000 1.802
+ATOM 231 CA THR A 16 48.963 66.379 46.701 0.000 2.012
+ATOM 232 C THR A 16 47.691 65.581 46.964 0.000 1.917
+ATOM 233 O THR A 16 47.638 64.784 47.909 0.000 1.541
+ATOM 234 CB THR A 16 50.124 65.419 46.380 0.000 2.012
+ATOM 235 OG1 THR A 16 51.295 66.152 45.987 0.000 1.543
+ATOM 236 CG2 THR A 16 49.735 64.460 45.270 0.000 2.012
+ATOM 237 H THR A 16 49.241 66.794 48.786 0.000 0.902
+ATOM 238 HA THR A 16 48.818 67.029 45.838 0.000 1.421
+ATOM 239 HB THR A 16 50.380 64.847 47.272 0.000 1.421
+ATOM 240 HG1 THR A 16 51.105 67.093 46.008 0.000 0.902
+ATOM 241 1HG2 THR A 16 50.569 63.790 45.059 0.000 1.421
+ATOM 242 2HG2 THR A 16 48.869 63.875 45.581 0.000 1.421
+ATOM 243 3HG2 THR A 16 49.487 65.024 44.372 0.000 1.421
+ATOM 244 N LEU A 17 46.676 65.782 46.122 0.000 1.802
+ATOM 245 CA LEU A 17 45.417 65.067 46.273 0.000 2.012
+ATOM 246 C LEU A 17 45.549 63.647 45.738 0.000 1.917
+ATOM 247 O LEU A 17 46.223 63.419 44.737 0.000 1.541
+ATOM 248 CB LEU A 17 44.304 65.812 45.545 0.000 2.012
+ATOM 249 CG LEU A 17 42.955 65.109 45.475 0.000 2.012
+ATOM 250 CD1 LEU A 17 42.395 64.876 46.854 0.000 2.012
+ATOM 251 CD2 LEU A 17 41.992 65.938 44.658 0.000 2.012
+ATOM 252 H LEU A 17 46.779 66.442 45.364 0.000 0.902
+ATOM 253 HA LEU A 17 45.173 65.017 47.334 0.000 1.421
+ATOM 254 1HB LEU A 17 44.147 66.770 46.039 0.000 1.421
+ATOM 255 2HB LEU A 17 44.625 66.003 44.521 0.000 1.421
+ATOM 256 HG LEU A 17 43.078 64.132 45.007 0.000 1.421
+ATOM 257 1HD1 LEU A 17 41.431 64.372 46.775 0.000 1.421
+ATOM 258 2HD1 LEU A 17 43.083 64.253 47.426 0.000 1.421
+ATOM 259 3HD1 LEU A 17 42.264 65.832 47.360 0.000 1.421
+ATOM 260 1HD2 LEU A 17 41.027 65.432 44.609 0.000 1.421
+ATOM 261 2HD2 LEU A 17 41.866 66.915 45.125 0.000 1.421
+ATOM 262 3HD2 LEU A 17 42.387 66.066 43.650 0.000 1.421
+ATOM 263 N SER A 18 44.931 62.689 46.435 0.000 1.802
+ATOM 264 CA SER A 18 44.961 61.268 46.072 0.000 2.012
+ATOM 265 C SER A 18 43.538 60.716 46.110 0.000 1.917
+ATOM 266 O SER A 18 43.022 60.396 47.186 0.000 1.541
+ATOM 267 CB SER A 18 45.856 60.464 47.001 0.000 2.012
+ATOM 268 OG SER A 18 47.221 60.724 46.762 0.000 1.543
+ATOM 269 H SER A 18 44.418 62.976 47.256 0.000 0.902
+ATOM 270 HA SER A 18 45.359 61.178 45.060 0.000 1.421
+ATOM 271 1HB SER A 18 45.619 60.708 48.036 0.000 1.421
+ATOM 272 2HB SER A 18 45.662 59.401 46.863 0.000 1.421
+ATOM 273 HG SER A 18 47.247 61.366 46.048 0.000 0.902
+ATOM 274 N LEU A 19 42.918 60.575 44.938 0.000 1.802
+ATOM 275 CA LEU A 19 41.591 59.992 44.832 0.000 2.012
+ATOM 276 C LEU A 19 41.688 58.596 44.240 0.000 1.917
+ATOM 277 O LEU A 19 42.677 58.237 43.602 0.000 1.541
+ATOM 278 CB LEU A 19 40.664 60.872 43.990 0.000 2.012
+ATOM 279 CG LEU A 19 40.529 62.286 44.551 0.000 2.012
+ATOM 280 CD1 LEU A 19 39.535 63.103 43.769 0.000 2.012
+ATOM 281 CD2 LEU A 19 40.129 62.214 46.008 0.000 2.012
+ATOM 282 H LEU A 19 43.388 60.884 44.099 0.000 0.902
+ATOM 283 HA LEU A 19 41.168 59.910 45.833 0.000 1.421
+ATOM 284 1HB LEU A 19 41.059 60.923 42.977 0.000 1.421
+ATOM 285 2HB LEU A 19 39.681 60.404 43.951 0.000 1.421
+ATOM 286 HG LEU A 19 41.483 62.806 44.462 0.000 1.421
+ATOM 287 1HD1 LEU A 19 39.467 64.103 44.199 0.000 1.421
+ATOM 288 2HD1 LEU A 19 39.861 63.176 42.731 0.000 1.421
+ATOM 289 3HD1 LEU A 19 38.558 62.624 43.810 0.000 1.421
+ATOM 290 1HD2 LEU A 19 40.033 63.223 46.409 0.000 1.421
+ATOM 291 2HD2 LEU A 19 39.174 61.695 46.098 0.000 1.421
+ATOM 292 3HD2 LEU A 19 40.891 61.672 46.568 0.000 1.421
diff --git a/7_Simple_Metrics/data/PB_WVU9JECQ.in b/7_Simple_Metrics/data/PB_WVU9JECQ.in
new file mode 100644
index 0000000..cf77d22
--- /dev/null
+++ b/7_Simple_Metrics/data/PB_WVU9JECQ.in
@@ -0,0 +1,64 @@
+#
+# Note that most of the comments here were taken from sample
+# input files that came with APBS. You can find APBS at
+# http://agave.wustl.edu/apbs/
+# Note that APBS is BSD & MIT'd code.
+#
+read
+mol pqr PB_WVU9JECQ.pqr # read molecule 1
+end
+elec
+mg-auto
+dime 97 99 83 # number of find grid points
+# calculated by psize.py
+cglen 48.140600 49.903500 41.262400 # coarse mesh lengths (A)
+fglen 48.140600 49.355000 41.262400 # fine mesh lengths (A)
+# calculated by psize.py
+cgcent 38.581000 62.214500 44.882000 # (could also give (x,y,z) form psize.py) #known center
+fgcent 38.581000 62.214500 44.882000 # (could also give (x,y,z) form psize.py) #known center
+npbe # solve the full nonlinear PBE with npbe
+#lpbe # solve the linear PBE with lpbe
+bcfl sdh # Boundary condition flag
+# 0 => Zero
+# 1 => Single DH sphere
+# 2 => Multiple DH spheres
+# 4 => Focusing
+#
+#ion 1 0.000 2.0 # Counterion declaration:
+ion 1 0.150000 2.000000 # Counterion declaration:
+ion -1 0.150000 2.000000 # ion
+ion 2 0.000000 2.000000 # ion
+ion -2 0.000000 2.000000 # ion
+pdie 4.000000 # Solute dielectric
+sdie 80.000000 # Solvent dielectric
+chgm spl2 # Charge disc method
+# 0 is linear splines
+# 1 is cubic b-splines
+mol 1 # which molecule to use
+srfm smol # Surface calculation method
+# 0 => Mol surface for epsilon;
+# inflated VdW for kappa; no
+# smoothing
+# 1 => As 0 with harmoic average
+# smoothing
+# 2 => Cubic spline
+srad 1.400000 # Solvent radius (1.4 for water)
+swin 0.3 # Surface cubic spline window .. default 0.3
+temp 310.000000 # System temperature (298.15 default)
+sdens 10.000000 # Specify the number of grid points per square-angstrom to use in Vacc object. Ignored when srad is 0.0 (see srad) or srfm is spl2 (see srfm). There is a direct correlation between the value used for the Vacc sphere density, the accuracy of the Vacc object, and the APBS calculation time. APBS default value is 10.0.
+gamma 0.105 # Surface tension parameter for apolar forces (in kJ/mol/A^2)
+# only used for force calculations, so we don't care, but
+# it's always required, and 0.105 is the default
+calcenergy no # Energy I/O to stdout
+# 0 => don't write out energy
+# 1 => write out total energy
+# 2 => write out total energy and all
+# components
+calcforce no # Atomic forces I/O (to stdout)
+# 0 => don't write out forces
+# 1 => write out net forces on molecule
+# 2 => write out atom-level forces
+write pot dx PB_WVU9JECQ # What to write .. this says write the potential in dx
+# format to a file.
+end
+quit
diff --git a/7_Simple_Metrics/data/PB_WVU9JECQ.pqr b/7_Simple_Metrics/data/PB_WVU9JECQ.pqr
new file mode 100644
index 0000000..008777e
--- /dev/null
+++ b/7_Simple_Metrics/data/PB_WVU9JECQ.pqr
@@ -0,0 +1,292 @@
+ATOM 1 N VAL A 1 26.872 48.196 36.147 -0.199 1.802
+ATOM 2 CA VAL A 1 28.092 48.984 36.158 0.201 2.012
+ATOM 3 C VAL A 1 27.995 49.965 37.307 0.688 1.917
+ATOM 4 O VAL A 1 26.993 50.658 37.456 -0.688 1.541
+ATOM 5 CB VAL A 1 28.335 49.705 34.828 -0.096 2.012
+ATOM 6 CG1 VAL A 1 29.627 50.502 34.901 -0.289 2.012
+ATOM 7 CG2 VAL A 1 28.387 48.705 33.683 -0.289 2.012
+ATOM 8 1H VAL A 1 26.907 47.537 35.396 0.295 0.902
+ATOM 9 2H VAL A 1 26.782 47.707 37.015 0.295 0.902
+ATOM 10 3H VAL A 1 26.085 48.801 36.023 0.295 0.902
+ATOM 11 HA VAL A 1 28.935 48.314 36.330 0.114 1.421
+ATOM 12 HB VAL A 1 27.522 50.409 34.653 0.096 1.421
+ATOM 13 1HG1 VAL A 1 29.794 51.013 33.952 0.096 1.421
+ATOM 14 2HG1 VAL A 1 29.555 51.239 35.701 0.096 1.421
+ATOM 15 3HG1 VAL A 1 30.460 49.828 35.100 0.096 1.421
+ATOM 16 1HG2 VAL A 1 28.559 49.234 32.746 0.096 1.421
+ATOM 17 2HG2 VAL A 1 29.198 47.997 33.855 0.096 1.421
+ATOM 18 3HG2 VAL A 1 27.441 48.167 33.627 0.096 1.421
+ATOM 19 N GLN A 2 29.037 50.001 38.128 -0.605 1.802
+ATOM 20 CA GLN A 2 29.096 50.888 39.277 0.090 2.012
+ATOM 21 C GLN A 2 30.456 51.555 39.329 0.688 1.917
+ATOM 22 O GLN A 2 31.468 50.938 38.987 -0.688 1.541
+ATOM 23 CB GLN A 2 28.851 50.137 40.594 -0.178 2.012
+ATOM 24 CG GLN A 2 27.449 49.584 40.786 -0.178 2.012
+ATOM 25 CD GLN A 2 26.403 50.677 40.936 0.543 1.968
+ATOM 26 OE1 GLN A 2 26.711 51.870 40.845 -0.543 1.549
+ATOM 27 NE2 GLN A 2 25.154 50.275 41.165 -0.612 1.802
+ATOM 28 H GLN A 2 29.816 49.385 37.941 0.399 0.902
+ATOM 29 HA GLN A 2 28.317 51.643 39.171 0.116 1.421
+ATOM 30 1HB GLN A 2 29.541 49.297 40.668 0.089 1.421
+ATOM 31 2HB GLN A 2 29.053 50.801 41.434 0.089 1.421
+ATOM 32 1HG GLN A 2 27.186 48.979 39.918 0.089 1.421
+ATOM 33 2HG GLN A 2 27.432 48.971 41.687 0.089 1.421
+ATOM 34 1HE2 GLN A 2 24.422 50.950 41.273 0.316 0.902
+ATOM 35 2HE2 GLN A 2 24.946 49.299 41.230 0.296 0.902
+ATOM 36 N LEU A 3 30.479 52.810 39.767 -0.605 1.802
+ATOM 37 CA LEU A 3 31.733 53.467 40.107 0.090 2.012
+ATOM 38 C LEU A 3 31.527 54.310 41.362 0.688 1.917
+ATOM 39 O LEU A 3 30.481 54.948 41.522 -0.688 1.541
+ATOM 40 CB LEU A 3 32.248 54.332 38.945 -0.193 2.012
+ATOM 41 CG LEU A 3 32.463 53.683 37.554 -0.096 2.012
+ATOM 42 CD1 LEU A 3 31.222 53.775 36.663 -0.289 2.012
+ATOM 43 CD2 LEU A 3 33.679 54.255 36.820 -0.289 2.012
+ATOM 44 H LEU A 3 29.613 53.320 39.867 0.399 0.902
+ATOM 45 HA LEU A 3 32.479 52.701 40.317 0.116 1.421
+ATOM 46 1HB LEU A 3 31.548 55.151 38.785 0.096 1.421
+ATOM 47 2HB LEU A 3 33.212 54.755 39.227 0.096 1.421
+ATOM 48 HG LEU A 3 32.618 52.610 37.673 0.096 1.421
+ATOM 49 1HD1 LEU A 3 31.429 53.305 35.701 0.096 1.421
+ATOM 50 2HD1 LEU A 3 30.389 53.263 37.145 0.096 1.421
+ATOM 51 3HD1 LEU A 3 30.963 54.822 36.507 0.096 1.421
+ATOM 52 1HD2 LEU A 3 33.784 53.765 35.852 0.096 1.421
+ATOM 53 2HD2 LEU A 3 33.544 55.327 36.671 0.096 1.421
+ATOM 54 3HD2 LEU A 3 34.577 54.082 37.413 0.096 1.421
+ATOM 55 N LYS A 4 32.506 54.294 42.274 -0.605 1.802
+ATOM 56 CA LYS A 4 32.473 55.208 43.409 0.090 2.012
+ATOM 57 C LYS A 4 33.835 55.855 43.620 0.688 1.917
+ATOM 58 O LYS A 4 34.875 55.218 43.443 -0.688 1.541
+ATOM 59 CB LYS A 4 32.011 54.510 44.700 -0.157 2.012
+ATOM 60 CG LYS A 4 31.526 55.511 45.769 -0.157 2.012
+ATOM 61 CD LYS A 4 30.625 54.860 46.812 -0.157 2.012
+ATOM 62 CE LYS A 4 30.835 55.476 48.202 0.196 2.012
+ATOM 63 NZ LYS A 4 29.863 54.932 49.188 -0.266 1.802
+ATOM 64 H LYS A 4 33.277 53.648 42.185 0.399 0.902
+ATOM 65 HA LYS A 4 31.765 56.008 43.189 0.116 1.421
+ATOM 66 1HB LYS A 4 31.200 53.818 44.470 0.087 1.421
+ATOM 67 2HB LYS A 4 32.833 53.925 45.112 0.087 1.421
+ATOM 68 1HG LYS A 4 32.387 55.943 46.280 0.087 1.421
+ATOM 69 2HG LYS A 4 30.970 56.315 45.288 0.087 1.421
+ATOM 70 1HD LYS A 4 29.581 54.988 46.523 0.087 1.421
+ATOM 71 2HD LYS A 4 30.841 53.793 46.864 0.087 1.421
+ATOM 72 1HE LYS A 4 31.847 55.264 48.544 0.051 1.421
+ATOM 73 2HE LYS A 4 30.714 56.558 48.143 0.051 1.421
+ATOM 74 1HZ LYS A 4 30.026 55.356 50.091 0.305 0.902
+ATOM 75 2HZ LYS A 4 28.922 55.139 48.884 0.305 0.902
+ATOM 76 3HZ LYS A 4 29.980 53.932 49.260 0.305 0.902
+ATOM 77 N GLU A 5 33.812 57.132 43.989 -0.605 1.802
+ATOM 78 CA GLU A 5 35.007 57.915 44.281 0.090 2.012
+ATOM 79 C GLU A 5 35.211 57.956 45.789 0.688 1.917
+ATOM 80 O GLU A 5 34.237 58.052 46.542 -0.688 1.541
+ATOM 81 CB GLU A 5 34.870 59.346 43.745 -0.162 2.012
+ATOM 82 CG GLU A 5 34.465 59.461 42.276 -0.237 2.012
+ATOM 83 CD GLU A 5 32.973 59.277 42.045 0.434 1.917
+ATOM 84 OE1 GLU A 5 32.250 58.886 42.979 -0.595 1.493
+ATOM 85 OE2 GLU A 5 32.511 59.521 40.922 -0.595 1.493
+ATOM 86 H GLU A 5 32.905 57.570 44.067 0.399 0.902
+ATOM 87 HA GLU A 5 35.858 57.443 43.790 0.116 1.421
+ATOM 88 1HB GLU A 5 34.124 59.884 44.330 0.039 1.421
+ATOM 89 2HB GLU A 5 35.818 59.871 43.862 0.039 1.421
+ATOM 90 1HG GLU A 5 34.755 60.444 41.906 0.039 1.421
+ATOM 91 2HG GLU A 5 35.007 58.712 41.701 0.039 1.421
+ATOM 92 N SER A 6 36.473 57.898 46.230 -0.605 1.802
+ATOM 93 CA SER A 6 36.743 57.784 47.667 0.090 2.012
+ATOM 94 C SER A 6 38.164 58.264 47.972 0.688 1.917
+ATOM 95 O SER A 6 39.095 57.463 48.063 -0.688 1.541
+ATOM 96 CB SER A 6 36.556 56.364 48.155 0.039 2.012
+ATOM 97 OG SER A 6 37.575 55.541 47.622 -0.509 1.543
+ATOM 98 H SER A 6 37.249 57.932 45.585 0.399 0.902
+ATOM 99 HA SER A 6 36.040 58.423 48.203 0.116 1.421
+ATOM 100 1HB SER A 6 36.586 56.347 49.244 0.069 1.421
+ATOM 101 2HB SER A 6 35.576 56.000 47.849 0.069 1.421
+ATOM 102 HG SER A 6 38.124 56.115 47.082 0.332 0.902
+ATOM 103 N GLY A 7 38.301 59.567 48.152 -0.605 1.802
+ATOM 104 CA GLY A 7 39.472 60.139 48.765 -0.026 2.012
+ATOM 105 C GLY A 7 39.021 61.033 49.898 0.688 1.917
+ATOM 106 O GLY A 7 37.846 61.029 50.282 -0.688 1.541
+ATOM 107 H GLY A 7 37.557 60.178 47.848 0.399 0.902
+ATOM 108 1HA GLY A 7 40.121 59.341 49.125 0.116 1.421
+ATOM 109 2HA GLY A 7 40.036 60.699 48.020 0.116 1.421
+ATOM 110 N PRO A 8 39.943 61.839 50.446 -0.373 1.802
+ATOM 111 CA PRO A 8 39.571 62.767 51.519 0.026 2.012
+ATOM 112 C PRO A 8 38.624 63.844 51.022 0.688 1.917
+ATOM 113 O PRO A 8 38.241 63.849 49.848 -0.688 1.541
+ATOM 114 CB PRO A 8 40.921 63.344 51.965 -0.232 2.012
+ATOM 115 CG PRO A 8 41.768 63.270 50.786 -0.232 2.012
+ATOM 116 CD PRO A 8 41.340 62.030 50.023 0.000 2.012
+ATOM 117 HA PRO A 8 39.096 62.204 52.336 0.116 1.421
+ATOM 118 1HB PRO A 8 40.789 64.375 52.324 0.116 1.421
+ATOM 119 2HB PRO A 8 41.320 62.759 52.807 0.116 1.421
+ATOM 120 1HG PRO A 8 41.652 64.179 50.178 0.116 1.421
+ATOM 121 2HG PRO A 8 42.826 63.218 51.081 0.116 1.421
+ATOM 122 1HD PRO A 8 41.414 62.220 48.942 0.116 1.421
+ATOM 123 2HD PRO A 8 41.979 61.182 50.312 0.116 1.421
+ATOM 124 N ASP A 9 38.197 64.741 51.901 -0.605 1.802
+ATOM 125 CA ASP A 9 37.351 65.841 51.469 0.090 2.012
+ATOM 126 C ASP A 9 37.905 67.193 51.874 0.688 1.917
+ATOM 127 O ASP A 9 37.285 68.217 51.568 -0.688 1.541
+ATOM 128 CB ASP A 9 35.917 65.678 51.998 -0.289 2.012
+ATOM 129 CG ASP A 9 35.863 65.556 53.496 0.686 1.917
+ATOM 130 OD1 ASP A 9 36.834 65.017 54.074 -0.810 1.493
+ATOM 131 OD2 ASP A 9 34.849 65.987 54.092 -0.810 1.493
+ATOM 132 H ASP A 9 38.453 64.671 52.875 0.399 0.902
+ATOM 133 HA ASP A 9 37.316 65.843 50.379 0.116 1.421
+ATOM 134 1HB ASP A 9 35.317 66.536 51.694 0.111 1.421
+ATOM 135 2HB ASP A 9 35.465 64.789 51.557 0.111 1.421
+ATOM 136 N LEU A 10 39.059 67.230 52.528 0.000 1.802
+ATOM 137 CA LEU A 10 39.708 68.489 52.858 0.000 2.012
+ATOM 138 C LEU A 10 41.211 68.259 52.836 0.000 1.917
+ATOM 139 O LEU A 10 41.720 67.413 53.579 0.000 1.541
+ATOM 140 CB LEU A 10 39.242 69.006 54.220 0.000 2.012
+ATOM 141 CG LEU A 10 39.912 70.257 54.801 0.000 2.012
+ATOM 142 CD1 LEU A 10 39.672 71.472 53.914 0.000 2.012
+ATOM 143 CD2 LEU A 10 39.433 70.521 56.231 0.000 2.012
+ATOM 144 H LEU A 10 39.498 66.363 52.804 0.000 0.902
+ATOM 145 HA LEU A 10 39.440 69.225 52.101 0.000 1.421
+ATOM 146 1HB LEU A 10 38.179 69.233 54.160 0.000 1.421
+ATOM 147 2HB LEU A 10 39.383 68.217 54.958 0.000 1.421
+ATOM 148 HG LEU A 10 40.993 70.118 54.815 0.000 1.421
+ATOM 149 1HD1 LEU A 10 40.159 72.344 54.351 0.000 1.421
+ATOM 150 2HD1 LEU A 10 40.085 71.286 52.923 0.000 1.421
+ATOM 151 3HD1 LEU A 10 38.602 71.657 53.833 0.000 1.421
+ATOM 152 1HD2 LEU A 10 39.924 71.413 56.620 0.000 1.421
+ATOM 153 2HD2 LEU A 10 38.353 70.672 56.231 0.000 1.421
+ATOM 154 3HD2 LEU A 10 39.680 69.667 56.861 0.000 1.421
+ATOM 155 N VAL A 11 41.905 68.993 51.963 0.000 1.802
+ATOM 156 CA VAL A 11 43.357 68.977 51.839 0.000 2.012
+ATOM 157 C VAL A 11 43.819 70.429 51.737 0.000 1.917
+ATOM 158 O VAL A 11 43.010 71.350 51.596 0.000 1.541
+ATOM 159 CB VAL A 11 43.830 68.137 50.628 0.000 2.012
+ATOM 160 CG1 VAL A 11 43.414 66.683 50.776 0.000 2.012
+ATOM 161 CG2 VAL A 11 43.236 68.673 49.353 0.000 2.012
+ATOM 162 H VAL A 11 41.366 69.594 51.356 0.000 0.902
+ATOM 163 HA VAL A 11 43.776 68.529 52.741 0.000 1.421
+ATOM 164 HB VAL A 11 44.917 68.186 50.566 0.000 1.421
+ATOM 165 1HG1 VAL A 11 43.760 66.116 49.911 0.000 1.421
+ATOM 166 2HG1 VAL A 11 43.856 66.268 51.682 0.000 1.421
+ATOM 167 3HG1 VAL A 11 42.328 66.620 50.840 0.000 1.421
+ATOM 168 1HG2 VAL A 11 43.579 68.072 48.511 0.000 1.421
+ATOM 169 2HG2 VAL A 11 42.148 68.629 49.412 0.000 1.421
+ATOM 170 3HG2 VAL A 11 43.550 69.707 49.212 0.000 1.421
+ATOM 171 N GLN A 12 45.129 70.637 51.824 0.000 1.802
+ATOM 172 CA GLN A 12 45.675 71.984 51.952 0.000 2.012
+ATOM 173 C GLN A 12 46.535 72.374 50.756 0.000 1.917
+ATOM 174 O GLN A 12 47.137 71.511 50.111 0.000 1.541
+ATOM 175 CB GLN A 12 46.548 72.129 53.209 0.000 2.012
+ATOM 176 CG GLN A 12 46.028 71.534 54.486 0.000 2.012
+ATOM 177 CD GLN A 12 46.912 71.947 55.629 0.000 1.968
+ATOM 178 OE1 GLN A 12 47.030 73.135 55.930 0.000 1.549
+ATOM 179 NE2 GLN A 12 47.573 70.981 56.250 0.000 1.802
+ATOM 180 H GLN A 12 45.761 69.850 51.801 0.000 0.902
+ATOM 181 HA GLN A 12 44.846 72.687 52.035 0.000 1.421
+ATOM 182 1HB GLN A 12 47.520 71.668 53.032 0.000 1.421
+ATOM 183 2HB GLN A 12 46.719 73.186 53.413 0.000 1.421
+ATOM 184 1HG GLN A 12 45.014 71.895 54.656 0.000 1.421
+ATOM 185 2HG GLN A 12 46.028 70.448 54.395 0.000 1.421
+ATOM 186 1HE2 GLN A 12 48.176 71.200 57.018 0.000 0.902
+ATOM 187 2HE2 GLN A 12 47.470 70.032 55.952 0.000 0.902
+ATOM 188 N PRO A 13 46.649 73.672 50.461 0.000 1.802
+ATOM 189 CA PRO A 13 47.506 74.119 49.357 0.000 2.012
+ATOM 190 C PRO A 13 48.910 73.538 49.408 0.000 1.917
+ATOM 191 O PRO A 13 49.497 73.368 50.472 0.000 1.541
+ATOM 192 CB PRO A 13 47.521 75.640 49.535 0.000 2.012
+ATOM 193 CG PRO A 13 46.141 75.926 49.982 0.000 2.012
+ATOM 194 CD PRO A 13 45.762 74.755 50.897 0.000 2.012
+ATOM 195 HA PRO A 13 47.041 73.837 48.401 0.000 1.421
+ATOM 196 1HB PRO A 13 48.290 75.925 50.268 0.000 1.421
+ATOM 197 2HB PRO A 13 47.786 76.127 48.585 0.000 1.421
+ATOM 198 1HG PRO A 13 46.104 76.892 50.506 0.000 1.421
+ATOM 199 2HG PRO A 13 45.470 76.010 49.114 0.000 1.421
+ATOM 200 1HD PRO A 13 45.951 75.032 51.945 0.000 1.421
+ATOM 201 2HD PRO A 13 44.702 74.501 50.748 0.000 1.421
+ATOM 202 N SER A 14 49.422 73.217 48.225 0.000 1.802
+ATOM 203 CA SER A 14 50.770 72.712 47.984 0.000 2.012
+ATOM 204 C SER A 14 50.885 71.234 48.341 0.000 1.917
+ATOM 205 O SER A 14 51.890 70.596 48.017 0.000 1.541
+ATOM 206 CB SER A 14 51.809 73.540 48.730 0.000 2.012
+ATOM 207 OG SER A 14 52.034 73.006 50.019 0.000 1.543
+ATOM 208 H SER A 14 48.797 73.345 47.442 0.000 0.902
+ATOM 209 HA SER A 14 50.980 72.781 46.916 0.000 1.421
+ATOM 210 1HB SER A 14 52.740 73.550 48.165 0.000 1.421
+ATOM 211 2HB SER A 14 51.464 74.570 48.810 0.000 1.421
+ATOM 212 HG SER A 14 51.459 72.240 50.092 0.000 0.902
+ATOM 213 N GLN A 15 49.846 70.666 48.946 0.000 1.802
+ATOM 214 CA GLN A 15 49.773 69.222 49.142 0.000 2.012
+ATOM 215 C GLN A 15 49.519 68.520 47.801 0.000 1.917
+ATOM 216 O GLN A 15 49.559 69.121 46.725 0.000 1.541
+ATOM 217 CB GLN A 15 48.685 68.867 50.151 0.000 2.012
+ATOM 218 CG GLN A 15 49.126 68.782 51.596 0.000 2.012
+ATOM 219 CD GLN A 15 48.011 68.291 52.496 0.000 1.968
+ATOM 220 OE1 GLN A 15 47.601 68.985 53.421 0.000 1.549
+ATOM 221 NE2 GLN A 15 47.503 67.091 52.218 0.000 1.802
+ATOM 222 H GLN A 15 49.089 71.246 49.278 0.000 0.902
+ATOM 223 HA GLN A 15 50.731 68.877 49.531 0.000 1.421
+ATOM 224 1HB GLN A 15 47.888 69.609 50.103 0.000 1.421
+ATOM 225 2HB GLN A 15 48.250 67.902 49.892 0.000 1.421
+ATOM 226 1HG GLN A 15 49.963 68.088 51.669 0.000 1.421
+ATOM 227 2HG GLN A 15 49.432 69.773 51.931 0.000 1.421
+ATOM 228 1HE2 GLN A 15 46.764 66.717 52.780 0.000 0.902
+ATOM 229 2HE2 GLN A 15 47.860 66.563 51.447 0.000 0.902
+ATOM 230 N THR A 16 49.247 67.214 47.867 0.000 1.802
+ATOM 231 CA THR A 16 48.963 66.379 46.701 0.000 2.012
+ATOM 232 C THR A 16 47.691 65.581 46.964 0.000 1.917
+ATOM 233 O THR A 16 47.638 64.784 47.909 0.000 1.541
+ATOM 234 CB THR A 16 50.124 65.419 46.380 0.000 2.012
+ATOM 235 OG1 THR A 16 51.295 66.152 45.987 0.000 1.543
+ATOM 236 CG2 THR A 16 49.735 64.460 45.270 0.000 2.012
+ATOM 237 H THR A 16 49.241 66.794 48.786 0.000 0.902
+ATOM 238 HA THR A 16 48.818 67.029 45.838 0.000 1.421
+ATOM 239 HB THR A 16 50.380 64.847 47.272 0.000 1.421
+ATOM 240 HG1 THR A 16 51.105 67.093 46.008 0.000 0.902
+ATOM 241 1HG2 THR A 16 50.569 63.790 45.059 0.000 1.421
+ATOM 242 2HG2 THR A 16 48.869 63.875 45.581 0.000 1.421
+ATOM 243 3HG2 THR A 16 49.487 65.024 44.372 0.000 1.421
+ATOM 244 N LEU A 17 46.676 65.782 46.122 0.000 1.802
+ATOM 245 CA LEU A 17 45.417 65.067 46.273 0.000 2.012
+ATOM 246 C LEU A 17 45.549 63.647 45.738 0.000 1.917
+ATOM 247 O LEU A 17 46.223 63.419 44.737 0.000 1.541
+ATOM 248 CB LEU A 17 44.304 65.812 45.545 0.000 2.012
+ATOM 249 CG LEU A 17 42.955 65.109 45.475 0.000 2.012
+ATOM 250 CD1 LEU A 17 42.395 64.876 46.854 0.000 2.012
+ATOM 251 CD2 LEU A 17 41.992 65.938 44.658 0.000 2.012
+ATOM 252 H LEU A 17 46.779 66.442 45.364 0.000 0.902
+ATOM 253 HA LEU A 17 45.173 65.017 47.334 0.000 1.421
+ATOM 254 1HB LEU A 17 44.147 66.770 46.039 0.000 1.421
+ATOM 255 2HB LEU A 17 44.625 66.003 44.521 0.000 1.421
+ATOM 256 HG LEU A 17 43.078 64.132 45.007 0.000 1.421
+ATOM 257 1HD1 LEU A 17 41.431 64.372 46.775 0.000 1.421
+ATOM 258 2HD1 LEU A 17 43.083 64.253 47.426 0.000 1.421
+ATOM 259 3HD1 LEU A 17 42.264 65.832 47.360 0.000 1.421
+ATOM 260 1HD2 LEU A 17 41.027 65.432 44.609 0.000 1.421
+ATOM 261 2HD2 LEU A 17 41.866 66.915 45.125 0.000 1.421
+ATOM 262 3HD2 LEU A 17 42.387 66.066 43.650 0.000 1.421
+ATOM 263 N SER A 18 44.931 62.689 46.435 0.000 1.802
+ATOM 264 CA SER A 18 44.961 61.268 46.072 0.000 2.012
+ATOM 265 C SER A 18 43.538 60.716 46.110 0.000 1.917
+ATOM 266 O SER A 18 43.022 60.396 47.186 0.000 1.541
+ATOM 267 CB SER A 18 45.856 60.464 47.001 0.000 2.012
+ATOM 268 OG SER A 18 47.221 60.724 46.762 0.000 1.543
+ATOM 269 H SER A 18 44.418 62.976 47.256 0.000 0.902
+ATOM 270 HA SER A 18 45.359 61.178 45.060 0.000 1.421
+ATOM 271 1HB SER A 18 45.619 60.708 48.036 0.000 1.421
+ATOM 272 2HB SER A 18 45.662 59.401 46.863 0.000 1.421
+ATOM 273 HG SER A 18 47.247 61.366 46.048 0.000 0.902
+ATOM 274 N LEU A 19 42.918 60.575 44.938 0.000 1.802
+ATOM 275 CA LEU A 19 41.591 59.992 44.832 0.000 2.012
+ATOM 276 C LEU A 19 41.688 58.596 44.240 0.000 1.917
+ATOM 277 O LEU A 19 42.677 58.237 43.602 0.000 1.541
+ATOM 278 CB LEU A 19 40.664 60.872 43.990 0.000 2.012
+ATOM 279 CG LEU A 19 40.529 62.286 44.551 0.000 2.012
+ATOM 280 CD1 LEU A 19 39.535 63.103 43.769 0.000 2.012
+ATOM 281 CD2 LEU A 19 40.129 62.214 46.008 0.000 2.012
+ATOM 282 H LEU A 19 43.388 60.884 44.099 0.000 0.902
+ATOM 283 HA LEU A 19 41.168 59.910 45.833 0.000 1.421
+ATOM 284 1HB LEU A 19 41.059 60.923 42.977 0.000 1.421
+ATOM 285 2HB LEU A 19 39.681 60.404 43.951 0.000 1.421
+ATOM 286 HG LEU A 19 41.483 62.806 44.462 0.000 1.421
+ATOM 287 1HD1 LEU A 19 39.467 64.103 44.199 0.000 1.421
+ATOM 288 2HD1 LEU A 19 39.861 63.176 42.731 0.000 1.421
+ATOM 289 3HD1 LEU A 19 38.558 62.624 43.810 0.000 1.421
+ATOM 290 1HD2 LEU A 19 40.033 63.223 46.409 0.000 1.421
+ATOM 291 2HD2 LEU A 19 39.174 61.695 46.098 0.000 1.421
+ATOM 292 3HD2 LEU A 19 40.891 61.672 46.568 0.000 1.421
diff --git a/7_Simple_Metrics/img/SimpleMetricsFrameworks.jpg b/7_Simple_Metrics/img/SimpleMetricsFrameworks.jpg
new file mode 100644
index 0000000..3e19d18
Binary files /dev/null and b/7_Simple_Metrics/img/SimpleMetricsFrameworks.jpg differ
diff --git a/8_Filter/.ipynb_checkpoints/8_1_Filter_Introduction-checkpoint.ipynb b/8_Filter/.ipynb_checkpoints/8_1_Filter_Introduction-checkpoint.ipynb
index 3bf3a34..8760e81 100644
--- a/8_Filter/.ipynb_checkpoints/8_1_Filter_Introduction-checkpoint.ipynb
+++ b/8_Filter/.ipynb_checkpoints/8_1_Filter_Introduction-checkpoint.ipynb
@@ -32,16 +32,17 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "由于Rosetta采用使用MCMC算法，因此并不是每一个在轨迹中的构象都是“好”的。如果采样是多步，每步都依赖于前一步的结果，当某一步骤中产生的构象是不可靠的，后续的所有采样步骤消耗的计算资源是浪费的，如果有的放矢地设置一些过滤器将初始阶段产生的“劣质”构象丢弃掉，无疑可以加速采样的过程并提高可靠性，这就是Rosetta中设置Filter(过滤模块)的初衷。\n",
+ "由于Rosetta使用MCMC算法，因此并不是每一个在轨迹中的构象都是“好”的。如果采样是多步，每步都依赖于前一步的结果，当某一步骤中产生的构象是不可靠的，后续的所有采样步骤消耗的计算资源是浪费的，如果有的放矢地设置一些过滤器将初始阶段产生的“劣质”构象丢弃掉，无疑可以加速采样的过程并提高可靠性，这就是Rosetta中设置Filter(过滤模块)的初衷。\n",
"\n",
- "举个例子，我们知道在ubiqutin(一种蛋白质)的构象优化过程中保留原构象中保留的K11和E34的盐桥是重要的，因此如果在Repack优化侧链时该盐桥被破坏，那么在后续的能量最小化的过程中就不太可能重新连接起来。如果在这一步中指定了相应的Filter，就可以从多条模拟轨迹中筛选出那些盐桥没有被破坏的构象作为后续采样的Pose输入。"
+ "举个例子，我们知道在ubiqutin(一种蛋白质)的构象优化过程中，原构象中保留的K11和E34的盐桥是重要的，因此如果在Repack优化侧链时该盐桥被破坏，那么在后续的能量最小化的过程中就不太可能重新连接起来。如果在这一步中指定了相应的Filter，就可以从多条模拟轨迹中筛选出那些盐桥没有被破坏的构象作为后续采样的Pose输入。"
]
},
{
"cell_type": "markdown",
"metadata": {},
"source": [
- "
\n",
+ "(图片来源: 晶泰科技团队)"
]
},
{
@@ -50,7 +51,7 @@
"source": [
"Rosetta中Filter模块分为两个大类别，SimpleMetricFilter以及其他已经定义好的Filters:\n",
"- 在前面的章节中，我们认识了SimpleMetrics，它是Rosetta新一代的数据分析和特征报告工具，可以在计算流程的任意步骤处使用SimpleMetrics去获取当前Pose的特征数据，SimpleMetricFilter以SimpleMetrics输出作为阈值进行筛选。\n",
- "- Filters的种类多于SimpleMetricFilter，一般会以某些结构上的度量（角度、距离等）作为阈值条件，以决定构象的去留。如在设定盐桥的例子里面，我们可以简单地通过设定两个残基之间的距离应小于4埃，来达到滤掉无特定盐桥构象的目的。"
+ "- **Filters的种类多于SimpleMetricFilter**，一般会以某些结构上的度量（角度、距离等）作为阈值条件，以决定构象的去留。如在设定盐桥的例子里面，我们可以简单地通过设定两个残基之间的距离应小于4埃，来达到滤掉无特定盐桥构象的目的。"
]
},
{
@@ -102,7 +103,7 @@
},
{
"cell_type": "code",
- "execution_count": 7,
+ "execution_count": 1,
"metadata": {
"scrolled": true,
"tags": []
@@ -112,13 +113,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release 2021.18+release.54b4909cd528ede1d749ea69e8046c244fc797f2 2021-05-04T21:04:43] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
"\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release r282 2021.18+release.54b4909cd52 54b4909cd528ede1d749ea69e8046c244fc797f2 http://www.pyrosetta.org 2021-05-04T21:04:43\n",
- "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.6/site-packages/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=1386844316 seed_offset=0 real_seed=1386844316 thread_index=0\n",
- "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=1386844316 RG_type=mt19937\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=283761091 seed_offset=0 real_seed=283761091 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=283761091 RG_type=mt19937\n",
"\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
"\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
"\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
@@ -133,6 +134,58 @@
"\t\n",
"\n",
"\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 984 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.706405 seconds.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama_str.dat.\n",
"\u001b[0mprotocols.filters.AtomicDistanceFilter: {0} \u001b[0mAtomicDistance filter between Residue 1 atom type Nlys and Residue 2 atom type OOC with distance cutoff of 3\n",
"\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"salt_bridge\" of type AtomicDistance\n",
"\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n"
@@ -159,7 +212,7 @@
},
{
"cell_type": "code",
- "execution_count": 8,
+ "execution_count": 2,
"metadata": {},
"outputs": [
{
@@ -183,7 +236,7 @@
},
{
"cell_type": "code",
- "execution_count": 9,
+ "execution_count": 3,
"metadata": {},
"outputs": [
{
@@ -201,7 +254,7 @@
},
{
"cell_type": "code",
- "execution_count": 10,
+ "execution_count": 4,
"metadata": {},
"outputs": [
{
@@ -210,7 +263,7 @@
"False"
]
},
- "execution_count": 10,
+ "execution_count": 4,
"metadata": {},
"output_type": "execute_result"
}
@@ -222,7 +275,7 @@
},
{
"cell_type": "code",
- "execution_count": 12,
+ "execution_count": 5,
"metadata": {},
"outputs": [
{
@@ -230,9 +283,18 @@
"output_type": "stream",
"text": [
"\u001b[0mcore.pack.task: {0} \u001b[0mPacker task: initialize from command line()\n",
- "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 1401 rotamers at 76 positions.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.163419 seconds to load from binary\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 1518 rotamers at 76 positions.\n",
"\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
"\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadManager: {?} \u001b[0mCreating a thread pool of 1 threads.\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadPool: {?} \u001b[0mLaunched 0 new threads.\n",
"\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
"\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n"
]
@@ -263,7 +325,7 @@
},
{
"cell_type": "code",
- "execution_count": 13,
+ "execution_count": 6,
"metadata": {},
"outputs": [
{
@@ -272,7 +334,7 @@
"True"
]
},
- "execution_count": 13,
+ "execution_count": 6,
"metadata": {},
"output_type": "execute_result"
}
@@ -284,7 +346,7 @@
},
{
"cell_type": "code",
- "execution_count": 14,
+ "execution_count": 7,
"metadata": {},
"outputs": [
{
@@ -293,7 +355,7 @@
"2.3640114111461292"
]
},
- "execution_count": 14,
+ "execution_count": 7,
"metadata": {},
"output_type": "execute_result"
}
@@ -326,20 +388,20 @@
},
{
"cell_type": "code",
- "execution_count": 65,
+ "execution_count": 8,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release 2021.18+release.54b4909cd528ede1d749ea69e8046c244fc797f2 2021-05-04T21:04:43] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
"\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release r282 2021.18+release.54b4909cd52 54b4909cd528ede1d749ea69e8046c244fc797f2 http://www.pyrosetta.org 2021-05-04T21:04:43\n",
- "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.6/site-packages/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=570318775 seed_offset=0 real_seed=570318775 thread_index=0\n",
- "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=570318775 RG_type=mt19937\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=304941111 seed_offset=0 real_seed=304941111 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=304941111 RG_type=mt19937\n",
"\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
"Atom Type: Nlys\n",
"\telement: N\n",
@@ -361,10 +423,10 @@
"pose = pose_from_pdb(\"./data/1ubq_clean.pdb\")\n",
"\n",
"# 获取atom type基本信息:\n",
- "atom_NZ_index = res11.atom_index(\"NZ\")\n",
+ "atom_NZ_index = pose.residue(11).atom_index(\"NZ\")\n",
"\n",
"# 获取1号原子的atomtype所有的信息:\n",
- "atom_type = res11.atom_type(atom_NZ_index)\n",
+ "atom_type = pose.residue(11).atom_type(atom_NZ_index)\n",
"print(atom_type)"
]
},
@@ -372,12 +434,12 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "上述例子可以成功找到某个PDB中原子的名成对应的Rosetta Atom Type, 11号赖氨酸的NZ原子的AtomType为Nlys。"
+ "上述例子可以成功找到某个PDB中原子的名称对应的Rosetta Atom Type, 11号赖氨酸的NZ原子的AtomType为Nlys。"
]
},
{
"cell_type": "code",
- "execution_count": 66,
+ "execution_count": 9,
"metadata": {},
"outputs": [
{
@@ -398,7 +460,7 @@
},
{
"cell_type": "code",
- "execution_count": 67,
+ "execution_count": 10,
"metadata": {},
"outputs": [
{
@@ -407,7 +469,7 @@
"False"
]
},
- "execution_count": 67,
+ "execution_count": 10,
"metadata": {},
"output_type": "execute_result"
}
@@ -415,6 +477,21 @@
"source": [
"distance_filter.apply(pose)"
]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "**结语**\n",
+ "在PyRosetta中，Filter并不能决定程序的终止与否。因此和SimpleMetric等都可视为计算器，不同的是，SimpleMetric返回的是计算缓存结果，Filter的apply函数返回的是真与否。如果需要获取计算数值，在filter中应该使用score()或compute()函数。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
}
],
"metadata": {
@@ -433,7 +510,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/8_Filter/8_2_Filter_api.ipynb b/8_Filter/8_2_Filter_api.ipynb
deleted file mode 100644
index 551efc5..0000000
--- a/8_Filter/8_2_Filter_api.ipynb
+++ /dev/null
@@ -1,1706 +0,0 @@
-{
- "cells": [
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "# Filter in Pyrosetta (API)\n",
- "\n",
- "@Author: 黄健\n",
- "@E-mail: jian.huang@xtalpi.com\n",
- "\n",
- "@Proofread: 吴炜坤\n",
- "@email：weikun.wu@xtalpi.com\n",
- "\n",
- "更多参考:\n",
- "https://new.rosettacommons.org/docs/latest/scripting_documentation/RosettaScripts/Filters/Filters-RosettaScripts\n",
- "\n",
- "\n",
- "\n",
- "本章节将详细介绍Pyrosetta中一些常用的filter的使用，并给出示例。请读者根据自己需求，需要使用时进行查询即可。"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 1,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.Release.python36.ubuntu 2020.28+release.8ecab77aa50ac1301efe53641e07e09ac91fee3b 2020-07-07T16:41:06] retrieved from: http://www.pyrosetta.org\n",
- "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
- "\u001b[0mcore.init: \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: \u001b[0mRosetta version: PyRosetta4.Release.python36.ubuntu r260 2020.28+release.8ecab77aa50 8ecab77aa50ac1301efe53641e07e09ac91fee3b http://www.pyrosetta.org 2020-07-07T16:41:06\n",
- "\u001b[0mcore.init: \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-545887235 seed_offset=0 real_seed=-545887235\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0mRandomGenerator:init: Normal mode, seed=-545887235 RG_type=mt19937\n"
- ]
- }
- ],
- "source": [
- "from pyrosetta.rosetta.protocols.rosetta_scripts import *\n",
- "from pyrosetta import *\n",
- "init()"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 2,
- "metadata": {},
- "outputs": [],
- "source": [
- "# 定义一个模板函数，让我们可以很方便创建各种filter的RS\n",
- "def generate_filter_RS(residue_selector_str:str=\"\", simple_metric_str:str=\"\", filter_definition_str:str=\"\", protocol_definition_str:str=\"\"):\n",
- " filter_template = \\\n",
- " \"\"\"\n",
- " \n",
- " \n",
- " \n",
- " \n",
- " {}\n",
- " \n",
- " \n",
- " \n",
- " \n",
- " {}\n",
- " \n",
- " \n",
- " {}\n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " {}\n",
- " \n",
- " \n",
- " \n",
- " \"\"\".format(residue_selector_str, simple_metric_str, filter_definition_str, protocol_definition_str)\n",
- " return filter_template"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 1. SimpleMetricFilter -- 衍生于SimpleMetric的Filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "```\n",
- "\n",
- " \n",
- "\n",
- "```\n",
- "\n",
- "1. epsilon: epsilon for numerical comparisons\n",
- "2. metric:在SIMPLE_METRICS中定义的SimpleMetric\n",
- "3. comparison_type：比较类型，可选 “nq”：not equal；“eq”： equal etc, choices are [eq, gt, gt_or_eq, lt, lt_or_eq, ne]\n",
- "4. composite_action:Composite Metrics的一个额外选项，可选：any，all，metric_name\n",
- "5. cutoff： filter用以判定是否通过的数值\n",
- "6. match： filter用以判定是否通过的string类型，针对StringMetric和CompositeStringMetric\n",
- "7. use_sum_for_per_residue_real：在使用PerResidueRealMetric可设置为Ture，使用总体的值作为判定\n",
- "8. use_cached_data：使用缓存数据。Metric的数据缓存在SimpleMetric的Mover-RunSimpleMetrics运行之后。\n",
- "9. cache_prefix： 若use_cached_data为True，则指明RunSimpleMetrics的前缀\n",
- "10. cache_suffix： 若use_cached_data为True，则指明RunSimpleMetrics的后缀\n",
- "11. fail_on_missing_cache：若use_cached_data为True但有没有找到缓存数据，是否报告失败\n",
- "12. confidence：若一个pose没有通过filter，有多大几率被过滤掉。Rosetta中所有Filter的默认值均为1。"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 22,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n"
- ]
- }
- ],
- "source": [
- "# 使用layer选择器选取表面层的残基\n",
- "residue_selector_definition_1 = ''\n",
- "\n",
- "# 注意simpleMetric定义中指定selector对象名字与选择器中保持一致\n",
- "simple_metric_definition_1 = ''\n",
- "\n",
- "# 定义filter层：这里展示了溶剂可表面的metric的filter的例子。其他的simpleMetric请参考相关章节\n",
- "simple_metric_filter_definition_1 = ''\n",
- "\n",
- "# 在protocol层添加该filter\n",
- "protocol_definition_1 = ''\n",
- "\n",
- "simpleMetricFilter_example = generate_filter_RS(residue_selector_definition_1,simple_metric_definition_1,simple_metric_filter_definition_1, protocol_definition_1)\n",
- "\n",
- "print(simpleMetricFilter_example)"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 23,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
- "\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSet cutoffs for core and surface to 5.2 and 2, respectively, in LayerSelector.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting core=false boundary=false surface=true in LayerSelector.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSet cutoffs for core and surface to 4 and 2, respectively, in LayerSelector.\n",
- "\u001b[0mcore.select.residue_selector.util: \u001b[0mFound residue selector surfacelayer\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined filter named \"sasa_filter\" of type SimpleMetricFilter\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"NULL_MOVER\" with filter \"sasa_filter\"\n"
- ]
- }
- ],
- "source": [
- "xml_simpleMetricFilter = XmlObjects.create_from_string(simpleMetricFilter_example)"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 25,
- "metadata": {},
- "outputs": [],
- "source": [
- "simpleMetricFilter = xml_simpleMetricFilter.get_filter(\"sasa_filter\")\n",
- "\n",
- "# apply to pose\n",
- "# simpleMetricFilter.apply(pose)\n",
- "# simpleMetricFilter.score(pose)"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 2. 基本的Filter类型 -- ResidueCount和NetCharge"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "ResidueCount：基于残基总数的过滤器，其官方完整定义如下：\n",
- "\n",
- "```\n",
- "\n",
- "```\n",
- "1. residue_types: 逗号分隔的残基类型名字的列表，如\"CYS,SER,HIS_D\"，只有在列表中的残基会被记数\n",
- "2. include_property（未展示）：逗号分隔的性质列表，如\"HYDROPHOBIC,ALIPHATIC\"，只有在列表中的性质的残基会被记数\n",
- "3. max_residue_count：计数残基的总数最大允许值\n",
- "4. min_residue_count：计数残基的总数最小允许值\n",
- "5. count_as_percentage：设定为True表示使用百分数占比(=100*raw_number_of_specified_residue/total_residue)表示，而非计数总数\n",
- "6. residue_selector：残基选择器，选定计数范围\n",
- "7. task_operations：指定计数残基的子集，默认仅计数可设计的残基\n",
- "8. packable：T/F，计数在task_operations中允许repack的残基\n",
- "\n",
- "NetCharge：基于蛋白总电荷值的过滤器，其官方完整定义如下：\n",
- "\n",
- "```\n",
- "\n",
- "```\n",
- "1. min：最少净电荷（默认-100）\n",
- "2. max：最大净电荷（默认100）\n",
- "3. chain：指定那一条链作为电荷计数的链（从PDB文件头到尾，依次为1，2，3...）默认为0，计数所有chain的电荷\n",
- "4. task_operations：在task_operations指定可设计的残基的电荷计数，不可设计的残基不再计数\n",
- "\n",
- "NetCharge设定LYS和ARG残基电荷值为+1，酸性残基ASP和GLU电荷值为-1。\n",
- "\n",
- "**注意若不显式设置task_operations，rosetta会默认所有残基均可设计**\n"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 31,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n"
- ]
- }
- ],
- "source": [
- "# 使用layer选择器选取表面层的残基\n",
- "residue_selector_definition = ''\n",
- "\n",
- "# 定义filter层\n",
- "residue_count_filter_definition = ''\n",
- "\n",
- "# 在protocol层添加该filter\n",
- "residue_count_protocol_definition = ''\n",
- "\n",
- "residue_count_Filter = generate_filter_RS(residue_selector_definition_1,\"\",residue_count_filter_definition, residue_count_protocol_definition)\n",
- "\n",
- "print(residue_count_Filter)"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 32,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
- "\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSet cutoffs for core and surface to 5.2 and 2, respectively, in LayerSelector.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting core=false boundary=false surface=true in LayerSelector.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSet cutoffs for core and surface to 4 and 2, respectively, in LayerSelector.\n",
- "\u001b[0mprotocols.simple_filters.ResidueCountFilter: \u001b[0mResidue types specified: [CYS]\n",
- "\u001b[0mcore.select.residue_selector.util: \u001b[0mFound residue selector surfacelayer\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined filter named \"residue_count\" of type ResidueCount\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"NULL_MOVER\" with filter \"residue_count\"\n"
- ]
- }
- ],
- "source": [
- "residue_count_xml = XmlObjects.create_from_string(residue_count_Filter)\n",
- "residue_count_filter = xml_simpleMetricFilter.get_filter(\"sasa_filter\")\n",
- "\n",
- "# apply to pose\n",
- "# residue_count_filter.apply(pose)\n",
- "# residue_count_filter.score(pose)"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 33,
- "metadata": {},
- "outputs": [],
- "source": [
- "# 使用layer选择器选取表面层的残基\n",
- "residue_selector_definition = ''\n",
- "\n",
- "# 定义filter层\n",
- "netcharge_filter_definition = ''\n",
- "\n",
- "# 在protocol层添加该filter\n",
- "netcharge_protocol_definition = ''\n",
- "\n",
- "netcharge_Filter = generate_filter_RS(residue_selector_definition,\"\",netcharge_filter_definition, netcharge_protocol_definition)\n",
- "\n",
- "# print(netcharge_Filter)"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 35,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
- "\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSet cutoffs for core and surface to 5.2 and 2, respectively, in LayerSelector.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting core=false boundary=false surface=true in LayerSelector.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSet cutoffs for core and surface to 4 and 2, respectively, in LayerSelector.\n",
- "\u001b[0mprotocols.simple_filters.NetChargeFilter: \u001b[0mNet charge will be caculated for chain 0 with maximum cutoff 5 and minimum cutoff 0.\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined filter named \"netcharge\" of type NetCharge\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"NULL_MOVER\" with filter \"netcharge\"\n"
- ]
- }
- ],
- "source": [
- "netcharge_xml = XmlObjects.create_from_string(netcharge_Filter)\n",
- "netcharge_filter = netcharge_xml.get_filter(\"netcharge\")\n",
- "\n",
- "# apply to pose\n",
- "# residue_count_filter.apply(pose)\n",
- "# residue_count_filter.score(pose)"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 3. 与能量项或打分相关的Filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "这一类的Filter包括：\n",
- "\n",
- "**ScoreType**：基于某特定打分项的Filter\n",
- "```\n",
- "\n",
- "```\n",
- "1. score_type：某打分项。若缺省，则以总得分作为filter\n",
- "2. threshold：必要参数，若能量值低于该值，返回True\n",
- "3. scorefxn：指定打分函数的名字（在SCOREFXNS标签下应先定义）\n",
- "\n",
- "**TaskAwareScoreType**：对可以pack的残基部分的打分的Filter\n",
- "```\n",
- "\n",
- "```\n",
- "1. task_operations：设定repack残基的task operations\n",
- "2. scorefxn：指定打分函数的名字（在SCOREFXNS标签下应先定义），默认为score12\n",
- "3. score_type：打分项\n",
- "4. threshold：必要参数，若能量值低于该值，返回True。若设定mode为“individual”，则每一个残基都需要通过该阈值\n",
- "5. mode：可选\"total\", \"average\", or \"individual\"\n",
- "\n",
- "**BindingStrain**：在结合态的单体的能量张力的Filter\n",
- "```\n",
- "\n",
- "```\n",
- "1. threshold：必要参数，允许多大能量张力\n",
- "2. task_operations：设定repack残基的task operations\n",
- "3. scorefxn：用来repack的打分函数\n",
- "4. relax_mover：在unbound state 进行repack之后，下面需要使用何种mover进行relax（MinMover）\n",
- "**ConstraintScore**：从ConstraintGenerators产生的一系列constraints计算的打分项的Filter\n",
- "```\n",
- "\n",
- "```\n",
- "1. constraint_generators：constraint generators的名字，需要使用AddConstraints进行事先定义\n",
- "2. threshold：必要参数，允许多大能量值\n",
- "**Delta**：计算filter中的值与input结构能量差值\n",
- "```\n",
- "\n",
- "```\n",
- "1. upper/lower：设定阈值为最低阈值还是最高阈值\n",
- "2. range：允许高出或低于基线多大范围\n",
- "3. filter：提前定义的filter的名字，用以评估能量项\n",
- "4. unbound：平移其他构象partner10000A，再进行评估\n",
- "5. jump：与unbound结合起来使用，指定平移对象\n",
- "6. relax_mover: 在设定baseline之前先进行的relax操作，尽量使能量更低\n",
- "**EnergyPerResidue**：基于某特定残基选择部分的能量项的Filter\n",
- "```\n",
- "\"\n",
- "```\n",
- "1. pdb_num/res_num：基于PDB或Rosetta编号的选取\n",
- "**ReadPoseExtraScoreFilter**：提取早前储存在pose中的打分项，可以用来提取FilterReportAsPoseExtraScoresMover保存的打分记录\n",
- "```\n",
- "\n",
- "```\n",
- "1. term_name：需要与可以用来提取FilterReportAsPoseExtraScoresMover中的report_as选项定义保持一致\n",
- "**Residue Interaction Energy**：在界面上的特定残基的相互作用打分。计算特定残基在界面（interface=1）或整体pose（interface=0）的相互作用能量。而后如果相互作用得分高于cutoff值，给予惩罚penalty = sum (IE(res)-(cutoff))。\n",
- "```\n",
- "\n",
- "```\n",
- "**ResidueSetChainEnergy**:残基集合的能量filter（可以是链或者某selection）\n",
- "```\n",
- "\n",
- "```\n",
- "计算两组残基集合之间的相互作用能量。Group1使用resnum定义（兼容PDB编号和Rosetta编号），Group2由chain定义，使用rosetta chain编号定义。\n",
- "**ScorePoseSegmentFromResidueSelectorFilter**：通过残基选择器（ResidueSelector）选取的部分的得分。\n",
- "```\n",
- "\n",
- "```\n",
- "1. in_context:在打分前不单独区分selection\n",
- "2. residue_selector:必要选项，指定事先定义的selector的名字，也可以使用逻辑符AND, NOT, OR。"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 39,
- "metadata": {},
- "outputs": [],
- "source": [
- "# 此处仅以第一个ScoreType为例\n",
- "\n",
- "# 使用layer选择器选取表面层的残基\n",
- "residue_selector_definition = ''\n",
- "\n",
- "# 定义filter层，这里没有指定scorefnx，将使用默认ref2015打分函数\n",
- "scoretype_filter_definition = ''\n",
- "\n",
- "# 在protocol层添加该filter\n",
- "scoretype_protocol_definition = ''\n",
- "\n",
- "scoretype_Filter = generate_filter_RS(residue_selector_definition,\"\",scoretype_filter_definition, scoretype_protocol_definition)\n",
- "\n",
- "# print(scoretype_Filter)"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 40,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
- "\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSet cutoffs for core and surface to 5.2 and 2, respectively, in LayerSelector.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting core=false boundary=false surface=true in LayerSelector.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
- "\u001b[0mcore.select.residue_selector.LayerSelector: \u001b[0mSet cutoffs for core and surface to 4 and 2, respectively, in LayerSelector.\n",
- "\u001b[0mprotocols.simple_filters.ScoreTypeFilter: \u001b[0mScoreType filter for score_type fa_atr with threshold 0.5.\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined filter named \"scoretype\" of type ScoreType\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"NULL_MOVER\" with filter \"scoretype\"\n"
- ]
- }
- ],
- "source": [
- "scoretype_xml = XmlObjects.create_from_string(scoretype_Filter)\n",
- "scoretype_filter = scoretype_xml.get_filter(\"scoretype\")\n",
- "\n",
- "# apply to pose\n",
- "# residue_count_filter.apply(pose)\n",
- "# residue_count_filter.score(pose)"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 4. 距离相关的Filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "在第一节中我们学习了AtomicDistance filter进行两个原子之间距离的计算和设置过滤条件。关于距离的Filter还有以下几种：\n",
- "\n",
- "**ResidueDistance**：残基距离，以每个残疾的邻原子作为计算（通常为C-β原子）\n",
- "```\n",
- "\n",
- "```\n",
- "1. 这里可以使用rosetta编号和pdb编号，选择其一即可。\n",
- "**AtomicContact**：两个残基是否存在任何一对原子距离在设定的cutoff内？\n",
- "```\n",
- "\n",
- "```\n",
- "1. 用户可以指定sidechain，backbone，protons指定计算距离对的范围\n",
- "**AtomicContactCount**：在指定残基之间计算侧链C原子与C原子的距离是否在设定cutoff内\n",
- "```\n",
- "\"All\" mode:\n",
- "\n",
- "\n",
- "\"jump\" mode\n",
- "\n",
- "\n",
- "\"chain\" mode\n",
- "\n",
- "```\n",
- "在给定task operations定义可以pack的残基中依次迭代计算所有侧链间C原子间的距离（若没有指定task operations，默认使用所有残基）。可以被限制为计算jump间的contact或chain之间的contact（jump mode或chain mode）\n",
- "**TerminusDistance**：如果所有表面残基离N或C端距离长于n个残基，即pass/True，返回1000。False，则返回距离短于n个残基的残基距离末端的距离。\n",
- "```\n",
- "\n",
- "```"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "*关于距离的示例请参考本章第一节内容，在此不再赘述*"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 5. 基于序列分析的Filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**LongestContinuousPolarSegment**: 基于极性氨基酸残基最大长度的Filter\n",
- "```\n",
- "\n",
- "```\n",
- "1. exclude_chain_termini： false表示极性区域能够延展到N端或C端的将被计算；true表示不被计算（默认为true，仅内部的极性残基块被计算）\n",
- "2. count_gly_as_polar： true表示gly会被考虑为极性氨基酸，（默认为true）\n",
- "3. filter_out_high ：true表示高于cutoff设定值的极性残基长度的pose会被reject掉；false表示低于cutoff会被reject（默认为true）\n",
- "4. cutoff：最长极性残基长度的阈值，默认值为5\n",
- "5. residue_selector：氨基酸选择器，应预先定义\n",
- "**LongestContinuousApolarSegment**：基于非极性氨基酸残基最大长度的Filter。*rosetta中默认定义ACFGILMPVWY为极性，其余为非极性残基*。\n",
- "默认该filter将reject掉那些含有最大非极性残基长度超过设定cutoff值的pose。\n",
- "```\n",
- "\n",
- "```\n",
- "选项跟上一个基本类似，不再赘述。\n",
- "**SequenceDistanceFilter**：基于pose序列和pose的comment中储存序列的突变的数目的Filter。计算当前pose序列与pose comments中储存的一个序列或是使用target_sequence指定的序列之间的hamming距离\n",
- "```\n",
- "< SequenceDistance name=(string)\n",
- " sequence_comment_id=(string,\"true\")\n",
- " target_sequence=(string,\"true\")\n",
- " threshold=(int,\"8000\") \n",
- " confidence=(real,\"1.0\")\n",
- "/>\n",
- "```\n",
- "1. sequence_comment_id： comment id， 需要从pose的comment该id中载入序列。通常会先用SaveSequenceToComments保存一个comment sequence\n",
- "2. target_sequence：用于与pose序列对比的氨基酸序列\n",
- "3. threshold： 最大hamming distance，默认值为8000"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 3,
- "metadata": {},
- "outputs": [],
- "source": [
- "def generate_filter_RS_2(residue_selector_str:str=\"\", simple_metric_str:str=\"\", filter_definition_str:str=\"\", mover_definition_str:str=\"\", protocol_definition_str:str=\"\"):\n",
- " filter_template = \\\n",
- " \"\"\"\n",
- " \n",
- " \n",
- " \n",
- " \n",
- " {}\n",
- " \n",
- " \n",
- " \n",
- " \n",
- " {}\n",
- " \n",
- " \n",
- " {}\n",
- " \n",
- " \n",
- " {}\n",
- " \n",
- " \n",
- " \n",
- " \n",
- " {}\n",
- " \n",
- " \n",
- " \n",
- " \"\"\".format(residue_selector_str, simple_metric_str, filter_definition_str, mover_definition_str, protocol_definition_str)\n",
- " return filter_template"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 19,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n",
- " \n"
- ]
- }
- ],
- "source": [
- "# 写入一个允许design的Packing Mover\n",
- "sequence_distance_mover_definition = ' \\\n",
- " '\n",
- "\n",
- "# 定义filter层，这里没有指定scorefnx，将使用默认ref2015打分函数\n",
- "sequence_distance_filter_definition = ''\n",
- "\n",
- "# 在protocol层添加该filter\n",
- "sequence_distance_protocol_definition = ' \\\n",
- " \\\n",
- " '\n",
- "\n",
- "sequence_distance_Filter = generate_filter_RS_2(\"\",\"\",sequence_distance_filter_definition, sequence_distance_mover_definition, sequence_distance_protocol_definition)\n",
- "\n",
- "print(sequence_distance_Filter)"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 13,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
- ]
- }
- ],
- "source": [
- "original_pose = pose_from_pdb(\"./data/1ubq_clean.pdb\")\n",
- "\n",
- "pose = original_pose.clone()"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 20,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
- "\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\t\n",
- "\t\t\n",
- "\t\t\n",
- "\t\t\n",
- "\t\n",
- "\t\n",
- "\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined filter named \"sequence_distance\" of type SequenceDistance\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"save_sequence_to_comment\" of type SaveSequenceToCommentsMover\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"pack1\" of type PackRotamersMover\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"save_sequence_to_comment\" with filter \"true_filter\"\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"pack1\" with filter \"true_filter\"\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"NULL_MOVER\" with filter \"sequence_distance\"\n"
- ]
- }
- ],
- "source": [
- "sequence_distance_xml = XmlObjects.create_from_string(sequence_distance_Filter)\n",
- "sequence_distance_filter = sequence_distance_xml.get_filter(\"sequence_distance\")"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": 23,
- "metadata": {},
- "outputs": [
- {
- "name": "stdout",
- "output_type": "stream",
- "text": [
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
- "\u001b[0mcore.scoring.elec.util: \u001b[0mRead 40 countpair representative atoms\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mBinary rotamer library selected: /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mUsing Dunbrack library binary file '/home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mDunbrack 2010 library took 0.234375 seconds to load from binary\n",
- "\u001b[0mcore.pack.pack_rotamers: \u001b[0mbuilt 18755 rotamers at 76 positions.\n",
- "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: \u001b[0mInstantiating PDInteractionGraph\n",
- "\u001b[0mprotocols.simple_filters.SequenceDistance: \u001b[0mSequence distance reports 72 mutations.\n"
- ]
- },
- {
- "data": {
- "text/plain": [
- "False"
- ]
- },
- "execution_count": 23,
- "metadata": {},
- "output_type": "execute_result"
- }
- ],
- "source": [
- "# 按照protocol依次apply\n",
- "save_sequence_filter = sequence_distance_xml.get_mover(\"save_sequence_to_comment\")\n",
- "save_sequence_filter.apply(pose)\n",
- "\n",
- "# this step is going to take a long time to finish\n",
- "packer = sequence_distance_xml.get_mover(\"pack1\")\n",
- "packer.apply(pose)\n",
- "\n",
- "sequence_distance_filter.apply(pose)"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 6. 基于Alignment分析的Filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**AlignmentAAFinder**：对一个alignment进行扫描，在每个位点测试所有可能的氨基酸，生成通过的氨基酸的文件。\n",
- "扫描一个pose序列的所有位点，并测试那些同源序列中的氨基酸替代是否能够适应到当前pose中\n",
- "```\n",
- "< AlignmentAAFinder name=\"(&string)\" \n",
- " scorefxn=\"(beta_nov16 &string)\" \n",
- " exclude_AA_threshold=\"(10.0 &float)\" \n",
- " alignment_file=\"(null &string)\" \n",
- " loop_seqid_threshold=\"(0.50 &float)\" \n",
- " indel_motif_radius=\"(2 &int)\" \n",
- " available_AAs_file=\"(null &string)\"\n",
- "/>\n",
- "```\n",
- "1. exclude_AA_threshold：用于决定一个同源氨基酸位点替代后是否fit的能量阈值\n",
- "2. loop_seqid_threshold：loop区域的氨基酸相似度的阈值\n",
- "3. indel_motif_radius： indel motif半径\n",
- "4. available_AAs_file：输出文件路径\n",
- "**AlignmentGapInserter**：扫描一个alignment，在那些不能代表pose序列化学环境的位点插入gap\n",
- "一般而言，读取由AlignmentAAFinder产生的available_AAs_file，其中包含了所有能够fit到pose序列的各个位点氨基酸信息。依次迭代所有的align的序列，联合到pose的序列中（忽略插入并用gly替代gap），判断化学环境是否变化。\n",
- "```\n",
- "< AlignmentGapInserterFilter name=\"(&string)\" \n",
- " scorefxn=\"(beta_nov16 &string)\" \n",
- " nbr_e_threshold=\"(0.1 &float)\" \n",
- " indel_motif_radius=\"(2 &int)\" \n",
- " alignment_file=\"(null &string)\" \n",
- " available_AAs_file=\"(null &string)\"\n",
- " cleaned_alignment_file=\"(null &string)\"\n",
- " loop_seqid_threshold=\"(comma separated floats)\" \n",
- " max_score_diffs=\"(comma separated floats)\"\n",
- " only_clean_seq_num=\"(null &int)\"\n",
- "/>\n",
- "```\n",
- "1. nbr_e_threshold： 用于定义临近残基的绝对能量值（res-res-energy）\n",
- "2. cleaned_alignment_file： output alignment"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 7. Geometry相关Filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**AngleToVector**：计算一条链第一个氨基酸的两个原子或一个预先定义矢量的原子间的角度。其目的是测试一个小分子是否以正确角度结合在蛋白的口袋中。\n",
- "```\n",
- "\n",
- "```\n",
- "1. atm1 atm2 为用于计算方向矢量的两个原子，例如 “CA” “NE”等\n",
- "2. chain：ligand所在的链\n",
- "3. refx, refy, refz：参照矢量的x，y，z坐标，该矢量在计算角度之前会先被归一化\n",
- "其过程是：先计算两个原子之间的是矢量，然后计算这个矢量与参照矢量之间的角度\n",
- "\n",
- "**Torsion**：基于二面角的Filter\n",
- "```\n",
- "\n",
- "```\n",
- "1. lower和upper:最低阈值、最高阈值\n",
- "2. resnum：pdb或rosetta numbering\n",
- "3. torsion：phi、psi、“”\n",
- "4. task_operations：输出的residue可以是在task_operations定义过的那些残基，所有可以design的残基将被输出。不能同时使用task_operations和resnnum两个选项！\n",
- "不设置torsion选项将会输出所有phi和psi；不设置resnum会report所有残基。\n",
- "\n",
- "**HelixPairing**：基于helix成对的几何性质的Filter\n",
- "该filter首先计算一个pose的二级结构，然后利用二级结构去找到螺旋部分。对于螺旋pairing，该filter提供三个参数，dist，cross和align，一个pose的这些参数低于设定阈值的话将被reject掉。\n",
- "```\n",
- "\n",
- "```\n",
- "\n",
- "1. secstruct：使用给定的二级结构定义强制到当前pose，且用于搜索helices。二级结构长度必须与pose序列一致\n",
- "2. use_dssp：使用dssp算法计算二级结构\n",
- "3. helix_pairings：若给定，则给定的成对helics将作为filter条件。helic number用数字表示，两个螺旋间“-”连接，A和P表示平行方向，如 1-2.A;2-3.A;1-3.P\n",
- "4. dist：成对螺旋的各自中点间的距离\n",
- "5. cross：helix矢量之间的角度。helix矢量即螺旋的C端和N端中心形成的矢量\n",
- "6. align： helix矢量投影到该helices之前的strand形成的beta sheet上之间的角度\n",
- "7. bend：检查螺旋内部bend的程度\n",
- "8. output_id：输出到score file中的成对helix的id\n",
- "9. output_type：输出到score file中的参数类型：dist, cross, or align\n",
- "10. blueprint：用于设定所需pose二级结构的蓝图文件\n",
- "\n",
- "**SSMotifFinder**：基于loop主干骨架几何性质的filter。计算主干骨架几何性质与模板loop主干的相似度。该filter会在一级序列一一定长度氨基酸分隔的两个残基之间搜索，以一定RMSD cutoff值重叠模板loop的骨架原子。RMSD计算会包括主干区骨架重原子以及前后6个残基。输出为一个包含所有成对主干的pairs和特定RMSD cutoff，并给出RMSD。\n",
- "```\n",
- "\n",
- "```\n",
- "**SecondaryStructure**：基于二级结构的Filter。比较pose的二级结构与理想定义二级结构。报告N_MATCHING / N_TOTAL的值，N_MATCHING 为选取部分的残基中有多少与定义理想的二级结构一致，N_TOTAL 为选取的残基总数。若compute_pose_secstruct_by_dssp 选项为false（默认为false），必须实现为pose计算二级结构信息，例如使用DsspMover；设定为true则会自动调用DSSP计算pose二级结构。\n",
- "```\n",
- "\n",
- "```\n",
- "1. residue_selector：氨基酸选择器，预先定义\n",
- "2. ss：提供理想二级结构字符串描述，比如“HHHHHLLLHHHHH”，其长度必须与pose中氨基酸数目保持一致\n",
- "3. use_dssp：false表示使用pose中储存的二级结构（如果有的话），true表示使用DSSP计算\n",
- "4. blueprint：用于设定所需pose二级结构的蓝图文件（不要与ss选项混用，Override）\n",
- "5. abego：所需的abego值，如\"XAAAAGBABBBB\"，长度必须与pose氨基酸数目一致\n",
- "6. use_abego：0 or 1. true表示二级结构需要match在abego选项中定义的string描述。\n",
- "7. threshold：必须至少match二级结构的分数。默认为1，即全部match才会通过该filter\n",
- ">Secondary Structure specification :\n",
- ">\n",
- ">E: sheet\n",
- ">\n",
- ">H: helix\n",
- ">\n",
- ">h: not helix (so either E or L)\n",
- ">\n",
- ">L: loop\n",
- ">\n",
- ">D: wildcard (allows anything)\n",
- "\n",
- "```\n",
- "使用蓝图文件\n",
- "\n",
- "\n",
- "使用ss字段\n",
- "\n",
- " \n",
- "\n",
- "\n",
- " \n",
- "\n",
- "\n",
- " \n",
- " \n",
- "\n",
- "```\n",
- "\n",
- "**SecondaryStructureCount**：基于单个二级结构元件计数的filter。计算给定类型的DSSP定义的二级结构的类型的数目。\n",
- "```\n",
- "\n",
- "```\n",
- "1. filter_helix, filter_sheet, filter_loop: true 分别表示在helix，sheet，loop二级结构上进行过滤\n",
- "2. filter_helix_sheet：filter on helix and sheet\n",
- "3. num_helix，num_sheet，num_loop，num_helix_sheet：需要多少数目的对应二级结构才能通过该filter\n",
- "4. min_helix_length，max_helix_length：最少和最大的helix氨基酸数目才会被当作一个helix，默认值4和9999\n",
- "5. min_sheet_length，max_sheet_length，min_loop_length，max_loop_length与上一条类似\n",
- "6. return_total：true表示将过滤的二级结构元件的总数目记录到score文件。默认为0.\n",
- "7. residue_selector：氨基酸选择器\n",
- "8. min_element_resis：一个二级结构原件的最少残基数目（作为计数基础），默认为1.\n",
- "\n",
- "**SecondaryStructureHasResidue**：计算二级结构元件部分位点是否含有N个或更多的某特定残基。在de novo设计中，用于检查各个二级结构是否存在至少一个疏水残基等用途。\n",
- "```\n",
- "\n",
- "```\n",
- "1. secstruct_fraction_threshold:被考虑计算在内的二级结构元件的分数（检查是否存在N个或更多的指定残基）\n",
- "2. res_check_task_operations：指定哪些残基用于检查正确的残基类型\n",
- "3. ss_select_task_operations：用于检查的已存在二级结构元件的残基\n",
- "4. required_restypes：默认为非ALA的疏水类型，使用氨基酸的单字母缩写即可\n",
- "5. nres_required_per_secstruct：默认仅需一个残基存在在一个二级结构元件，作为pass\n",
- "6. filter_helix/sheet/loop：yes/no 是否考虑这些二级结构类型\n",
- "\n",
- "**HelixKink**：基于helix拓扑结构的filter\n",
- "```\n",
- "\n",
- "```\n",
- "1. bend: helix扭曲角度的cutoff值\n",
- "2. resnums：逗号分隔的残基列表，任何helix含有该列表中的残基的都会被扫描计算。默认扫描整个蛋白\n",
- "3. helix_start 和helix_end 可以申明一个连续helix被考虑的起始和终止范围，如此符合要求的helix才会被计算。默认为1（用户需要设置该值！）\n",
- "\n",
- "**Geometry**：基于键的几何性质和omega角度的constraint的filter\n",
- "```\n",
- "\n",
- "```\n",
- "1. omega: 肽键平面的omega角度的cutoff值，Cis-Pro也会被考虑\n",
- "2. cart_bonded：键角和键长的惩罚分数\n",
- "3. cstfile：给定constraint 文件，并使用该文件中的限制施加给pose。仅成对原子的constraint会被使用。constraint 打分将会被检查是否低于设定的cst_cutoff值，超过了即fail\n",
- "3. cst_off: cstfile的附加选项\n",
- "4. start，end：起始和终止的残基numbering\n",
- "5. residue_selector：残基选择器，仅在该选择部分进行filter\n",
- "6. count_bad_residues：true表示报告没有通过该filter的残基数目（report_sm）；false表示filter score为0或1（所有残基都失败/成功）\n",
- "\n",
- "**HSSTriplet**：评估给定的helix-strand-strand三联（HSS triplet）结构。计算strand pair与helix之间的距离以及sheet平面和helix之间的角度。若距离计算值处于min_dist和max_dist选项设定值且角度计算值处于min_angle和max_angle选项设定值，则返回true。也可以基于output_id和output_type给出数值。\n",
- "```\n",
- "\n",
- "```\n",
- "1. hsstriplets：描述HSS triplet的字符串。该选项或者blueprint 蓝图文件必须有一个被指定，且不能同时被指定。格式为i,j-k，i为整数表示helix的编号，j为strand1的编号（从N端到C端），k是strand2的编号\n",
- "2. blueprint：二级结构的蓝图文件，需要包含HSS信息\n",
- "\n",
- "**PreProlineFilter**：基于脯氨酸前一个残基的不合理扭转角的filter\n",
- "```\n",
- "\n",
- "```\n",
- "螺旋空间（Abego，ABEGO type A）在pro之前一般不倾向形成，但rosetta可能捕捉不到该信息。在默认模式下，该filter会检查所有pro残基之前的所有残基，计算那些非B类型和非E类型（越少越好）。\n",
- "1. use_statistical_potential：true表示使用基于拉式图构象空间bicublic spline fit会被用来评估该扭转角。false表示使用不合理扭转角的bin范围内的残基被计数\n",
- "\n",
- "**LoopAnalyzerFilter**：使用 LoopAnalyzerMover 计算与loop相关的一些metrics\n",
- "```\n",
- "\n",
- " \n",
- "\n",
- "```\n",
- "1. 亚标签loop可以进一步详细定义loop\n",
- "2. loops_file：可以传入文件\n",
- "3. use_tracer：false表示结果在每次运行结束储存在PoseExtraScores / DataCache中；true表示结果打印到tracer对象中\n"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 8. Packing/Connectivity相关Filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**CavityVolume**：用于计算蛋白内部空腔体积，总是返回true。使用will sheffler的packing代码（packstat）计算蛋白内部空腔的体积大小，单位Angstrom^3。20大约为一个碳原子体积大小。注意算法本质具有随机性。\n",
- "```\n",
- "\n",
- "\n",
- "example：\n",
- "\n",
- " \n",
- "\n",
- "\n",
- " \n",
- "\n",
- "```\n"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**AverageDegree**：计算与一个残基选择部分的定义距离内的残基数目。能够区分从天然复合物中区分没有相互作用的design。许多没有相互作用的design都存在没有很好嵌合的表面。\n",
- "```\n",
- "\n",
- "```\n",
- "1. threshold：至少需要存在多少个氨基酸在选择部分氨基酸的范围内\n",
- "2. distance_threshold：定义计算距离的范围大小\n",
- "3. task_operations定义针对哪些残基进行该计算\n"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**PackStat**：基于packing统计量的filter\n",
- "```\n",
- "\n",
- "```\n",
- "1. threshold：最低阈值\n",
- "2. chain：在计算packstate之前从哪一个jump开始分离复合物。0表示不分离\n",
- "3. repeats：重复计算次数\n"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**Holes**：寻找packing中的空腔。仍然是使用will sheffler的packing代码（packstat）计算蛋白内部空腔的体积大小。但是这一允许传入氨基酸选择器，仅使用部分氨基酸（蛋白部分进行计算）。但是值得注意是，这里的计算仍然是把pose作为整体进行计算，只是report得分的时候，只有在选择器中的原子才会被计算总和。（Holes打分是对单个原子/残基进行计算得分值得总和。）结果如果正说明比之native结构更多空腔，负说明更少空腔。\n",
- "```\n",
- "\n",
- "```\n",
- "1. threshold：最高阈值。高于该值，将不通过。\n",
- "2. exclude_bb_atoms：不考虑骨架原子的holes贡献\n",
- "3. normalize_per_residue：对于选中的残基部分进行归一化（不推荐使用，默认为false）\n",
- "4. normalize_per_atom：同上（对原子）"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**InterfaceHoles**：在蛋白-蛋白接触界面上计算空腔，使用Will Sheffler's packstat的脚本。报告的打分是指bound和unbound构象的holes得分的差值。需要开启-holes:dalphaball选项。\n",
- "```\n",
- "\n",
- "```\n",
- "1. jump：计算InterfaceHoles的jump\n",
- "2. threshold：最高阈值"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**NeighborType**：在一个残基附近搜索是否存在一种设定的残基类型的filter。\n",
- "```\n",
- "\n",
- " \n",
- "\n",
- "```"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**ResInInterface**：基于界面上残基总数的filter。\n",
- "```\n",
- "\n",
- "```\n",
- "1. 需要制定jump说明计算哪一个接触界面\n",
- "2. threshold为最低阈值，超过设定值，返回true。"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**ShapeComplementarity**：基于界面形状互补的filter。计算 Lawrence & Coleman形状互补系数。\n",
- "```\n",
- "\n",
- "```\n",
- "1. min_sc：最低形状互补系数阈值\n",
- "2. quick：使用快速但降低精确度的算法\n",
- "3. sym_dof_name：对于具有对称性的pose，计算哪一个dof的interface\n",
- "4. residues1 & residues2 ：显式说明哪些残基是在interface的哪一边\n",
- "5. residue_selector1 & residue_selector2：显式，同上（残基选择部分）\n",
- "6. write_int_area：将得分写入score 文件\n",
- "7. write_median_dist：写入median distance\n",
- "8. max_median_dist：median distance最高阈值"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**SSShapeComplementarity**：基于二级结构形状互补系数的filter\n",
- "```\n",
- "\n",
- "```\n",
- "使用与上一条filter相同的脚本，计算基于二级结构的Lawrence & Coleman形状互补系数。二级结构元件（loop，helix等）从蛋白整体切下，然后计算其与剩余蛋白部分的互补情况。filter被调用的时候，蛋白还原，而后使用下一个二级结构元件进行相同计算。返回值为sum( sc_i × a_i )/a_tot，sc_i为第i个二级结构元件的形状互补系数值，a_i为第i个二级结构元件与剩余部分的相互作用面积，a_tot为所有二级结构元件的蛋白内面积的总和。目前不支持sheet结构。可以使用blueprint指定二级结构。若总体的形状互补系数低于min_sc值，返回false，否则返回true。"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**SpecificResiduesNearInterface**：基于界面附近特定残基的filter。即要求pose的界面附近需要含有指定残基。\n",
- "```\n",
- "\n",
- "```\n",
- "例如taskop中design的残基需要靠近interface。"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 9. Burial相关filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**TotalSasa**：基于pose总溶剂可及表面积的filter。高于设定阈值（threshold），返回true。\n",
- "```\n",
- "\n",
- "```\n",
- "1. upper_threshold：最大溶剂可及表面积\n",
- "2. hydrophobic：仅计算与疏水性残基相关的可及表面积\n",
- "3. polar：仅计算与极性残基相关的可及表面积\n",
- "4. task_operations：进报告可以被pack的残基部分（有taskop指定）的SASA值。若没有指定，则会计算所有残基的SASA\n",
- "5. report_per_residue_sasa：报告单个残基的SASA\n"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**Sasa**：基于界面上溶剂可及表面积的filter。高于设定阈值，返回true。\n",
- "```\n",
- "\n",
- "```\n",
- "1. upper_threshold：最大溶剂可及表面积\n",
- "2. jump：用于计算SASA的界面jump\n",
- "3. sym_dof_names：对于存在对称定义的pose，进一步指定计算何界面的SASA"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**ResidueBurial**：在目标残基界面的相互作用距离范围内的残基数目的filter。简单来说就是计算目标残基的某相互作用距离（distance选项）下范围的其他残基数。若设定neighbors为1，既仅仅检查界面附近是否存在残基。\n",
- "```\n",
- "\n",
- "```\n",
- "1. task_operations： taskop指定的可设计的残基。任意一个残基通过burial threshold则返回true\n",
- "2. residue_fraction_buried：被taskop定义为designable的总残基的分数，默认为0.0001"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**BuriedSurfaceArea**：计算一个pose或selection的包埋的表面积。若低于设定阈值，返回false。该filter仅适用在L型或D型天然氨基酸，其他类型一律为0。\n",
- "```\n",
- "\n",
- "```\n",
- "1. select_only_FAMILYVW： true表示仅计算FAMILYVW这些残基；false表示所有的残基都会被计算。会与residue_selector进行取交集进行计算。\n",
- "2. filter_out_low ：默认为true，表示pose/selection计算值低于阈值将被reject掉\n",
- "3. cutoff_buried_surface_area ：默认为500\n",
- "4. atom_mode：默认为“all_atoms”，也可以是\"hydrophobic_atoms\"、\"polar_atoms\""
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**ExposedHydrophobics**：对每个疏水残基进行的SASA计算(A, F, I, M, L, W, V, Y)。score返回溶剂暴露的疏水残基数目和暴露程度。对于每一个疏水残基，SAS高于设定cutoff值（默认20），则将 SASA - sasa_cutoff的计算值加和到score上。若最终score低于定义的threshold，返回true。\n",
- "```\n",
- "\n",
- "```"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 10. Comparison相关Filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**RelativePose**：比较pose相比于另一个不同pose结构的filter计算值。\n",
- "```\n",
- "\n",
- "```\n",
- "1. pdb_name：参照pose读入的pdb文件\n",
- "2. filter：需要计算pose的何种filter值\n",
- "3. dump_pose：是否输出pose\n",
- "4. alignment：需要在disk读入的pose和当前pose的哪一个segment进行align，默认为1 -> nres，例如也可以指定为3A:1B,4A:2B,5A:6B，意思为align disk读入的pose的3A-5A到1B，2B和6B位置。\n",
- "5. packing_shell：每个残基周围多大范围内进行repack"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**Rmsd**：计算当前pose与参照pose的rmsd值的filter。\n",
- "```\n",
- "\n",
- " \n",
- " \n",
- " \n",
- "\n",
- "```\n",
- "1. reference_name：参照pose的名字（使用SavePoseMover 可以创建参照pose）\n",
- "2. superimpose_on_all：是否叠合所有残基\n",
- "3. threshold：最高阈值\n",
- "4. by_aln：依据alignment文件进行rmsd计算，align_files必须指定\n",
- "5. template_names：逗号分隔的template的名字\n",
- "6. rms_residues_from_pose_cache：是否pose的缓存中存在RMS残基"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**SidechainRmsd**：计算单个残基的全原子RMSD （可以包含或不包含骨架原子）。计算rmsd之前不会进行叠合。\n",
- "```\n",
- "SidechainRmsd name=\"(&string)\" res1_(res/pdb)_num=\"(&string)\" res2_(res/pdb)_num=\"(&string)\" reference_name=\"(&string)\" include_backbone=\"(0 &bool)\" threshold=\"(1.0 &real)\" />\n",
- "```\n",
- "1. threshold：最高阈值"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**IRmsd**：计算interface上的RMSD，包含interface上的所有骨架原子。interface残基包括在两边界面8埃范围内的所有残基。\n",
- "```\n",
- "\n",
- "```\n",
- "1. threshold：最高阈值。比之低的pose会通过该filter\n",
- "2. reference_pose：需要制定参照pose"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**RmsdFromResidueSelectorFilter**：与Rmsd filter类似，只不过对参照pose和当前计算pose分别提供ResidueSelectors。\n",
- "```\n",
- "\n",
- "```"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**SequenceRecovery**：对比参照pose，当前pose有多大的序列回复率的filter。用户通过task_operations提供可design的残基范围。command line可输入-in:file:native 将用户输入的pose文件作为参照，否则将使用起始pose作为参照。\n",
- "```\n",
- "\n",
- "```\n",
- "1. rate_threshold：最低通过阈值（至少需要到多大的回复率）\n",
- "2. mutation_threshold：突变的最大个数\n",
- "3. report_mutations：默认false，不会report。true表示不再使用rate作为filter，而使用突变个数。"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "## 11. bonding相关Filter"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**ChainBreak**：基于pose中链断裂数目的filter。这里的break指的是当某键长偏离平均键长（1.33）+/- tolerance (默认0.13为tolerance)\n",
- "```\n",
- "< ChainBreak name=\"(&string)\" \n",
- " chain_num=\"(1 &int)\" \n",
- " tolerance=\"(0.13 &float)\"\n",
- " threshold=\"(1 &int)\" \n",
- "/>\n",
- "```"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**HbondsToResidue**：基于某残基的氢键连接数目的filter。计算与某残基形成氢键的残基数目，且每一个氢键必须要超过一定的energy_cutoff值。对于骨架间的氢键，需要开放bb_bb选项。\n",
- "```\n",
- "\n",
- "```\n",
- "1. partners：预期的氢键partner个数，最低阈值。至少需要规定数目的partner，该filter才能通过\n",
- "2. backbone：是否包含骨架氢键\n",
- "3. sidechain：是否包含侧链氢键\n",
- "4. bb_bb：是否记录骨架-骨架氢键\n",
- "5. from_other_chains：true表示计算与另外的链的氢键partner（default为true）\n",
- "6. from_same_chain：true表示需要计算本条链内部的partner（default为true）"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**SimpleHbondsToAtom**：基于某原子的氢键数目的filter。检查目标原子是否存在至少n_partners指定的氢键partner\n",
- "```\n",
- "\n",
- "```\n",
- "1. hb_e_cutoff：氢键能量cutoff值，默认-0.5。只要达标的氢键才会被该filter算作partner。"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**HbondsToAtom**：与SimpleHbondsToAtom相似，但逻辑稍复杂。结合了部分HbondsToResidue的选项。\n",
- "```\n",
- "\n",
- "```"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**PeptideInternalHbondsFilter**：在一个pose或selection中的氢键数目，排除了在threshold范围内的共价连接残基之间的氢键部分。低于设定阈值的pose会被reject掉。在寻找长距离的骨架氢键作用时候比较有用。\n",
- "```\n",
- "\n",
- "```\n",
- "1. backbone_backbone：默认为true，计算骨架-骨架间氢键\n",
- "2. backbone_sidechain：默认为true\n",
- "3. sidechain_sidechain：默认为true\n",
- "4. exclusion_distance：既在该设定范围内共价连接的残基间氢键不必计算\n",
- "5. hbond_cutoff：最低阈值，默认为1，最少需要的氢键数目\n",
- "\n",
- "\n"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**BuriedUnsatHbonds**：基于被包埋的不饱和氢键的最大数目的filter。\n",
- "```\n",
- "# old filter, recapitulates results of this filter before Dec 16 2017\n",
- "\n",
- "\n",
- "# report number of backbone (bb) heavy-atom buns, using residue selector:\n",
- "# many native and de novo backbones have at least a couple of legit buried unsats in the backbone; most occur in loops or other flexible regions, but setting this to 0 will throw out potentially good designs; best to set cutoff to a few, or use confidence=\"0\"\n",
- "\n",
- "\n",
- "# report the number of sidechain (sc) heavy-atom buns, using a residue selector\n",
- "# if doing design, and residue selector is design space, you want this to be 0\n",
- "\n",
- "```\n",
- "1. 该filter被更新过，略显复杂。如果需要使用旧版filter，指定use_legacy_options为true即可"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**BuriedUnsatHbonds2**：与上一个相似，只是算法不同。(具体如何不同，官方也没有明确给出)\n",
- "```\n",
- "\n",
- "```\n",
- "1. threshold：最高阈值\n",
- "2. sasa_burial_cutoff：定义残基被包埋与否的sasa阈值\n",
- "3. AHD_cutoff：氢键Acceptor - H - Donor之间角度阈值\n",
- "4. dist_cutoff：氢键距离阈值\n",
- "5. hxl_dist_cutoff：氢键距离羟基的距离阈值\n",
- "6. sulph_dist_cutoff：氢键距离硫原子距离阈值\n",
- "7. metal_dist_cutoff：氢键距离金属例子的阈值"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**OversaturatedHbondAcceptorFilter**：过饱和氢键受体的filter。超过一个供体的氢键受体属于此类。\n",
- "```\n",
- "\n",
- "```\n",
- "选项含义大多不言自明。\n",
- "1. max_allowed_oversaturated：最大允许过饱和数，默认为0。既通过的pose不含有任何过饱和氢键受体。"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**DisulfideFilter**：二硫键的filter。计算界面上二硫键是否存在。\n",
- "```\n",
- "\n",
- "```\n",
- "1. targets: 逗号分隔的残基numbering的列表，兼容rosetta numbering和pdb numbering。列表中残基需要处于界面上"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**AveragePathLength**：计算蛋白质“图网络表示”的最短途径距离，图表示中残基为节点，共价键为边。\n",
- "```\n",
- "\n",
- "```\n",
- "原也是设计用来搜索二硫键相关metric（不如DisulfideEntropyFilter准确）。在设定最高阈值内，pose可以通过该filter。\n",
- "\n",
- "threshold = (0.1429 n) + 0.8635 + path_tightness\n",
- "\n",
- "n为链中残基数目，path_tightness需要用户定义。"
- ]
- },
- {
- "cell_type": "markdown",
- "metadata": {},
- "source": [
- "**DisulfideEntropy**：由于二硫键形成构象熵值改变的计算。\n",
- "```\n",
- "\n",
- "```\n",
- "计算由于二硫键形成导致deltaSconf_folding的变化。S_conf仅表示蛋白链的构象熵：deltaS_conf_folding = S_conf_folded - S_conf_unfolded。\n",
- "\n",
- "deltaG_folding = deltaH_folding - T (deltaS_conf_folding + deltaS_other)\n",
- "\n",
- "若deltaS_conf_folding计算为正，说明folded状态有更大的稳定性。\n",
- "\n",
- "threshold = (0.1604 * residues) + (1.7245 * disulfides) + 5.1477 + tightness\n",
- "\n",
- "其中仅tightness需要用户定义，用以调整阈值。设定为1，大约82%天然蛋白可以通过该filter，设定为-1，仅19%能够通过。"
- ]
- },
- {
- "cell_type": "code",
- "execution_count": null,
- "metadata": {},
- "outputs": [],
- "source": []
- }
- ],
- "metadata": {
- "kernelspec": {
- "display_name": "Python 3",
- "language": "python",
- "name": "python3"
- },
- "language_info": {
- "codemirror_mode": {
- "name": "ipython",
- "version": 3
- },
- "file_extension": ".py",
- "mimetype": "text/x-python",
- "name": "python",
- "nbconvert_exporter": "python",
- "pygments_lexer": "ipython3",
- "version": "3.6.12"
- }
- },
- "nbformat": 4,
- "nbformat_minor": 4
-}
diff --git a/8_Filter/8_2_RosettaFilter_API.ipynb b/8_Filter/8_2_RosettaFilter_API.ipynb
new file mode 100644
index 0000000..952876f
--- /dev/null
+++ b/8_Filter/8_2_RosettaFilter_API.ipynb
@@ -0,0 +1,4028 @@
+{
+ "cells": [
+ {
+ "cell_type": "markdown",
+ "id": "0e5f3ab4-d13b-44da-8311-a9b3e918c480",
+ "metadata": {},
+ "source": [
+ "# Rosetta Filter API\n",
+ "\n",
+ "@Author: 吴炜坤 @email：weikun.wu@xtalpi.com\n",
+ "\n",
+ "更多参考: https://new.rosettacommons.org/docs/latest/scripting_documentation/RosettaScripts/Filters/Filters-RosettaScripts\n",
+ "\n"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "98b36454-303d-4f55-a2a4-0dcbd3fc251b",
+ "metadata": {},
+ "source": [
+ "本章节将详细介绍Pyrosetta中一些常用的filter的使用，并给出示例。请读者根据自己需求，需要使用时进行查询即可。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 1,
+ "id": "bebf98a9-37bf-41cd-9fb8-821b90edb879",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=1549073982 seed_offset=0 real_seed=1549073982 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=1549073982 RG_type=mt19937\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.rosetta_scripts import *\n",
+ "from pyrosetta import *\n",
+ "init()"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "4418fc73-3afb-43f2-ab56-a8b1e8a860b8",
+ "metadata": {},
+ "source": [
+ "### 1. SimpleMetricFilter（简单介绍）\n",
+ "基于SimpleMetric计算的值判断是否保留构象的过滤器。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 2,
+ "id": "dcc5a3b4-7f09-4d6e-86c6-0af08e89316c",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 984 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.640261 seconds.\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "PDB file name: ./data/1ubq_clean.pdb\n",
+ " Pose Range Chain PDB Range | #Residues #Atoms\n",
+ "\n",
+ "0001 -- 0076 A 0001 -- 0076 | 0076 residues; 01234 atoms\n",
+ " TOTAL | 0076 residues; 01234 atoms\n",
+ "\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import SimpleMetricFilter\n",
+ "from pyrosetta.rosetta.core.select.residue_selector import ResidueIndexSelector\n",
+ "from pyrosetta.rosetta.core.simple_metrics.metrics import SasaMetric\n",
+ "from pyrosetta.rosetta.protocols.simple_filters import comparison_type\n",
+ "\n",
+ "# 读取pose\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "print(pose.pdb_info())"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 3,
+ "id": "f4bbac26-5f5a-419d-b633-5332b405b5f3",
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "# 定义SimpleMetrics计算器\n",
+ "sasa_sel = ResidueIndexSelector('1-76') # 比如计算1-76号残基每个残基的sasa值\n",
+ "sasa_metrics = SasaMetric(sasa_sel)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 4,
+ "id": "ff0a8f71-9b80-481f-b010-fc74b916e833",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mprotocols.simple_filters.SimpleMetricFilter: {0} \u001b[0m4738.4 gt 500 ?\n",
+ "\u001b[0mprotocols.simple_filters.SimpleMetricFilter: {0} \u001b[0mFilter passed: 1\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 4,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# 定义SimpleMetricFilter\n",
+ "sasa_filter = SimpleMetricFilter()\n",
+ "sasa_filter.set_simple_metric(sasa_metrics) # 设定SimpleMetrics\n",
+ "sasa_filter.set_cutoff(500) # 设定截断半径;\n",
+ "sasa_filter.set_comparison_type(comparison_type.gt) # gt 等于great than, filter的判断逻辑\n",
+ "sasa_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "f1135bd9-e494-48a1-9e7f-38312a5ab7c2",
+ "metadata": {},
+ "source": [
+ "**点评**:其实在python操作中，完全没必要去设定SimpleMetricFilter。直接根据SimpleMetric返回的内容进行判断True or False。这种python语言中是非常容易实现的。\n",
+ "此处仅做一个简单的案例，阐明SimpleMetricFilter的基本作用。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "9ba8302f-5dee-4d28-9531-417692f9d330",
+ "metadata": {},
+ "source": [
+ "### 2. Basic Filters\n",
+ "此部分根据官方的Filter文档介绍，ResidueCount和NetCharge的用法。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "27303003-4fe5-4e76-96ca-85f72c1f87f7",
+ "metadata": {},
+ "source": [
+ "#### 2.1 ResidueCount\n",
+ "根据残基类型、残基性质、Pack状态的计数/计频filter，可设置过滤阈值。当多个性质或类型被设置时，处理的逻辑是“或”。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 5,
+ "id": "241467e8-e39b-4377-b164-ff976bc4f2a7",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "41.0"
+ ]
+ },
+ "execution_count": 5,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import ResidueCountFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "res_count_filter = ResidueCountFilter()\n",
+ "res_count_filter.add_residue_property_by_name('POLAR')\n",
+ "res_count_filter.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 6,
+ "id": "7850297f-4f65-4208-9ea6-1a52e1154820",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "2.0"
+ ]
+ },
+ "execution_count": 6,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.chemical import ResidueTypeSet\n",
+ "from pyrosetta.rosetta.core.chemical import ChemicalManager\n",
+ "from pyrosetta.rosetta.core.conformation import ResidueFactory\n",
+ "\n",
+ "# 获取ResidueTypeSet\n",
+ "chm = ChemicalManager.get_instance()\n",
+ "residue_type_sets = chm.residue_type_set(\"fa_standard\")\n",
+ "\n",
+ "# 定义Filter\n",
+ "res_count_filter = ResidueCountFilter()\n",
+ "res_count_filter.add_residue_type_by_name(residue_type_sets, 'ALA')\n",
+ "res_count_filter.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "35d33f94-4505-4b40-ab67-2280b559c90b",
+ "metadata": {},
+ "source": [
+ "#### 2.2 NetCharge\n",
+ "基于蛋白序列总电荷值的过滤器，NetCharge设定LYS和ARG残基电荷值为+1，酸性残基ASP和GLU电荷值为-1。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 7,
+ "id": "7e5a5b33-b8b1-4131-bde2-388528b534cf",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 LYS 6\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 LYS 11\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 GLU 16\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 GLU 18\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 ASP 21\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 GLU 24\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 LYS 27\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 LYS 29\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 ASP 32\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 LYS 33\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 GLU 34\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 ASP 39\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 ARG 42\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 LYS 48\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 GLU 51\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 ASP 52\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 ARG 54\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 ASP 58\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 LYS 63\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: -1 GLU 64\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 ARG 72\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mAA: +1 ARG 74\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mThe net charge is: 0\n",
+ "\u001b[0mprotocols.simple_filters.NetChargeFilter: {0} \u001b[0mNet Charge: 0. passing.\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 7,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import NetChargeFilter\n",
+ "netcharge = NetChargeFilter()\n",
+ "netcharge.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "665ba7a5-6b57-4779-ae7b-ae4dedbb612c",
+ "metadata": {},
+ "source": [
+ "### 3. Energy/Score Filters"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "65921b0e-a506-445a-aeb5-c4d76da483f2",
+ "metadata": {},
+ "source": [
+ "#### 3.1 ScoreTypeFilter\n",
+ "基于某特定打分项的Filter，如果没有指定打分的能量项，将默认对总能进行判断过滤。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 8,
+ "id": "ea488e8e-2a4c-4e55-b4f3-3d8b9f687990",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.176495 seconds to load from binary\n",
+ "\u001b[0mprotocols.simple_filters.ScoreTypeFilter: {0} \u001b[0mscore fa_atr is -397.646. failing.\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "False"
+ ]
+ },
+ "execution_count": 8,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.score_filters import ScoreTypeFilter\n",
+ "from pyrosetta.rosetta.core.scoring import ScoreType\n",
+ "from pyrosetta import create_score_function\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 创建打分函数\n",
+ "ref2015 = create_score_function('ref2015')\n",
+ "\n",
+ "# 定义Filter\n",
+ "st_filter = ScoreTypeFilter()\n",
+ "st_filter.set_scorefxn(ref2015)\n",
+ "st_filter.set_score_type(ScoreType.fa_atr) # 对范德华吸引势能量项打分，更多请参见ScoreType类型。\n",
+ "st_filter.set_threshold(-400)\n",
+ "st_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "1c89bf99-4603-40fc-923b-0eaf8308a544",
+ "metadata": {},
+ "source": [
+ "#### 3.2 TaskAwareScoreType\n",
+ "TaskAwareScoreType过滤器与ScoreTypeFilter最大的区别在于，只对那些TaskOperation中可被Repack的部分进行能量评估。\n",
+ "\n",
+ "mode：可选\"total\", \"average\", or \"individual\"\n",
+ "\n",
+ "此Filter可以对Interface上的残基进行特定的过滤，特别结合individual模式可以识别出异常的Residue或Rotamer"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 9,
+ "id": "1f0a9abd-de11-4708-b4dc-92c4b8951153",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "0.0"
+ ]
+ },
+ "execution_count": 9,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import TaskAwareScoreTypeFilter\n",
+ "from pyrosetta.rosetta.core.scoring import ScoreType\n",
+ "from pyrosetta import create_score_function\n",
+ "from pyrosetta.rosetta.core.pack.task import TaskFactory\n",
+ "from pyrosetta.rosetta.core.pack.task.operation import PreventRepackingRLT\n",
+ "from pyrosetta.rosetta.core.pack.task.operation import OperateOnResidueSubset\n",
+ "from pyrosetta.rosetta.core.select.residue_selector import ResidueIndexSelector\n",
+ "from pyrosetta.rosetta.core.pack.task import TaskFactory\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 选择氨基酸范围\n",
+ "select_pos = ResidueIndexSelector('2,3,4,5,6,7,8,9,10,11,12,13')\n",
+ "# 使用OperateOnResidueSubset生成TaskOperations\n",
+ "packing_taskop = OperateOnResidueSubset(PreventRepackingRLT(), select_pos, False)\n",
+ "\n",
+ "# 创建打分函数\n",
+ "ref2015 = create_score_function('ref2015')\n",
+ "\n",
+ "# 创建tf\n",
+ "tf = TaskFactory()\n",
+ "tf.push_back(packing_taskop)\n",
+ "\n",
+ "# 定义Filter\n",
+ "tast_filter = TaskAwareScoreTypeFilter()\n",
+ "tast_filter.bb_bb(True) # 考虑骨架的能量项\n",
+ "tast_filter.score_type(ScoreType.fa_atr)\n",
+ "tast_filter.scorefxn(ref2015)\n",
+ "tast_filter.task_factory(tf)\n",
+ "tast_filter.threshold(-1.0)\n",
+ "tast_filter.unbound(False) # 必须手动设置为False\n",
+ "tast_filter.mode('individual') # 单独过滤每一个打分项\n",
+ "tast_filter.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "6aebc6e6-d88b-41a0-9b11-9bb734c6ab0d",
+ "metadata": {},
+ "source": [
+ "#### 3.3 BindingStrain\n",
+ "在结合态的单体的能量张力的Filter, 此Filter可以自动检测对称性。\n",
+ "\n",
+ "ps: 看了下源码，这个Filter其实就是把两个刚体组分拉开，然后进行repack。然后计算bind状态下的能量-unbind状态下的能量差。\n",
+ "\n",
+ "如果能量差的绝对值越大，说明bind状态以unbind状态下的能量差较大。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 10,
+ "id": "4bcd356d-6571-4fab-b6e1-e61879355e83",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2 -corrections::beta_nov16 -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=1905387258 seed_offset=0 real_seed=1905387258 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=1905387258 RG_type=mt19937\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/hydroxyl_torsion_preference.txt\n",
+ "\u001b[0mcore.pack.task: {0} \u001b[0mPacker task: initialize from command line()\n",
+ "\u001b[0mprotocols.moves.RigidBodyMover: {0} \u001b[0mTranslate: Jump (before): RT 0.475346 -0.778522 0.409816 -0.138636 0.393705 0.908722 -0.868807 -0.488773 0.0792154 17.3442 -1.09276 -32.123\n",
+ "\u001b[0mprotocols.moves.RigidBodyMover: {0} \u001b[0mTranslate: Jump (after): RT 0.475346 -0.778522 0.409816 -0.138636 0.393705 0.908722 -0.868807 -0.488773 0.0792154 4858.09 4993.85 -7216.68\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 984 rotamers at 61 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
+ "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadManager: {?} \u001b[0mCreating a thread pool of 1 threads.\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadPool: {?} \u001b[0mLaunched 0 new threads.\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "-11.974517803396395"
+ ]
+ },
+ "execution_count": 10,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.protein_interface_design.filters import BindingStrainFilter\n",
+ "from pyrosetta.rosetta.core.pack.task.operation import PreventRepackingRLT\n",
+ "from pyrosetta.rosetta.core.select.residue_selector import ChainSelector\n",
+ "init('-ex1 -ex2 -corrections::beta_nov16')\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb')\n",
+ "\n",
+ "# 创建打分函数\n",
+ "beta_16 = create_score_function('beta_nov16')\n",
+ "receptor_chain = ChainSelector('A')\n",
+ "\n",
+ "# 创建tf\n",
+ "no_repack_receptor_op = OperateOnResidueSubset(PreventRepackingRLT(), receptor_chain)\n",
+ "tf = TaskFactory()\n",
+ "tf.push_back(no_repack_receptor_op)\n",
+ "\n",
+ "# 定义Filter\n",
+ "bsf = BindingStrainFilter()\n",
+ "bsf.scorefxn(beta_16)\n",
+ "bsf.threshold(0)\n",
+ "bsf.jump(1) # 定义binder与receptor之间的jump值。\n",
+ "bsf.task_factory(tf)\n",
+ "bsf.compute(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "42cd4664-a62a-45af-a08f-cbb16ac01e33",
+ "metadata": {},
+ "source": [
+ "#### 3.4 ConstraintScore(有bug.不起效)\n",
+ "从ConstraintGenerators产生的一系列constraints计算的打分项的Filter\n",
+ "\n",
+ "注意: \n",
+ "1. Generators产生的约束必须通过AddConstraintsMover已经添加到Pose中\n",
+ "2. 对应的score term打分必须开启。\n"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 11,
+ "id": "c4ed482f-7187-430a-b6d1-5ec7ead19a4b",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.constraint_generator.TerminiConstraintGenerator: {0} \u001b[0mConstraining atoms atomno= 2 rsd= 1 and atomno= 2 rsd= 76 , min_distance=8 max_distance=20\n",
+ "\u001b[0mprotocols.constraint_generator.AddConstraints: {0} \u001b[0mAdding 1 constraints generated by ConstraintGenerator named test_nc\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 通过ConstraintGenerators产生约束\n",
+ "from pyrosetta.rosetta.protocols.simple_moves import VirtualRootMover\n",
+ "\n",
+ "# load pose from 1ubq_clean.pdb\n",
+ "pose = pose_from_pdb(\"./data/1ubq_clean.pdb\")\n",
+ "\n",
+ "# Score reweight\n",
+ "score = create_score_function('ref2015')\n",
+ "score.set_weight(ScoreType.atom_pair_constraint, 1.0) # reweight score\n",
+ "\n",
+ "# 定义Filter\n",
+ "from pyrosetta.rosetta.protocols.constraint_generator import TerminiConstraintGenerator\n",
+ "termin_cst = TerminiConstraintGenerator()\n",
+ "termin_cst.set_min_distance(8)\n",
+ "termin_cst.set_max_distance(20)\n",
+ "termin_cst.set_sd(1.0)\n",
+ "termin_cst.set_id('test_nc')\n",
+ "\n",
+ "# add TerminiConstraintGenerator to pose;\n",
+ "from pyrosetta.rosetta.protocols.constraint_generator import AddConstraints\n",
+ "add_cst = AddConstraints()\n",
+ "add_cst.add_generator(termin_cst)\n",
+ "add_cst.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 12,
+ "id": "544c041e-f58c-418b-bd26-01d4b4b5fe8a",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mprotocols.constraint_filters.ConstraintScoreFilter: {0} \u001b[0m\n",
+ "------------------------------------------------------------\n",
+ " Scores Weight Raw Score Wghtd.Score\n",
+ "------------------------------------------------------------\n",
+ " atom_pair_constraint 1.000 0.000 0.000\n",
+ " coordinate_constraint 1.000 0.000 0.000\n",
+ " angle_constraint 1.000 0.000 0.000\n",
+ " dihedral_constraint 1.000 0.000 0.000\n",
+ " res_type_constraint 1.000 0.000 0.000\n",
+ " backbone_stub_constraint 1.000 0.000 0.000\n",
+ "---------------------------------------------------\n",
+ " Total weighted score: 0.000\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "False"
+ ]
+ },
+ "execution_count": 12,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.constraint_filters import ConstraintScoreFilter\n",
+ "from pyrosetta.rosetta.protocols.relax import FastRelax\n",
+ "\n",
+ "# 破坏NC构象代码(转为线性肽):\n",
+ "for i in range(1, pose.total_residue()+1):\n",
+ " pose.set_phi(i, -150)\n",
+ " pose.set_psi(i, 150)\n",
+ "\n",
+ "# 定义Filter\n",
+ "cst_score_filter = ConstraintScoreFilter()\n",
+ "cst_score_filter.set_user_defined_name('test_nc')\n",
+ "cst_score_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "3bcc442a-8782-4583-b389-69766258f386",
+ "metadata": {},
+ "source": [
+ "#### 3.5 ScorePoseSegmentFromResidueSelectorFilter\n",
+ "该filter可以根据用户指定的ResidueSelector的范围进行能量打分并过滤。比如可以针对特殊region或某条链进行打分。\n",
+ "\n",
+ "in_context选项: 可以选择是否在打分前，将selection的区域提取到一个单独的Pose中。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 13,
+ "id": "23f8f585-5740-485a-b613-e5a7abbc7ee0",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "1709.9821163242043"
+ ]
+ },
+ "execution_count": 13,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.fold_from_loops.filters import ScorePoseSegmentFromResidueSelectorFilter\n",
+ "from pyrosetta.rosetta.core.select.residue_selector import ChainSelector\n",
+ "\n",
+ "# 选择链\n",
+ "chain_A = ChainSelector('A')\n",
+ "\n",
+ "# 定义Filter\n",
+ "score_from_selector_filter = ScorePoseSegmentFromResidueSelectorFilter()\n",
+ "score_from_selector_filter.residue_selector(chain_A)\n",
+ "score_from_selector_filter.in_context(True)\n",
+ "score_from_selector_filter.scorefxn(ref2015)\n",
+ "score_from_selector_filter.compute(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "7b05fe93-aea2-4f08-a919-2be16e331c2b",
+ "metadata": {},
+ "source": [
+ "#### 3.6 ReadPoseExtraScoreFilter\n",
+ "从Pose中的ExtraScore信息中提取score，并且设置是否进行过滤。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 14,
+ "id": "9b3b5d95-08d8-40d9-9b4a-152494684290",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# set ExtraScore to pose:\n",
+ "from pyrosetta.rosetta.core.pose import setPoseExtraScore\n",
+ "setPoseExtraScore(pose, 'test_score', '100')"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "459c2279-b46a-45d0-b886-91871ca5edcf",
+ "metadata": {},
+ "source": [
+ "下面来进行score提取并过滤。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 15,
+ "id": "599f48f3-23b1-4758-8905-7bd9703b86c9",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 15,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# 定义Filter\n",
+ "from pyrosetta.rosetta.protocols.simple_filters import ReadPoseExtraScoreFilter\n",
+ "extra_score_filter = ReadPoseExtraScoreFilter()\n",
+ "extra_score_filter.set_term_name('test_score') # 要过滤的score term\n",
+ "extra_score_filter.set_threshold(300) # returns false if the score is greater than this threshold\n",
+ "extra_score_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "098c9463-0f21-4458-993e-d3cddee00634",
+ "metadata": {},
+ "source": [
+ "#### 3.7 Delta（完全没必要使用!）\n",
+ "计算filter中的值与input结构能量差值，简单来说就是指定一个Filter后，比对native和当前pose的差异值。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "ea948786-3bd3-4bf5-94d1-75f18437c3e0",
+ "metadata": {},
+ "source": [
+ "（略），在python中直接比较native pose和pose的值并不困难。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "89e9432a-e502-4937-806e-f34a9c9369d7",
+ "metadata": {},
+ "source": [
+ "### 4. Distance Filter"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "4012f225-983c-4e52-8032-64bff73b55b8",
+ "metadata": {},
+ "source": [
+ "#### 4.1 ResidueDistance\n",
+ "计算两个残基之间距离，以每个残基的邻原子作为计算（通常为C-β原子），此Filter支持PDB编号或Pose编号。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 16,
+ "id": "b0ef8ec9-8e89-4ebe-a812-72569d857bdf",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.simple_filters.ResidueDistanceFilter: {0} \u001b[0mDistance between residues 5 and 10 is 10.8498\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "False"
+ ]
+ },
+ "execution_count": 16,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import ResidueDistanceFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义filter\n",
+ "res1 = '5'\n",
+ "res2 = '10'\n",
+ "two_res_dis = ResidueDistanceFilter(res1, res2, distance_threshold=10)\n",
+ "two_res_dis.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "cc20dca3-575e-4881-b6d7-ca46aeae60d8",
+ "metadata": {},
+ "source": [
+ "#### 4.2 AtomicContact\n",
+ "判定两个残基之间在cutoff distance范围内，是否存在原子相互作用？"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 17,
+ "id": "1c3aaec8-f693-459a-844b-d592493cc3b6",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 17,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import AtomicContactFilter\n",
+ "is_atom_between_res = AtomicContactFilter(res1=1, res2=5, distance=10.0, sidechain=True, backbone=True, protons=False)\n",
+ "is_atom_between_res.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "2aa884be-3d83-4a55-a29d-79e804fc55fa",
+ "metadata": {},
+ "source": [
+ "#### 4.3 AtomicContactCount(xmlobject)\n",
+ "计算两个残基之间contact的数量，此filter运行设置taskoperation，此时filter只统计packable残基侧链上的碳原子contact数量。\n",
+ "\n",
+ "这个filter有3种运行模式:\n",
+ "1. \"All\" mode: 计算所有侧链碳原子的contact的数量。（适合单链结构计算使用）\n",
+ "2. \"jump\" mode: 计算所有复合物界面原子contact的数量。（适合相互作用界面使用）\n",
+ "3. \"chain\" mode: 计算链之间的原子contact的数量。（适合两两链之间计算使用）"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 18,
+ "id": "66cbf3bd-5aa9-47f4-a77b-30490e090889",
+ "metadata": {
+ "tags": []
+ },
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama_str.dat.\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"all_atomic_contact\" of type AtomicContactCount\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "# \"All\" mode\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "''')\n",
+ "all_atomic_contact_filter = xml.get_filter('all_atomic_contact')\n",
+ "# all_atomic_contact_filter.compute(pose) # 输出太多，用户请自行运行"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 19,
+ "id": "3865e372-4b7e-4a36-8a19-271837ee6459",
+ "metadata": {
+ "tags": []
+ },
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"all_atomic_contact\" of type AtomicContactCount\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 定义Filter\n",
+ "# \"jump\" mode\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "''')\n",
+ "all_atomic_contact_filter = xml.get_filter('all_atomic_contact')\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb')\n",
+ "# all_atomic_contact_filter.compute(complex_pose) # 输出有点多，用户自行运行"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 20,
+ "id": "68421173-8311-421a-8927-b320f394f5ff",
+ "metadata": {
+ "tags": []
+ },
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"all_atomic_contact\" of type AtomicContactCount\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 定义Filter\n",
+ "# \"chain\" mode\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "''')\n",
+ "all_atomic_contact_filter = xml.get_filter('all_atomic_contact')\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb')\n",
+ "# all_atomic_contact_filter.compute(complex_pose) 输出有点多，用户自行运行"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "ad80b457-63e2-462a-a1de-fac450174db0",
+ "metadata": {
+ "tags": []
+ },
+ "source": [
+ "#### 4.4 AtomicDistance\n",
+ "计算指定两个原子之间的距离是否在cutoff距离之内呢？"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 21,
+ "id": "f1e2090e-82c2-45a1-a4e6-d836625fc565",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "Atom Type: Nlys\n",
+ "\telement: N\n",
+ "\tLennard Jones: radius=1.80245 wdepth=0.161725\n",
+ "\tLazaridis Karplus: lambda=3.5 volume=16.514 dgfree=-20.8646\n",
+ "\tproperties: DONOR \n",
+ "Extra Parameters: 1.75 1.55 0.79 1.55 1.44 1.5 1.55 -20 -10.695 -1.145 -20 -0.62 0 0 0 1.85 8.52379 0.025 0.01 0.005 -289.292 -0.697267 -1933.88 -1.56243 -93.2613 93.2593 0.00202205 715.165 74.6559 -74.6539 0.00268963 -1282.36 0.633 -0.367 0.926 -0.537 0.633 -0.367\n",
+ "\n",
+ "Atom Type: CObb\n",
+ "\telement: C\n",
+ "\tLennard Jones: radius=1.91666 wdepth=0.141799\n",
+ "\tLazaridis Karplus: lambda=3.5 volume=13.221 dgfree=3.10425\n",
+ "\tproperties: \n",
+ "Extra Parameters: 2.14 1.7 0.72 1.7 1.89 1.76 1.65 0 0 0 1 0.51 0 0 0 2 8.81363 0.025 0.01 0.005 147.227 -0.811304 -8117.41 -2.17625 -85.8924 85.8904 0.00196363 900.14 168.481 -168.287 0.00113765 -6725.43 0 0 0 0 0 0\n",
+ "\n",
+ "8.27940468874423\n",
+ "False\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import AtomicDistanceFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 获取atom type基本信息:\n",
+ "atom_NZ_index = pose.residue(11).atom_index(\"NZ\")\n",
+ "atom_type = pose.residue(11).atom_type(atom_NZ_index)\n",
+ "print(atom_type)\n",
+ "\n",
+ "atom_NZ_index = pose.residue(34).atom_index(\"C\")\n",
+ "atom_type = pose.residue(34).atom_type(atom_NZ_index)\n",
+ "print(atom_type)\n",
+ "\n",
+ "# 定义Filter\n",
+ "# 原子的AtomType: atom_desig1, atom_desig2\n",
+ "# res1、res2: 残基的PDB名，\n",
+ "# distance_filter = AtomicDistanceFilter(res1=11, res2=34, atom_desig1='NZ', atom_desig2='OE1')\n",
+ "distance_filter = AtomicDistanceFilter(11, 34, 'Nlys', 'CObb', True, True, 3.0)\n",
+ "print(distance_filter.score(pose))\n",
+ "print(distance_filter.apply(pose))"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "3c622eda-767a-467f-bf63-3d2f6b920634",
+ "metadata": {},
+ "source": [
+ "#### 4.5 TerminusDistance(xmlobject)\n",
+ "计算N端或C端的残基是否位于蛋白-蛋白相互作用界面上，使用一级序列上的距离进行衡量。这个filter的意义在于不希望flexible的N或C端有氨基酸在相互作用界面上。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 22,
+ "id": "a9f46763-1847-4c22-a908-f939a641319e",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n",
+ "\u001b[0mprotocols.simple_filters.TerminusDistanceFilter: {0} \u001b[0mDistance From Terminus filter over jump number 1 with cutoff 5\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"nc_filter\" of type TerminusDistance\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n",
+ "\u001b[0mprotocols.simple_filters.TerminusDistanceFilter: {0} \u001b[0mnear terminus: 6. passing.\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 22,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "''')\n",
+ "\n",
+ "terminus_distance_filter = xml.get_filter('nc_filter')\n",
+ "terminus_distance_filter.apply(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "071ee450-d0da-477d-b718-faf3a175055d",
+ "metadata": {},
+ "source": [
+ "### 5. Sequence analysis"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "c59b6ade-e37d-4f46-9ddd-84112931a4ef",
+ "metadata": {},
+ "source": [
+ "#### 5.1 LongestContinuousPolarSegment\n",
+ "侦查Pose一级序列上，极性氨基酸残基最大连续长度的Filter。\n",
+ "\n",
+ "选项:\n",
+ "- exclude_chain_termini： false表示极性区域能够延展到N端或C端的将被计算；true表示不被计算（默认为true，仅内部的极性残基块被计算）\n",
+ "- count_gly_as_polar： true表示gly会被考虑为极性氨基酸，（默认为true）\n",
+ "- filter_out_high ：true表示高于cutoff设定值的极性残基长度的pose会被reject掉；false表示低于cutoff会被reject（默认为true）\n",
+ "- cutoff：最长极性残基长度的阈值，默认值为5\n",
+ "- residue_selector：氨基酸选择器，应预先定义(可选)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 23,
+ "id": "206b2f1b-30b7-440f-b680-93243759bde0",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "5.0"
+ ]
+ },
+ "execution_count": 23,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import LongestContinuousPolarSegmentFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "lps = LongestContinuousPolarSegmentFilter()\n",
+ "lps.set_exclude_chain_termini(True)\n",
+ "# lps.residue_selector() # 需要时使用\n",
+ "# lps.filter_out_high(False) # 需要时使用\n",
+ "lps.set_count_gly_as_polar(False)\n",
+ "lps.set_cutoff(10)\n",
+ "lps.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "0b311e49-ecfb-4b0a-8441-a0f01268ce6b",
+ "metadata": {},
+ "source": [
+ "#### 5.2 LongestContinuousApolarSegment\n",
+ "侦查Pose一级序列上，非极性氨基酸残基最大连续长度的Filter。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 24,
+ "id": "71c5c86d-b639-4816-8c44-b34984afbd74",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "5.0"
+ ]
+ },
+ "execution_count": 24,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import LongestContinuousApolarSegmentFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "lps = LongestContinuousApolarSegmentFilter()\n",
+ "lps.set_exclude_chain_termini(True)\n",
+ "# lps.residue_selector() # 需要时使用\n",
+ "# lps.filter_out_high(False) # 需要时使用\n",
+ "lps.set_count_gly_as_polar(False)\n",
+ "lps.set_cutoff(10)\n",
+ "lps.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "4e66863a-2f0c-4d8b-be39-38c61d4f4f25",
+ "metadata": {},
+ "source": [
+ "#### 5.3 SequenceDistanceFilter\n",
+ "计算两个序列之间的hamming distance。\n",
+ "\n",
+ "https://zh.wikipedia.org/wiki/%E6%B1%89%E6%98%8E%E8%B7%9D%E7%A6%BB"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 25,
+ "id": "52c81853-4319-4387-a26c-dc71a4ea728c",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "73.0"
+ ]
+ },
+ "execution_count": 25,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import SequenceDistance\n",
+ "\n",
+ "# 突变序列\n",
+ "mut_seq = pose.sequence()\n",
+ "mut_seq.replace('Q','C')\n",
+ "print(mut_seq)\n",
+ "\n",
+ "# 定义Filter\n",
+ "seq_dis_filter = SequenceDistance()\n",
+ "seq_dis_filter.target_seq(mut_seq)\n",
+ "seq_dis_filter.threshold(10)\n",
+ "seq_dis_filter.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "3e690670-3893-4480-957e-2bd4c409d102",
+ "metadata": {},
+ "source": [
+ "### 6. Geometry"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "46254e2c-eb18-4e64-9a3a-ff94cc17e3e8",
+ "metadata": {},
+ "source": [
+ "#### 6.1 Torsion\n",
+ "基于二面角角度的Filter：\n",
+ "- lower和upper:最低阈值、最高阈值\n",
+ "- resnum：pdb或rosetta numbering\n",
+ "- torsion：\"phi\"、\"psi\"\n",
+ "- task_operations：输出的residue可以是在task_operations定义过的那些残基，所有可以design的残基将被输出。不能同时使用task_operations和resnnum两个选项！ 不设置torsion选项将会输出所有phi和psi；不设置resnum会report所有残基。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 26,
+ "id": "efb248d6-1b85-496a-accc-56d70cbfff7b",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.Torsion: {0} \u001b[0mResidue F4A\t phi -115.991\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "False"
+ ]
+ },
+ "execution_count": 26,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.protein_interface_design.filters import Torsion\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "torsion_filter = Torsion()\n",
+ "torsion_filter.lower(110)\n",
+ "torsion_filter.upper(180)\n",
+ "torsion_filter.resnum(4)\n",
+ "torsion_filter.torsion('phi')\n",
+ "torsion_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "e5b7a513-0d08-4d14-96b7-326e54d3db83",
+ "metadata": {},
+ "source": [
+ "#### 6.2 HelixKink\n",
+ "Helix Kink是连续螺旋中的一个短暂的转角结构，这种结构会使螺旋发生大角度的“弯折”。此过滤器即判断螺旋的弯曲程度。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 27,
+ "id": "4b425889-d73a-493a-90f6-f80dce4f94af",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.DsspMover: {0} \u001b[0mLEEEEEELLLLEEEEELLLLLEHHHHHHHHHHHHLLLHHHEEEEELLEELLLLLELHHHLLLLLLEEEEEELLLLL\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixKinkFilter: {0} \u001b[0m Pose does not have HBOND_SET. Checking hbonds will be skipped.\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixKinkFilter: {0} \u001b[0mHelix 1, res 23-34, is bended angle=19.7744\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixKinkFilter: {0} \u001b[0mis OK.\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixKinkFilter: {0} \u001b[0mHelix 2, res 38-40, is bended angle=0\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixKinkFilter: {0} \u001b[0mis OK.\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixKinkFilter: {0} \u001b[0mHelix 3, res 57-59, is bended angle=0\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixKinkFilter: {0} \u001b[0mis OK.\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixKinkFilter: {0} \u001b[0m Filter success !\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 27,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.fldsgn.filters import HelixKinkFilter\n",
+ "from pyrosetta.rosetta.protocols.moves import DsspMover\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# DsspMover确定二级结构\n",
+ "DsspMover().apply(pose)\n",
+ "\n",
+ "# 定义Filter\n",
+ "hk_filter = HelixKinkFilter()\n",
+ "hk_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "8091982f-761b-4cbb-9400-805e235a8e0e",
+ "metadata": {},
+ "source": [
+ "#### 6.3 Geometry(xmlobject)\n",
+ "基于键的几何性质和omega角度的过滤器，判断蛋白骨架中是否有异常的二面角、键角。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 28,
+ "id": "2e9d230d-2e86-4ffe-a3bb-33844a5c997c",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n",
+ "\u001b[0mcore.select.residue_selector.util: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Selector name is empty!\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"geometry_filter\" of type Geometry\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mInitializing IdealParametersDatabase with default Ks=300 , 80 , 80 , 10 , 80\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-lengths.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 759 bb-independent lengths.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-angles.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1434 bb-independent angles.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-torsions.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1 bb-independent torsions.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-improper.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 529 bb-independent improper tors.\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mCreating new peptide-bonded energy container (203)\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mScan residues between 1 and 203\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 1 name THR cart_bonded term: 0.992689 omega angle: 176.092\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 2 name GLN cart_bonded term: 1.65931 omega angle: -172.246\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 3 name ASN cart_bonded term: 1.26268 omega angle: -177.763\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 4 name VAL cart_bonded term: 1.099 omega angle: -178.738\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 5 name LEU cart_bonded term: 1.35312 omega angle: -178.243\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 6 name TYR cart_bonded term: 1.18849 omega angle: 178.796\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 7 name GLU cart_bonded term: 1.2969 omega angle: 176.019\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 8 name ASN cart_bonded term: 1.4588 omega angle: 179.075\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 9 name GLN cart_bonded term: 0.990204 omega angle: 177.036\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 10 name LYS cart_bonded term: 0.902491 omega angle: -178.887\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 11 name LEU cart_bonded term: 0.751696 omega angle: -179.523\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 12 name ILE cart_bonded term: 1.10573 omega angle: -178.423\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 13 name ALA cart_bonded term: 1.19178 omega angle: -176.17\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 14 name ASN cart_bonded term: 1.15318 omega angle: -179.194\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 15 name GLN cart_bonded term: 1.13096 omega angle: 178.094\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 16 name PHE cart_bonded term: 1.09638 omega angle: -178.37\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 17 name ASN cart_bonded term: 1.04982 omega angle: -179.186\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 18 name SER cart_bonded term: 1.0585 omega angle: 178.626\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 19 name ALA cart_bonded term: 0.996369 omega angle: -177.708\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 20 name ILE cart_bonded term: 0.8821 omega angle: 176.307\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 21 name GLY cart_bonded term: 1.03466 omega angle: 177.043\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 22 name LYS cart_bonded term: 1.0425 omega angle: -174.896\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 23 name ILE cart_bonded term: 1.42015 omega angle: -179.604\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 24 name GLN cart_bonded term: 1.37938 omega angle: -179.966\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 25 name ASP cart_bonded term: 1.45033 omega angle: -174.651\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 26 name SER cart_bonded term: 1.33776 omega angle: 178.37\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 27 name LEU cart_bonded term: 0.760225 omega angle: 175.333\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 28 name SER cart_bonded term: 0.801759 omega angle: 178.766\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 29 name SER cart_bonded term: 1.05472 omega angle: -179.719\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 30 name THR cart_bonded term: 1.10531 omega angle: -179.786\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 31 name ALA cart_bonded term: 1.004 omega angle: 178.356\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 32 name SER cart_bonded term: 0.855412 omega angle: -179.778\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 33 name ALA cart_bonded term: 0.685075 omega angle: 179.849\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 34 name LEU cart_bonded term: 1.06177 omega angle: 175.28\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 35 name GLY cart_bonded term: 0.986344 omega angle: -179.971\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 36 name LYS cart_bonded term: 0.953909 omega angle: 176.446\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 37 name LEU cart_bonded term: 1.14104 omega angle: -178.757\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 38 name GLN cart_bonded term: 0.960952 omega angle: -177.985\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 39 name ASP cart_bonded term: 1.54448 omega angle: -175.014\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 40 name VAL cart_bonded term: 1.62567 omega angle: 179.099\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 41 name VAL cart_bonded term: 1.32687 omega angle: -179.613\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 42 name ASN cart_bonded term: 1.38515 omega angle: 178.635\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 43 name GLN cart_bonded term: 1.568 omega angle: 179.297\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 44 name ASN cart_bonded term: 1.27995 omega angle: 179.467\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 45 name ALA cart_bonded term: 0.724435 omega angle: 178.883\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 46 name GLN cart_bonded term: 1.08387 omega angle: -176.515\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 47 name ALA cart_bonded term: 1.2817 omega angle: 173.275\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 48 name LEU cart_bonded term: 417446 omega angle: 156.082\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0momega 48 ASN fail\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mcart_bond 48 ASN fail\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 49 name ASN cart_bonded term: 417446 omega angle: 177.916\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mcart_bond 49 VAL fail\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 50 name VAL cart_bonded term: 2.05922 omega angle: -179.464\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 51 name LEU cart_bonded term: 1.03903 omega angle: 178\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 52 name TYR cart_bonded term: 0.813548 omega angle: -179.489\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 53 name GLU cart_bonded term: 1.23947 omega angle: 178.476\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 54 name ASN cart_bonded term: 1.10217 omega angle: 179.176\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 55 name GLN cart_bonded term: 0.96517 omega angle: -179.807\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 56 name LYS cart_bonded term: 1.94967 omega angle: 177.777\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 57 name LEU cart_bonded term: 1.8392 omega angle: -179.175\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 58 name ILE cart_bonded term: 0.994841 omega angle: -179.443\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 59 name ALA cart_bonded term: 0.915828 omega angle: -175.933\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 60 name ASN cart_bonded term: 1.17579 omega angle: -178.13\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 61 name GLN cart_bonded term: 1.31401 omega angle: 178.015\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 62 name PHE cart_bonded term: 0.885007 omega angle: -179.135\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 63 name ASN cart_bonded term: 0.781471 omega angle: 179.264\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 64 name SER cart_bonded term: 0.858888 omega angle: -179.857\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 65 name ALA cart_bonded term: 0.645112 omega angle: -179.248\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 66 name ILE cart_bonded term: 0.663998 omega angle: 179.268\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 67 name GLY cart_bonded term: 0.74435 omega angle: -179.138\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 68 name LYS cart_bonded term: 0.7402 omega angle: 179.855\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 69 name ILE cart_bonded term: 0.843688 omega angle: -178.78\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 70 name GLN cart_bonded term: 0.891578 omega angle: -178.407\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 71 name ASP cart_bonded term: 0.982767 omega angle: -178.044\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 72 name SER cart_bonded term: 1.08853 omega angle: -179.836\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 73 name LEU cart_bonded term: 1.0578 omega angle: -179.82\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 74 name SER cart_bonded term: 0.938061 omega angle: 176.026\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 75 name SER cart_bonded term: 0.939824 omega angle: 177.66\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 76 name THR cart_bonded term: 0.906463 omega angle: -179.395\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 77 name ALA cart_bonded term: 0.938293 omega angle: 178.921\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 78 name SER cart_bonded term: 0.92267 omega angle: -179.041\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 79 name ALA cart_bonded term: 0.76914 omega angle: -179.632\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 80 name LEU cart_bonded term: 1.02434 omega angle: 175.17\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 81 name GLY cart_bonded term: 0.856198 omega angle: -179.101\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 82 name LYS cart_bonded term: 0.860116 omega angle: 176.81\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 83 name LEU cart_bonded term: 1.19734 omega angle: 179.713\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 84 name GLN cart_bonded term: 1.23798 omega angle: -176.391\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 85 name ASP cart_bonded term: 1.30395 omega angle: -174.519\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 86 name VAL cart_bonded term: 1.09603 omega angle: -178.334\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 87 name VAL cart_bonded term: 1.16113 omega angle: -179.068\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 88 name ASN cart_bonded term: 1.36644 omega angle: 179.385\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 89 name GLN cart_bonded term: 1.16084 omega angle: 177.973\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 90 name ASN cart_bonded term: 0.86959 omega angle: 178.786\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 91 name ALA cart_bonded term: 0.717481 omega angle: 178.35\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 92 name GLN cart_bonded term: 0.789405 omega angle: 178.27\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 93 name ALA cart_bonded term: 0.768075 omega angle: 178.062\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 94 name LEU cart_bonded term: 442402 omega angle: 2.4415\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0momega 94 THR fail\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mcart_bond 94 THR fail\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 95 name THR cart_bonded term: 442403 omega angle: 178.586\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mcart_bond 95 GLN fail\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 96 name GLN cart_bonded term: 1.7819 omega angle: 170.657\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 97 name ASN cart_bonded term: 1.56583 omega angle: -177.367\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 98 name VAL cart_bonded term: 1.1231 omega angle: 179.951\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 99 name LEU cart_bonded term: 0.912556 omega angle: -178.16\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 100 name TYR cart_bonded term: 0.950977 omega angle: 179.245\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 101 name GLU cart_bonded term: 2.32134 omega angle: 175.316\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 102 name ASN cart_bonded term: 2.19715 omega angle: -179.956\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 103 name GLN cart_bonded term: 0.829659 omega angle: 178.756\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 104 name LYS cart_bonded term: 1.68345 omega angle: -177.52\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 105 name LEU cart_bonded term: 1.713 omega angle: -177.967\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 106 name ILE cart_bonded term: 0.922852 omega angle: 179.673\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 107 name ALA cart_bonded term: 0.886395 omega angle: -177.51\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 108 name ASN cart_bonded term: 0.957248 omega angle: -178.758\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 109 name GLN cart_bonded term: 0.995348 omega angle: 176.882\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 110 name PHE cart_bonded term: 0.742062 omega angle: -177.916\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 111 name ASN cart_bonded term: 0.655874 omega angle: 178.905\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 112 name SER cart_bonded term: 0.937037 omega angle: -176.021\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 113 name ALA cart_bonded term: 1.27419 omega angle: -177.435\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 114 name ILE cart_bonded term: 1.32497 omega angle: 176.096\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 115 name GLY cart_bonded term: 0.91721 omega angle: 179.027\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 116 name LYS cart_bonded term: 0.706815 omega angle: -178.882\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 117 name ILE cart_bonded term: 1.01628 omega angle: 178.741\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 118 name GLN cart_bonded term: 1.0381 omega angle: -176.927\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 119 name ASP cart_bonded term: 1.51152 omega angle: -176.772\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 120 name SER cart_bonded term: 1.48337 omega angle: 177.896\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 121 name LEU cart_bonded term: 0.721002 omega angle: 179.605\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 122 name SER cart_bonded term: 0.899755 omega angle: 177.462\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 123 name SER cart_bonded term: 1.06045 omega angle: 177.723\n",
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+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 125 name ALA cart_bonded term: 0.929567 omega angle: 179.952\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 126 name SER cart_bonded term: 1.13179 omega angle: 179.892\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 127 name ALA cart_bonded term: 0.898048 omega angle: 178.347\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 128 name LEU cart_bonded term: 0.779054 omega angle: 175.875\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 129 name GLY cart_bonded term: 0.783363 omega angle: -179.325\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 130 name LYS cart_bonded term: 1.14905 omega angle: 177.382\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 131 name LEU cart_bonded term: 1.41472 omega angle: -179.004\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 132 name GLN cart_bonded term: 1.03909 omega angle: -178.402\n",
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+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 134 name VAL cart_bonded term: 0.918267 omega angle: -177.335\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 135 name VAL cart_bonded term: 1.36166 omega angle: 177.476\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 136 name ASN cart_bonded term: 1.4979 omega angle: 178.255\n",
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+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 138 name ASN cart_bonded term: 1.28096 omega angle: -178.991\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 139 name ALA cart_bonded term: 0.974157 omega angle: -179.862\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 140 name GLN cart_bonded term: 0.733222 omega angle: 179.286\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 143 name ASP cart_bonded term: 0.0968812 omega angle: -175.509\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 144 name GLU cart_bonded term: 0.11277 omega angle: -177.807\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 145 name GLU cart_bonded term: 0.0182901 omega angle: 179.199\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 146 name GLU cart_bonded term: 0.0131132 omega angle: 178.262\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 147 name GLU cart_bonded term: 0.0312365 omega angle: 177.536\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 148 name CYS cart_bonded term: 0.036094 omega angle: -177.923\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 149 name GLU cart_bonded term: 0.0343167 omega angle: 177.936\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 150 name LYS cart_bonded term: 0.0345687 omega angle: -179.884\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 151 name ILE cart_bonded term: 0.10029 omega angle: -179.868\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 152 name ILE cart_bonded term: 0.166292 omega angle: -179.799\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 153 name GLU cart_bonded term: 0.0938737 omega angle: 178.224\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 154 name GLU cart_bonded term: 0.0180204 omega angle: 178.895\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 155 name LEU cart_bonded term: 0.0241292 omega angle: -179.502\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 156 name LEU cart_bonded term: 0.0823304 omega angle: 176.302\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 157 name GLU cart_bonded term: 0.0829067 omega angle: 177.877\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 158 name LYS cart_bonded term: 0.0381953 omega angle: 179.165\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 159 name ALA cart_bonded term: 0.101668 omega angle: -179.788\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 160 name ARG cart_bonded term: 0.122075 omega angle: 176.848\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 161 name LYS cart_bonded term: 0.0784963 omega angle: -177.505\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 162 name LEU cart_bonded term: 0.352932 omega angle: 170.924\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 163 name GLY cart_bonded term: 0.374447 omega angle: 175.825\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 164 name VAL cart_bonded term: 0.37323 omega angle: -171.463\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 165 name SER cart_bonded term: 0.430575 omega angle: 179.471\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 166 name GLU cart_bonded term: 0.11905 omega angle: -179.614\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 167 name ILE cart_bonded term: 0.146464 omega angle: 175.843\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 168 name GLU cart_bonded term: 0.310195 omega angle: 173.203\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 169 name TYR cart_bonded term: 0.174949 omega angle: 179.448\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 170 name TYR cart_bonded term: 0.0231926 omega angle: 178.719\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 171 name ILE cart_bonded term: 0.18862 omega angle: 174.614\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 172 name ALA cart_bonded term: 0.246517 omega angle: 179.517\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 173 name ARG cart_bonded term: 0.0873521 omega angle: -178.057\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 174 name LEU cart_bonded term: 0.0339888 omega angle: 179.981\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 175 name LEU cart_bonded term: 0.0353936 omega angle: 179.746\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 176 name LEU cart_bonded term: 0.0566418 omega angle: 177.386\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 177 name VAL cart_bonded term: 0.143644 omega angle: 176.769\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 178 name ALA cart_bonded term: 0.239817 omega angle: 175.841\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 179 name LEU cart_bonded term: 0.167174 omega angle: 178.437\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 180 name LYS cart_bonded term: 0.0577323 omega angle: 178.956\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 181 name LEU cart_bonded term: 0.107737 omega angle: -175.507\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 182 name ARG cart_bonded term: 0.127925 omega angle: 177.344\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 183 name GLY cart_bonded term: 0.0548393 omega angle: 178.384\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 184 name VAL cart_bonded term: 0.216583 omega angle: -173.562\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 185 name SER cart_bonded term: 0.320033 omega angle: -178.315\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 186 name CYS cart_bonded term: 0.137426 omega angle: -177.335\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 187 name GLU cart_bonded term: 0.0807207 omega angle: 176.006\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 188 name GLU cart_bonded term: 0.0673844 omega angle: 178.174\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 189 name LEU cart_bonded term: 0.0466945 omega angle: 177.696\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 190 name GLN cart_bonded term: 0.0592361 omega angle: 177.322\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 191 name LYS cart_bonded term: 0.0597081 omega angle: 177.357\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 192 name PHE cart_bonded term: 0.0384357 omega angle: -179.341\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 193 name ALA cart_bonded term: 0.0850748 omega angle: -179.425\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 194 name GLU cart_bonded term: 0.0842433 omega angle: 179.469\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 195 name GLU cart_bonded term: 0.00442329 omega angle: 179.423\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 196 name PHE cart_bonded term: 0.0470232 omega angle: -176.49\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 197 name ILE cart_bonded term: 0.133758 omega angle: 178.626\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 198 name GLU cart_bonded term: 0.0939906 omega angle: 178.771\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 199 name GLU cart_bonded term: 0.0140631 omega angle: 178.586\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 200 name ALA cart_bonded term: 0.0926163 omega angle: 179.515\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 201 name ARG cart_bonded term: 0.0868933 omega angle: 179.905\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mresidue 203 name LYS cart_bonded term: 0.5404750.540475\n",
+ "\u001b[0mprotocols.simple_filters.GeometryFilter: {0} \u001b[0mfailing.\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "False"
+ ]
+ },
+ "execution_count": 28,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "''')\n",
+ "\n",
+ "geometry_filter = xml.get_filter('geometry_filter')\n",
+ "geometry_filter.apply(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "45fddaa1-f596-41ca-add0-ecbac70890b7",
+ "metadata": {},
+ "source": [
+ "#### 6.4 PreProlineFilter\n",
+ "螺旋空间（Abego，ABEGO type A）在pro之前一般不倾向形成，但Rosetta可能捕捉不到该信息。在默认模式下，该filter会检查所有pro残基之前的所有残基，计算那些非B类型和非E类型（越少越好）。\n",
+ "1. use_statistical_potential：true表示使用基于拉式图构象空间bicublic spline fit会被用来评估该扭转角。false表示使用不合理扭转角的bin范围内的残基被计数"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 29,
+ "id": "7c56bc37-8447-43f4-bc88-6cfe35fd788b",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: protocol_data/denovo_design/preproline_normalized.gz\n",
+ "\u001b[0mprotocols.denovo_design.PreProlineFilter: {0} \u001b[0mX start: -180 delta: 11.25\n",
+ "\u001b[0mprotocols.denovo_design.PreProlineFilter: {0} \u001b[0mY start: -180 delta: 11.25\n",
+ "\u001b[0mprotocols.denovo_design.PreProlineFilter: {0} \u001b[0mSpline for preproline residues has been trained from protocol_data/denovo_design/preproline_normalized.gz.\n",
+ "\u001b[0mprotocols.denovo_design.PreProlineFilter: {0} \u001b[0mProlines in pose: 3 Bad pre-proline torsions: 0\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 29,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.denovo_design.filters import PreProlineFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "prepro_filter = PreProlineFilter()\n",
+ "prepro_filter.set_use_statistical_potential(False)\n",
+ "# prepro_filter.set_selector() # 设置残基选择器\n",
+ "prepro_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "1094e2b8-d49d-4821-9306-3bea10a05256",
+ "metadata": {},
+ "source": [
+ "#### 6.5 SecondaryStructure\n",
+ "基于二级结构的Filter。比较pose的二级结构与定义的二级结构间的差异。报告N_MATCHING / N_TOTAL的值：\n",
+ "- N_MATCHING 为选取部分的残基中有多少与定义理想的二级结构一致\n",
+ "- N_TOTAL 为选取的残基总数。\n",
+ "\n",
+ "若set_use_dssp选项为false（默认为false），必须实现为pose计算二级结构信息，例如使用DsspMover；设定为true则会自动调用DSSP计算pose二级结构。\n",
+ "\n",
+ "该Filter定义二级结构的输入有多种来源:\n",
+ "1. 用户定义的二级结构类型\n",
+ "2. blueprint文件(也是用户定义的二级结构类型)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 30,
+ "id": "5b376a6c-1151-4f94-b47e-df9dc7c4db7d",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.denovo_design.components.StructureDataFactory: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m -run:preserve_header is required for using \"Tomponents\" -- setting it to true. To avoid this message, include -run:preserve header true in your flags\n",
+ "\u001b[0mprotocols.denovo_design.residue_selectors.PairedSheetResidueSelector: {0} \u001b[0mCould not determine strand pairings! You must specify them using the \"sheet_topology\" option or attach a StructureData object to the pose. No residues will be selected.\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 1\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 2\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 3\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 4\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 5\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 6\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 7\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 8\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 9\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 10\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 11\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 12\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 13\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 14\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 15\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 16\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 17\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 18\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 19\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 20\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 21\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 22\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 35\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 36\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 37\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 41\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 42\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 43\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 44\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 45\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 46\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 47\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 48\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 49\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 50\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 51\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 52\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 53\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 54\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 55\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 56\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 60\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 61\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 62\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 63\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 64\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 65\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 66\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 67\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 68\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 69\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 70\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = E/H at position 71\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 72\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 73\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 74\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 75\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mSS filter fail: current/filtered = L/H at position 76\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureFilter: {0} \u001b[0mHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHH was filtered with 18 residues matching LEEEEEELLLLEEEEELLLLLEHHHHHHHHHHHHLLLHHHEEEEELLEELLLLLELHHHLLLLLLEEEEEELLLLL\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "False"
+ ]
+ },
+ "execution_count": 30,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.fldsgn.filters import SecondaryStructureFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "# 使用定义的二级结构:\n",
+ "ss_contain_filter = SecondaryStructureFilter()\n",
+ "ss_contain_filter.filtered_ss('HHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHH')\n",
+ "\n",
+ "# 使用blueprint:\n",
+ "# ss_contain_filter.set_blueprint($bp_file_name)\n",
+ "\n",
+ "ss_contain_filter.set_use_dssp(True)\n",
+ "ss_contain_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "d6cbdfe8-7c6d-45eb-8346-f9051b2e7aca",
+ "metadata": {},
+ "source": [
+ "#### 6.6 SecondaryStructureCoun(xmlobject)\n",
+ "基于单个二级结构元件计数的filter。计算给定类型的DSSP定义的二级结构的类型的数目。\n",
+ "\n",
+ "- filter_helix, filter_sheet, filter_loop: true 分别表示在helix，sheet，loop二级结构上进行过滤\n",
+ "- filter_helix_sheet：filter on helix and sheet\n",
+ "- num_helix，num_sheet，num_loop，num_helix_sheet：需要多少数目的对应二级结构才能通过该filter\n",
+ "- min_helix_length，max_helix_length：最少和最大的helix氨基酸数目才会被当作一个helix，默认值4和9999\n",
+ "- min_sheet_length，max_sheet_length，min_loop_length，max_loop_length与上一条类似\n",
+ "- return_total：true表示将过滤的二级结构元件的总数目记录到score文件。默认为0.\n",
+ "- residue_selector：氨基酸选择器\n",
+ "- min_element_resis：一个二级结构原件的最少残基数目（作为计数基础），默认为1."
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 31,
+ "id": "db8b7dd9-ab16-4d16-b339-d9ebef24f9b4",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.DsspMover: {0} \u001b[0mLEEEEEELLLLEEEEELLLLLEHHHHHHHHHHHHLLLHHHEEEEELLEELLLLLELHHHLLLLLLEEEEEELLLLL\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureCountFilter: {0} \u001b[0mfilter on 2 helix with length: 4-999\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureCountFilter: {0} \u001b[0mfilter on 2 sheet with length: 3-999\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureCountFilter: {0} \u001b[0mfilter on 2 loop with length: 1-999\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"ss_count_filter\" of type SecondaryStructureCount\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureCountFilter: {0} \u001b[0mLEEEEEELLLLEEEEELLLLLEHHHHHHHHHHHHLLLHHHEEEEELLEELLLLLELHHHLLLLLLEEEEEELLLLL\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureCountFilter: {0} \u001b[0m Pose has 1 helix, 4 sheet, 9 loop (filtered elements), according to dssp_reduced definition.\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureCountFilter: {0} \u001b[0mReturning TOTAL number of filtered SS elements into score file.\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "14"
+ ]
+ },
+ "execution_count": 31,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "from pyrosetta.rosetta.protocols.moves import DsspMover\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "DsspMover().apply(pose)\n",
+ "\n",
+ "# 定义Filter\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "''')\n",
+ "\n",
+ "ss_count_filter = xml.get_filter('ss_count_filter')\n",
+ "ss_count_filter.compute(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "4444be19-16ac-4e7f-8091-fcfbd135b93e",
+ "metadata": {},
+ "source": [
+ "#### 6.7 SecondaryStructureHasResidue(xmlobject)\n",
+ "计算二级结构元件部分位点是否含有N个或更多的某特定残基。在de novo设计中，用于检查各个二级结构是否存在至少一个疏水残基等用途。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 32,
+ "id": "aeba7ddd-71b7-4522-b5eb-6b29eb16b678",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mbeta_nov16.wts\u001b[0m\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0mInitializing the layers with the default residues\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0mLayers to be designed:\tboundary\tcore\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0mLayer Cterm\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tall aa = ACDEFGHIKLMNPQRSTVWY\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0mLayer Nterm\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tall aa = ACDEFGHIKLMNPQRSTVWY\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0mLayer boundary\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tHelix aa = ADEIKLNQRSTVWY\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tHelixCapping aa = DNST\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tHelixStart aa = ADEIKLNQRSTVWYP\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tLoop aa = ADEFGIKLNPQRSTVWY\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tStrand aa = DEFIKLNQRSTVWY\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tall aa = ADEFGIKLNPQRSTVWY\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0mLayer core\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tHelix aa = AFILVWY\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tHelixCapping aa = DNST\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tHelixStart aa = AFILVWYP\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tLoop aa = AFILPVWY\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tStrand aa = FILVWY\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tall aa = AFILPVWYDNST\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0mLayer surface\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tHelix aa = DEHKNQRST\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tHelixCapping aa = DNST\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tHelixStart aa = DEHKNQRSTP\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tLoop aa = DEGHKNPQRST\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tStrand aa = DEHKNQRST\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\tall aa = DEGHKNPQRST\n",
+ "\u001b[0mprotocols.flxbb.LayerDesignOperation: {0} \u001b[0m\n",
+ "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: {0} \u001b[0mDefined TaskOperation named \"layer_core_boundary\" of type LayerDesign\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureHasResidueFilter: {0} \u001b[0mfilter on helix with length: 4-9999\n",
+ "\u001b[0mprotocols.fldsgn.filters.SecondaryStructureHasResidueFilter: {0} \u001b[0mfilter on sheet with length: 3-9999\n",
+ "\u001b[0mcore.pack.task.xml_util: {0} \u001b[0mAdding the following task operations\n",
+ "layer_core_boundary\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"ss_contributes_core\" of type SecondaryStructureHasResidue\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "from pyrosetta.rosetta.protocols.moves import DsspMover\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string(\"\"\"\n",
+ "\n",
+ " \n",
+ "\n",
+ "\n",
+ " \n",
+ "\"\"\")\n",
+ "\n",
+ "ss_contributes_core = xml.get_filter('ss_contributes_core')\n",
+ "# ss_contributes_core.compute(pose) # 输出较多，读者请自行运行"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "b4024325-1cba-4cc4-b882-3abcfcdd9365",
+ "metadata": {},
+ "source": [
+ "#### 6.8 LoopAnalyzerFilter\n",
+ "使用 LoopAnalyzerMover 计算与loop相关的一些metrics:\n",
+ "- loop骨架的omega是否异常\n",
+ "- loop骨架中是否有chainbreak\n",
+ "- loop骨架中的rama二面角能量项是否超出20个能量单位（非常不合理）"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 33,
+ "id": "96e9f795-6e1f-4c73-8391-d6c5ee7dea31",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mprotocols.loops.filters.LoopAnalyzerFilter: {0} \u001b[0mrunning LoopAnalyzerFilter\n",
+ "\u001b[0mprotocols.analysis.LoopAnalyzerMover: {0} \u001b[0mrunning LoopAnalyzerMover\n",
+ "\u001b[0mprotocols.analysis.LoopAnalyzerMover: {0} \u001b[0mLoopAnalyzerMover will consider these positions (Rosetta numbering) - remember that it includes an extra residue on both sides of each loop, conditions permitting: 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57\n",
+ "\u001b[0mprotocols.evaluation.ChiWellRmsdEvaluatorCreator: {0} \u001b[0mEvaluation Creator active ...\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "-32.30644512437591"
+ ]
+ },
+ "execution_count": 33,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.loops.filters import LoopAnalyzerFilter\n",
+ "from pyrosetta.rosetta.protocols.loops import Loop, Loops\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/1ubq_clean.pdb')\n",
+ "\n",
+ "# 设置Loop的区域:\n",
+ "# define a loop;\n",
+ "loop = Loop(44, 56, 45) # start_res, end_res, cut_res\n",
+ "loops = Loops()\n",
+ "loops.add_loop(loop) # add to loops object;\n",
+ "\n",
+ "loop_analyzer = LoopAnalyzerFilter()\n",
+ "loop_analyzer.set_loops(loops)\n",
+ "loop_analyzer.report_sm(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "8a30888d-d027-434e-bc6a-cdaaca6c4452",
+ "metadata": {},
+ "source": [
+ "#### 6.9 HelixPairing\n",
+ "用于判断Pose中每两个螺旋的Packing几何特征是否正常。该Filter首先计算一个pose的二级结构，然后利用二级结构去找到螺旋部分。\n",
+ "\n",
+ "对于螺旋pairing，该filter提供三个参数，dist，cross和align，一个pose的这些参数低于设定阈值的话将被reject掉。\n",
+ "\n",
+ "- dist: 两个螺旋中点的距离;\n",
+ "- cross: 两个螺旋之间的packing角度，该角度由helix vector间的夹角决定。helix vector由每段螺旋的C->N端几何中心xyz坐标相减计算得到。\n",
+ "- align: 当两股螺旋之间存在beta strands时，计算cross时，先将helix vector投影在beta strands上，再进行cross angle的计算。\n",
+ "\n",
+ "最关键的参数设置是helix_pairings，通用匹配字符串为: \"helix_id1-helix_id2.Type\"：\n",
+ "- helix_id1/2: 指定螺旋的序号；\n",
+ "- Type：可选A或P，代表平行或反平行；\n",
+ "\n",
+ "举例, 如果我希望检查第一个螺旋与第二个螺旋之间的packing，需要设置为:\"1-2.A\"，含义是:1-2螺旋之间的packing，并且1和2螺旋之间的排布是反平行的。\n",
+ "\n",
+ "如果设置多段螺旋: \"1-2.A;2-3.A;1-3.P\", 不同的packing检查之间用分号隔开。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 34,
+ "id": "dea7d8f3-b3d1-4095-b2a1-ae3f13a2001b",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_helix.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 6 44\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 6 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 44 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 6 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 44 CYD\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0mHelix 1is bent, angle=30.2685\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m Filter condition:\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m bend ( intra helix ) <= 20\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m dist <= 15\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m cross <= 45\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m align <= 25\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m#### HelixPairingSet Info\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m# 1-2.A;2-3.A\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m# name distance cross_angle align_angle\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m# 1-2.A 13.518 24.177 -99.000\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m# 2-3.A 10.166 24.434 -99.000\n",
+ "\u001b[0mprotocols.fldsgn.filters.HelixPairingFilter: {0} \u001b[0m Filter failed !\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "False"
+ ]
+ },
+ "execution_count": 34,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.fldsgn.filters import HelixPairingFilter\n",
+ "\n",
+ "# 读取三螺旋拓扑结构\n",
+ "pose = pose_from_pdb('./data/denovo_helix.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "hpair_filter = HelixPairingFilter()\n",
+ "hpair_filter.helix_pairings('1-2.A;2-3.A')\n",
+ "# hpair_filter.dist(15)\n",
+ "# hpair_filter.cross_angle(45)\n",
+ "# hpair_filter.align_angle(25)\n",
+ "# hpair_filter.bend_angle(20)\n",
+ "hpair_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "c9f8cb00-9548-47b6-aac7-61f2b1ee6c1e",
+ "metadata": {},
+ "source": [
+ "#### 6.10 HSSTriplet\n",
+ "评估给定的helix-strand-strand三联（HSS triplet）结构。计算strand pair与helix之间的距离以及sheet平面和helix之间的角度。若距离计算值处于min_dist和max_dist选项设定值且角度计算值处于min_angle和max_angle选项设定值，则返回true。\n",
+ "\n",
+ "关键参数（默认）:\n",
+ "- min_dist=\"(7.5 &Real)\" \n",
+ "- max_dist=\"(13.0 &Real)\" \n",
+ "- min_angle=\"(-12.5 &Real)\" \n",
+ "- max_angle=\"(90.0 &Real)\"\n",
+ "\n",
+ "关键的参数设置是add_hsstriplets，通用匹配字符串为: \"helix_id1,strand_id1-strand_id2\"：\n",
+ "helix_id: 指定螺旋的序号；\n",
+ "strand_id1/2：指定beta片的序号；\n",
+ "\n",
+ "如果设置HSS pakcing: \"1,2-3;2,3-4\", 不同的packing检查之间用分号隔开。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 35,
+ "id": "04cd218e-0952-47fe-a8d1-4da3c2a3232d",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_hee.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.fldsgn.filters.HSSTripletFilter: {0} \u001b[0mHelix:1 Strand1:1 Strand2:2 hsheet_dist=9.14642, hs_angle=-150.393, hs_dist1=9.10143, hs_dist2=9.1914\n",
+ "\u001b[0mprotocols.fldsgn.filters.HSSTripletFilter: {0} \u001b[0m Filter failed !\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "False"
+ ]
+ },
+ "execution_count": 35,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.fldsgn.filters import HSSTripletFilter\n",
+ "\n",
+ "# 读取拓扑结构\n",
+ "pose = pose_from_pdb('./data/denovo_hee.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "hss_filter = HSSTripletFilter()\n",
+ "hss_filter.add_hsstriplets('1,1-2')\n",
+ "# hss_filter.filter_max_angle(90)\n",
+ "# hss_filter.filter_min_angle(-12.5)\n",
+ "# hss_filter.filter_max_dist(13)\n",
+ "# hss_filter.filter_min_dist(7.5)\n",
+ "hss_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "6cd45a4d-5737-4dcf-852e-a82238b61624",
+ "metadata": {},
+ "source": [
+ "### 7. Packing/Connectivity"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "073b4987-6d5f-4ee8-bfd9-11a754cd6276",
+ "metadata": {},
+ "source": [
+ "#### 7.1 AverageDegree\n",
+ "计算与一个残基选择部分的定义距离内残基的平均连通度。\n",
+ "\n",
+ "当Rosetta用于复合物界面的设计中时，可能引起过度优化，看似“完美的”Rotamer的构象其实在单体中并不稳定。\n",
+ "\n",
+ "使用此Filter能够区分从天然复合物中区分没有相互作用的design。\n",
+ "\n",
+ "参数:\n",
+ "- threshold：至少需要存在多少个氨基酸在选择部分氨基酸的范围内(9.4)\n",
+ "- distance_threshold：定义计算距离的范围大小(8.0)\n",
+ "- task_operations定义针对哪些残基进行该计算"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 36,
+ "id": "3b10382c-5761-4e5b-b183-e49122665c86",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ALA19 is 11\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LYS22 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ILE23 is 11\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ASP25 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of SER26 is 11\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of SER29 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of THR30 is 12\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of SER32 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ALA33 is 10\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LYS36 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LEU37 is 14\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ILE114 is 10\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of GLY115 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ILE117 is 11\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of GLN118 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ASP119 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LEU121 is 10\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of SER122 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of THR124 is 13\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ALA125 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LEU128 is 14\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of GLY129 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LEU131 is 14\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of GLN132 is 10\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ASN136 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of SER165 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of GLU166 is 7\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ILE167 is 7\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of GLU168 is 12\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of TYR170 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ILE171 is 10\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ARG173 is 10\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LEU174 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LEU175 is 11\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of VAL177 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ALA178 is 9\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LYS180 is 10\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of LEU181 is 7\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.AverageDegreeFilter: {0} \u001b[0mConnectivity of ARG182 is 7\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "9.871794871794872"
+ ]
+ },
+ "execution_count": 36,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.protein_interface_design.filters import AverageDegreeFilter\n",
+ "from pyrosetta.rosetta.core.pack.task import TaskFactory\n",
+ "from pyrosetta.rosetta.protocols.simple_task_operations import RestrictToInterface\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb')\n",
+ "\n",
+ "# ppi task_factory\n",
+ "tf = TaskFactory()\n",
+ "tf.push_back(RestrictToInterface())\n",
+ "\n",
+ "# 定义Filter\n",
+ "average_degree_filter = AverageDegreeFilter()\n",
+ "average_degree_filter.task_factory(tf)\n",
+ "average_degree_filter.distance_threshold(8)\n",
+ "average_degree_filter.threshold(9.4)\n",
+ "average_degree_filter.compute(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "2e20f4b1-73ba-4b9f-8ca6-018ef980a782",
+ "metadata": {},
+ "source": [
+ "#### 7.2 PackStat\n",
+ "基于packing统计量的filter\n",
+ "\n",
+ "参数:\n",
+ "- threshold：最低阈值\n",
+ "- chain：在计算packstate之前从哪一个jump开始分离复合物。0表示不分离\n",
+ "- repeats：重复计算次数"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 37,
+ "id": "25c8b5b7-928c-46dc-8a56-12e235b38706",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_hee.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.filters.PackStatFilter: {0} \u001b[0mrepeat 1: packscore: 0.737467\n",
+ "\u001b[0mprotocols.filters.PackStatFilter: {0} \u001b[0mrepeat 2: packscore: 0.777977\n",
+ "\u001b[0mprotocols.filters.PackStatFilter: {0} \u001b[0mrepeat 3: packscore: 0.714652\n",
+ "\u001b[0mprotocols.filters.PackStatFilter: {0} \u001b[0mrepeat 4: packscore: 0.76972\n",
+ "\u001b[0mprotocols.filters.PackStatFilter: {0} \u001b[0mrepeat 5: packscore: 0.790474\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import PackStatFilter\n",
+ "\n",
+ "# 读取拓扑结构\n",
+ "pose = pose_from_pdb('./data/denovo_hee.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "packsat_filter = PackStatFilter()\n",
+ "packsat_filter.repeats_ = 5\n",
+ "packsat_filter.chain_ = 0 # 不是复合物结构这个案例。如有需要按照jump num进行设置。\n",
+ "packstate = packsat_filter.compute(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "c56b947c-d3c0-4033-b23f-e5e5f9ff5741",
+ "metadata": {},
+ "source": [
+ "#### 7.3 Holes\n",
+ "寻找packing中的空腔。仍然是使用will sheffler的packing代码（packstat）计算蛋白内部空腔的体积大小。但是这一允许传入氨基酸选择器，仅使用部分氨基酸（蛋白部分进行计算）。但是值得注意是，这里的计算仍然是把pose作为整体进行计算，只是report得分的时候，只有在选择器中的原子才会被计算总和。（Holes打分是对单个原子/残基进行计算得分值得总和。）\n",
+ "\n",
+ "结果如果正说明比天然蛋白结构(PDB库)更多空腔，负说明更少空腔。\n",
+ "\n",
+ "**特别注意: 此处需要额外编译安装dalphaball**:\n",
+ "- 此处提供data文件夹中两种二进制的dalphaball（MacOS、Ubuntu）"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 38,
+ "id": "257f7b3e-aff2-4b3d-aab0-29e991ba10be",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -holes:dalphaball ./data/DAlphaBall.macgcc -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=1495719393 seed_offset=0 real_seed=1495719393 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=1495719393 RG_type=mt19937\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_hee.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mcore.select.residue_selector.LayerSelector: {0} \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
+ "\u001b[0mcore.select.residue_selector.LayerSelector: {0} \u001b[0mSet cutoffs for core and surface to 5.2 and 2, respectively, in LayerSelector.\n",
+ "\u001b[0mcore.select.residue_selector.LayerSelector: {0} \u001b[0mSetting LayerSelector to use sidechain neighbors to determine burial.\n",
+ "\u001b[0mcore.select.residue_selector.LayerSelector: {0} \u001b[0mSetting core=true boundary=false surface=false in LayerSelector.\n",
+ "\u001b[0mcore.select.residue_selector.LayerSelector: {0} \u001b[0mSetting radius for rolling ball algorithm to 2 in LayerSelector. (Note that this will have no effect if the sidechain neighbors method is used.)\n",
+ "\u001b[0mcore.select.residue_selector.LayerSelector: {0} \u001b[0mSet cutoffs for core and surface to 3.5 and 1.5, respectively, in LayerSelector.\n",
+ "\u001b[0mprotocols.simple_filters.HolesFilter: {0} \u001b[0m computing using residue selector\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_surfs try: 1\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_surfs completed successfully\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_score done: 7.43944\n",
+ "\u001b[0mprotocols.simple_filters.HolesFilter: {0} \u001b[0m total holes score for selection = -66.284\n",
+ "\u001b[0mprotocols.simple_filters.HolesFilter: {0} \u001b[0m normalize_per_atom holes score = -0.454\n",
+ "\u001b[0mprotocols.simple_filters.HolesFilter: {0} \u001b[0m normalize_per_residue holes score = -7.36489\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.select.residue_selector import LayerSelector\n",
+ "from pyrosetta.rosetta.protocols.simple_filters import HolesFilter\n",
+ "\n",
+ "# 初始化DAlphaBall\n",
+ "DAlphaBall_path = './data/DAlphaBall.macgcc'\n",
+ "init(f'-holes:dalphaball {DAlphaBall_path}')\n",
+ "\n",
+ "# 读取拓扑结构\n",
+ "pose = pose_from_pdb('./data/denovo_hee.pdb')\n",
+ "\n",
+ "# 选择内核层氨基酸\n",
+ "layer = LayerSelector()\n",
+ "layer.set_use_sc_neighbors(True)\n",
+ "layer.set_layers(1, 0, 0) # pick core\n",
+ "layer.set_ball_radius(2.0)\n",
+ "layer.set_cutoffs(3.5, 1.5) # >= 4 neighbor defined as core residuie. for miniprotein.\n",
+ "\n",
+ "# 定义Filter\n",
+ "void_filter = HolesFilter()\n",
+ "void_filter.set_threshold(0)\n",
+ "void_filter.set_residue_selector(layer) # 设置selector\n",
+ "void_score = void_filter.compute(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "5e99689f-8933-4f75-a27a-5e8b045170c5",
+ "metadata": {},
+ "source": [
+ "#### 7.4 InterfaceHoles\n",
+ "在蛋白-蛋白接触界面上计算空腔，使用Will Sheffler's packstat的脚本。报告的打分是指bound和unbound构象的holes得分的差值。需要开启-holes:dalphaball选项。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 39,
+ "id": "8d7046c1-3277-4516-8690-b4968c1f7693",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -holes:dalphaball ./data/DAlphaBall.macgcc -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-1486178363 seed_offset=0 real_seed=-1486178363 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-1486178363 RG_type=mt19937\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_surfs try: 1\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_surfs completed successfully\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_score done: 1705.44\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_score done: 821.556\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_score done: 559.01\n",
+ "\u001b[0mprotocols.moves.RigidBodyMover: {0} \u001b[0mTranslate: Jump (before): RT 0.475346 -0.778522 0.409816 -0.138636 0.393705 0.908722 -0.868807 -0.488773 0.0792154 17.3442 -1.09276 -32.123\n",
+ "\u001b[0mprotocols.moves.RigidBodyMover: {0} \u001b[0mTranslate: Jump (after): RT 0.475346 -0.778522 0.409816 -0.138636 0.393705 0.908722 -0.868807 -0.488773 0.0792154 501.418 498.401 -750.578\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_surfs try: 1\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_surfs completed successfully\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_score done: 1563.02\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_score done: 1750.62\n",
+ "\u001b[0mcore.scoring.packing.compute_holes_score: {0} \u001b[0mcompute_holes_score done: 1356.69\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "-0.5898811825867023"
+ ]
+ },
+ "execution_count": 39,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.select.residue_selector import LayerSelector\n",
+ "from pyrosetta.rosetta.protocols.protein_interface_design.filters import InterfaceHolesFilter\n",
+ "\n",
+ "# 初始化DAlphaBall\n",
+ "DAlphaBall_path = './data/DAlphaBall.macgcc'\n",
+ "init(f'-holes:dalphaball {DAlphaBall_path}')\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "jump_num = 1\n",
+ "interface_void_filter = InterfaceHolesFilter(jump_num, 200)\n",
+ "interface_void_filter.score(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "3d0a037a-e63c-4408-9c68-38bda76720c7",
+ "metadata": {},
+ "source": [
+ "#### 7.5 ResInInterface\n",
+ "基于界面上残基总数的filter。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 40,
+ "id": "040590bf-1b42-47a9-817c-7a8016ed8090",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "39.0"
+ ]
+ },
+ "execution_count": 40,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import ResiduesInInterfaceFilter\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "residues_cutoff = 20\n",
+ "jump_num = 1\n",
+ "interface_resnum_filter = ResiduesInInterfaceFilter(residues_cutoff, jump_num)\n",
+ "interface_resnum_filter.score(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "30d77b00-daa3-48a9-b3ab-e2bc90622539",
+ "metadata": {},
+ "source": [
+ "#### 7.6 ShapeComplementarity\n",
+ "基于界面形状互补的filter。计算 Lawrence & Coleman形状互补系数（系数范围0.6-0.8），系数越大说明两个刚体的匹配程度越高。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 41,
+ "id": "b4ed388f-fb46-4e2a-90a9-12ec109aa576",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/sc/sc_radii.lib\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "0.7477233707904816"
+ ]
+ },
+ "execution_count": 41,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import ShapeComplementarityFilter\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "jump_num = 1\n",
+ "sc_filter = ShapeComplementarityFilter()\n",
+ "sc_filter.jump_id(jump_num) # 设置刚体的jump\n",
+ "sc_filter.multicomp(True)\n",
+ "sc_filter.filtered_sc(0.6) # 阈值;\n",
+ "sc_filter.score(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "3a8b54f0-18f2-4070-828c-4745cda56543",
+ "metadata": {},
+ "source": [
+ "#### 7.7 SSShapeComplementarity\n",
+ "基于二级结构形状互补系数的filter，具体做法是将Pose中的每一段连续的二级结构分离，并与剩余部分计算ShapeComplementarity。\n",
+ "\n",
+ "数值参考:\n",
+ "For antibody-antigen interfaces, a value of 0.65-0.67 is typical, while complementarity among intra-protein secondary structure elements is typically higher, on the order of 0.7-0.8.\n",
+ "\n",
+ "注意: 目前不支持sheet结构。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 42,
+ "id": "ad5ce0c1-eb85-486c-adf4-35362530d642",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_hee.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.denovo_design.SSShapeComplementarityFilter: {0} \u001b[0mSUM=373.625; area=458.515; sc=0.814857; num_res=15\n",
+ "\u001b[0mprotocols.denovo_design.SSShapeComplementarityFilter: {0} \u001b[0mSUM=410.377; area=48.0544; sc=0.764812; num_res=1\n",
+ "\u001b[0mprotocols.denovo_design.SSShapeComplementarityFilter: {0} \u001b[0mSUM=429.074; area=26.9846; sc=0.692857; num_res=2\n",
+ "\u001b[0mprotocols.denovo_design.SSShapeComplementarityFilter: {0} \u001b[0mSUM=522.793; area=129.851; sc=0.721743; num_res=3\n",
+ "\u001b[0mprotocols.denovo_design.SSShapeComplementarityFilter: {0} \u001b[0mSUM=574.004; area=65.587; sc=0.780813; num_res=1\n",
+ "\u001b[0mprotocols.denovo_design.SSShapeComplementarityFilter: {0} \u001b[0mReturning 0.787394\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "0.7873935628335386"
+ ]
+ },
+ "execution_count": 42,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.denovo_design.filters import SSShapeComplementarityFilter\n",
+ "\n",
+ "# 读取拓扑结构\n",
+ "pose = pose_from_pdb('./data/denovo_hee.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "ss_helix = SSShapeComplementarityFilter()\n",
+ "ss_helix.compute(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "a615d650-5415-42a5-a233-eae25ee7b39f",
+ "metadata": {},
+ "source": [
+ "### 8. Burial"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "61c4e9ac-31d5-4967-b86d-3d8579512136",
+ "metadata": {},
+ "source": [
+ "#### 8.1 TotalSasa\n",
+ "基于pose总溶剂可及表面积的filter。高于设定阈值（threshold），返回true。\n",
+ "\n",
+ "参数:\n",
+ "- upper_threshold：最大溶剂可及表面积\n",
+ "- hydrophobic：仅计算与疏水性残基相关的可及表面积\n",
+ "- polar：仅计算与极性残基相关的可及表面积\n",
+ "- task_operations：仅报告可以被pack的残基部分（有taskop指定）的SASA值。若没有指定，则会计算所有残基的SASA\n",
+ "- report_per_residue_sasa：报告单个残基的SASA"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 43,
+ "id": "92707ffd-9bf2-4ebb-8cbf-2b35a0a734ec",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_hee.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mASP1 A HYDROPHOBIC SASA : 30.7547\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mSER2 A HYDROPHOBIC SASA : 4.61109\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mLEU3 A HYDROPHOBIC SASA : 56.5835\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mHIS4 A HYDROPHOBIC SASA : 41.266\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mILE5 A HYDROPHOBIC SASA : 1.53703\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mASN6 A HYDROPHOBIC SASA : 27.683\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mLEU7 A HYDROPHOBIC SASA : 9.48423\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mASP8 A HYDROPHOBIC SASA : 47.4767\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mGLY9 A HYDROPHOBIC SASA : 28.809\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mILE10 A HYDROPHOBIC SASA : 86.6072\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mARG11 A HYDROPHOBIC SASA : 63.5564\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mPHE12 A HYDROPHOBIC SASA : 89.3881\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mGLU13 A HYDROPHOBIC SASA : 26.4057\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mVAL14 A HYDROPHOBIC SASA : 13.8356\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mHIS15 A HYDROPHOBIC SASA : 65.1029\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mGLY16 A HYDROPHOBIC SASA : 19.9837\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mASP17 A HYDROPHOBIC SASA : 40.9676\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mCYS18 A HYDROPHOBIC SASA : 43.8133\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mGLU19 A HYDROPHOBIC SASA : 56.3789\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mCYS20 A HYDROPHOBIC SASA : 61.6269\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mGLU21 A HYDROPHOBIC SASA : 19.2258\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mLEU22 A HYDROPHOBIC SASA : 6.66516\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mLYS23 A HYDROPHOBIC SASA : 80.6085\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mARG24 A HYDROPHOBIC SASA : 90.1643\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mLEU25 A HYDROPHOBIC SASA : 69.6975\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mGLU26 A HYDROPHOBIC SASA : 11.543\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mGLU27 A HYDROPHOBIC SASA : 35.6255\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mGLU28 A HYDROPHOBIC SASA : 27.9356\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mALA29 A HYDROPHOBIC SASA : 5.89312\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mARG30 A HYDROPHOBIC SASA : 47.5776\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mARG31 A HYDROPHOBIC SASA : 96.3054\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mARG32 A HYDROPHOBIC SASA : 65.3391\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mMET33 A HYDROPHOBIC SASA : 31.5666\n",
+ "\u001b[0mprotocols.simple_filters.TotalSasaFilter: {0} \u001b[0mARG34 A HYDROPHOBIC SASA : 80.7258\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "1484.7443573729436"
+ ]
+ },
+ "execution_count": 43,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import TotalSasaFilter\n",
+ "\n",
+ "# 读取拓扑结构\n",
+ "pose = pose_from_pdb('./data/denovo_hee.pdb')\n",
+ "\n",
+ "# 定义Filter（定义了疏水面积）\n",
+ "tsasa = TotalSasaFilter(lower_threshold=1200, hydrophobic=True, polar=False, upper_threshold=2000, report_per_residue_sasa=True)\n",
+ "tsasa.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "f0569e46-60d4-45c2-b7c8-26e7fb59f4ae",
+ "metadata": {},
+ "source": [
+ "#### 8.2 InterfaceSasaFilter\n",
+ "基于蛋白-蛋白相互作用界面上溶剂可及表面积的filter。高于设定阈值，返回true。\n",
+ "\n",
+ "参数:\n",
+ "- upper_threshold：最大溶剂可及表面积\n",
+ "- jump：用于计算SASA的界面jump\n",
+ "- sym_dof_names：对于存在对称定义的pose，进一步指定计算何界面的SASA"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 44,
+ "id": "9efdb9c8-c14c-49d0-86d7-c3139f10f2b1",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mprotocols.moves.RigidBodyMover: {0} \u001b[0mTranslate: Jump (before): RT 0.475346 -0.778522 0.409816 -0.138636 0.393705 0.908722 -0.868807 -0.488773 0.0792154 17.3442 -1.09276 -32.123\n",
+ "\u001b[0mprotocols.moves.RigidBodyMover: {0} \u001b[0mTranslate: Jump (after): RT 0.475346 -0.778522 0.409816 -0.138636 0.393705 0.908722 -0.868807 -0.488773 0.0792154 501.418 498.401 -750.578\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "1605.8146206639158"
+ ]
+ },
+ "execution_count": 44,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import InterfaceSasaFilter\n",
+ "from pyrosetta.rosetta.core.pose.metrics import CalculatorFactory, simple_calculators\n",
+ "\n",
+ "# interface sasa 计算器初始化\n",
+ "calculator_factory = CalculatorFactory.Instance()\n",
+ "if not calculator_factory.check_calculator_exists(\"sasa\"):\n",
+ " sasa_calculator = simple_calculators.SasaCalculatorLegacy()\n",
+ " calculator_factory.register_calculator(\"sasa\", sasa_calculator)\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb') \n",
+ "\n",
+ "# 定义Filter\n",
+ "jump_num = 1\n",
+ "cutoff = 1200\n",
+ "dsasa = InterfaceSasaFilter(cutoff) # 1200A\n",
+ "dsasa.add_jump(jump_num)\n",
+ "dsasa.score(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "7204df8a-c3eb-4324-bb07-1a55809d6d48",
+ "metadata": {},
+ "source": [
+ "#### 8.3 ResidueBurial\n",
+ "简单来说就是计算目标残基的某相互作用距离（distance选项）下范围的其他残基数。若设定neighbors为1，既仅仅检查蛋白-蛋白相互作用界面附近是否存在残基。\n",
+ "\n",
+ "参数:\n",
+ "- residue_fraction_buried：被taskop定义为designable的总残基的分数，默认为0.0001"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 45,
+ "id": "2e2cecb6-9a34-4d79-b78a-3d07b2778969",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mprotocols.simple_filters.ResidueBurialFilter: {0} \u001b[0mResidue: 30 is serialized to: 30\n",
+ "\u001b[0mprotocols.simple_filters.ResidueBurialFilter: {0} \u001b[0mchain span 1 142\n",
+ "\u001b[0mprotocols.simple_filters.ResidueBurialFilter: {0} \u001b[0mNumber of interface neighbors of residue THR30 is 2\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 45,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import ResidueBurialFilter\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb') \n",
+ "\n",
+ "# 定义Filter\n",
+ "rb_filter = ResidueBurialFilter()\n",
+ "# rb_filter.neighbors(1) # 仅检查界面附近是否存在残基\n",
+ "rb_filter.residue('30') # 检查残基的pose id.\n",
+ "# rb_filter.residue_fraction_buried(1.0) # 设置为1代表全部残基需要包埋，才能通过filter\n",
+ "rb_filter.apply(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "d9ae86db-3a07-485c-aad0-763313dfd8b7",
+ "metadata": {},
+ "source": [
+ "#### 8.4 BuriedSurfaceArea\n",
+ "计算一个pose或selection的包埋的表面积。若低于设定阈值，返回false。该filter仅适用在L型或D型天然氨基酸，其他类型一律为0。\n",
+ "\n",
+ "参数:\n",
+ "- select_only_FAMILYVW： true表示仅计算FAMILYVW这些残基；false表示所有的残基都会被计算。会与residue_selector进行取交集进行计算。\n",
+ "- filter_out_low ：默认为true，表示pose/selection计算值低于阈值将被reject掉\n",
+ "- cutoff_buried_surface_area ：默认为500\n",
+ "- atom_mode：默认为“all_atoms”，也可以是\"hydrophobic_atoms\"、\"polar_atoms\""
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 46,
+ "id": "66ff315a-b1da-49d9-9213-ec2364304691",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_hee.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mRES\tBURIED AREA (A^2)\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mASP1\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mSER2\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mLEU3\t126.417\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mHIS4\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mILE5\t180.463\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mASN6\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mLEU7\t173.516\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mASP8\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mGLY9\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mILE10\t95.3928\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mARG11\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mPHE12\t120.612\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mGLU13\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mVAL14\t143.164\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mHIS15\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mGLY16\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mASP17\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mCYS18\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mGLU19\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mCYS20\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mGLU21\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mLEU22\t176.335\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mLYS23\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mARG24\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mLEU25\t113.303\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mGLU26\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mGLU27\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mGLU28\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mALA29\t105.107\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mARG30\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mARG31\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mARG32\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mMET33\t176.433\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mARG34\t0.0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mTOTAL BURIED AREA = 1410.74 square Angstroms.\n",
+ "\u001b[0mprotocols.simple_filters.BuriedSurfaceAreaFilter: {0} \u001b[0mThe BuriedSurfaceArea filter reports that this pose passes.\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "1410.7419778812703"
+ ]
+ },
+ "execution_count": 46,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.pose.metrics import CalculatorFactory, simple_calculators\n",
+ "from pyrosetta.rosetta.protocols.simple_filters import BuriedSurfaceAreaFilter\n",
+ "\n",
+ "# 初始化计算器.\n",
+ "calculator_factory = CalculatorFactory.Instance()\n",
+ "if not calculator_factory.check_calculator_exists(\"sasa\"):\n",
+ " sasa_calculator = simple_calculators.SasaCalculatorLegacy()\n",
+ " calculator_factory.register_calculator(\"sasa\", sasa_calculator)\n",
+ "\n",
+ "# 读取拓扑结构\n",
+ "pose = pose_from_pdb('./data/denovo_hee.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "bsa = BuriedSurfaceAreaFilter()\n",
+ "bsa.set_filter_out_low(True)\n",
+ "bsa.set_cutoff_buried_surface_area(500)\n",
+ "bsa.set_atom_mode(\"hydrophobic_atoms\")\n",
+ "bsa.set_select_only_FAMILYVW(True)\n",
+ "# bsa.residue_selector() # 定义残基选择器\n",
+ "bsa.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "ca923aac-ff61-4c96-935f-204ec2f7b860",
+ "metadata": {},
+ "source": [
+ "#### 8.5 ExposedHydrophobics\n",
+ "对每个疏水残基进行的SASA计算(A, F, I, M, L, W, V, Y)。score返回溶剂暴露的疏水残基数目和暴露程度。对于每一个疏水残基，SAS高于设定cutoff值（默认20），则将 SASA - sasa_cutoff的计算值加和到score上。若最终score低于定义的threshold，返回true。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 47,
+ "id": "b42db197-cac3-4f45-9c4c-c170d71a4b7a",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_hee.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.DsspMover: {0} \u001b[0mLEEEEEELLEEEEEELLLHHHHHHHHHHHHHHHL\n",
+ "\u001b[0mprotocols.denovo_design.ExposedHydrophobicsFilter: {0} \u001b[0mExposedHydrophobics value=97.5573\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "97.55734626536554"
+ ]
+ },
+ "execution_count": 47,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.denovo_design.filters import ExposedHydrophobicsFilter\n",
+ "\n",
+ "# 读取拓扑结构\n",
+ "pose = pose_from_pdb('./data/denovo_hee.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "expose_hdro_filter = ExposedHydrophobicsFilter()\n",
+ "expose_hdro_filter.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "ceda2f92-b2c9-4e25-83b9-16720748a953",
+ "metadata": {},
+ "source": [
+ "### 9. Comparison"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "35fff1ed-2aa5-4b61-bf65-b0653824c8ab",
+ "metadata": {},
+ "source": [
+ "#### 9.1 Rmsd\n",
+ "计算当前pose与参照ref_pose的rmsd值的filter。\n",
+ "注意: pose和ref_pose必须长度一致。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 48,
+ "id": "1b87251c-9a3e-464e-a71a-929f2031e268",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/pose.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/ref_pose.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 3 23\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 3 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 23 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 3 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 23 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "2.5254119698867075"
+ ]
+ },
+ "execution_count": 48,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.protein_interface_design.filters import RmsdFilter\n",
+ "from pyrosetta.rosetta.core.select.residue_selector import ChainSelector\n",
+ "\n",
+ "# 读取PDB;\n",
+ "pose = pose_from_pdb('./data/pose.pdb')\n",
+ "ref_pose = pose_from_pdb('./data/ref_pose.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "rmsd_filter = RmsdFilter()\n",
+ "rmsd_filter.reference_pose(ref_pose)\n",
+ "rmsd_filter.set_selection(ChainSelector(1)) # 定义残基选择器\n",
+ "rmsd_filter.superimpose(False)\n",
+ "rmsd_filter.compute(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "64483d0e-754e-4ef5-acdf-8a07bb38174d",
+ "metadata": {},
+ "source": [
+ "#### 9.2 IRmsd(xmlobject)\n",
+ "计算interface上的RMSD，包含interface上的所有骨架原子。interface残基包括在两边界面8埃范围内的所有残基。\n",
+ "\n",
+ "通常用于评估docking结果的两个构象之间的复合物结构差异。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 49,
+ "id": "355e8706-ba3d-4534-881a-7fb894731784",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -native ./data/denovo_binder.pdb -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-1513252079 seed_offset=0 real_seed=-1513252079 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-1513252079 RG_type=mt19937\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mLoading native resource as native_pose to the datamap\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_binder.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 148 186\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 148 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 186 CYD\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.RosettaScripts.util: {0} \u001b[0mUsing native pose as reference pose.\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.IRmsdFilter: {0} \u001b[0mBuilt IRmsdFilter with threshold 5, scorefxn commandline, jump 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"irmsd\" of type IRmsd\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "4.731549552161596e-07"
+ ]
+ },
+ "execution_count": 49,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "from pyrosetta import pose_from_pdb, init\n",
+ "\n",
+ "init('-native ./data/denovo_binder.pdb')\n",
+ "\n",
+ "# 读取结构\n",
+ "complex_pose = pose_from_pdb('./data/denovo_binder.pdb') \n",
+ "\n",
+ "# 定义Filter\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "''')\n",
+ "irmsd_filter = xml.get_filter('irmsd')\n",
+ "irmsd_filter.compute(complex_pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "97d1d6dd-1d9e-4697-8358-a0052c9bed1b",
+ "metadata": {},
+ "source": [
+ "#### 9.3 RmsdFromResidueSelectorFilter\n",
+ "与Rmsd filter类似，只不过对参照pose和当前计算pose分别提供ResidueSelectors。\n",
+ "\n",
+ "**特别注意: ref_pose和pose的长度可以不一样，但是selector选择的序列长度必须一致**"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 50,
+ "id": "56b68a36-a04b-4090-bddd-1a41592d6751",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/pose.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/ref_pose.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 3 23\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 3 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 23 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 3 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 23 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.fold_from_loops.RmsdFromResidueSelectorFilter: {0} \u001b[0mReference selects 10 residues.\n",
+ "\u001b[0mprotocols.fold_from_loops.RmsdFromResidueSelectorFilter: {0} \u001b[0mQuery selects 10 residues.\n",
+ "\u001b[0mprotocols.grafting.util: {0} \u001b[0mDeleting 24 residues from 11 to 34\n",
+ "\u001b[0mprotocols.grafting.util: {0} \u001b[0mDeleting 24 residues from 11 to 34\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mReverting out-of-date disulfide to thiol type at resid 3\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "0.4574945569038391"
+ ]
+ },
+ "execution_count": 50,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.fold_from_loops.filters import RmsdFromResidueSelectorFilter\n",
+ "from pyrosetta.rosetta.core.select.residue_selector import ResidueIndexSelector\n",
+ "\n",
+ "# 读取PDB;\n",
+ "pose = pose_from_pdb('./data/pose.pdb')\n",
+ "ref_pose = pose_from_pdb('./data/ref_pose.pdb')\n",
+ "\n",
+ "# selection\n",
+ "ri_sel = ResidueIndexSelector('1-10')\n",
+ "\n",
+ "# 定义Filter\n",
+ "sel_rmsd_filter = RmsdFromResidueSelectorFilter()\n",
+ "sel_rmsd_filter.CA_only(True)\n",
+ "sel_rmsd_filter.reference_pose(ref_pose)\n",
+ "sel_rmsd_filter.reference_selector(ri_sel)\n",
+ "sel_rmsd_filter.query_selector(ri_sel)\n",
+ "sel_rmsd_filter.superimpose(True)\n",
+ "sel_rmsd_filter.compute(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "31913357-a608-4cea-9bdd-f6a3b8aa1c23",
+ "metadata": {
+ "tags": []
+ },
+ "source": [
+ "#### 9.4 SequenceRecovery\n",
+ "对比参照pose，当前pose有多大的序列回复率的filter。用户通过task_operations提供可design的残基范围。command line可输入-in:file:native 将用户输入的pose文件作为参照，否则将使用起始pose作为参照。\n",
+ "\n",
+ "参数:\n",
+ "- rate_threshold：最低通过阈值（至少需要到多大的回复率）\n",
+ "- mutation_threshold：突变的最大个数\n",
+ "- report_mutations：默认false，不会report。true表示不再使用rate作为filter，而使用突变个数。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 51,
+ "id": "c51fd78b-f7c7-40d4-ae41-2baa97689317",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/pose.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/ref_pose.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 3 23\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 3 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 23 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 3 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 23 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.SequenceRecoveryFilter: {0} \u001b[0mYour design mover mutated 21 positions out of 32 designable positions. Sequence recovery is: 0.34375\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "0.34375"
+ ]
+ },
+ "execution_count": 51,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.protein_interface_design.filters import SequenceRecoveryFilter\n",
+ "from pyrosetta.rosetta.core.pack.task import TaskFactory\n",
+ "\n",
+ "# 读取PDB;\n",
+ "pose = pose_from_pdb('./data/pose.pdb')\n",
+ "ref_pose = pose_from_pdb('./data/ref_pose.pdb')\n",
+ "\n",
+ "# 定义tf(可以是默认的)\n",
+ "tf = TaskFactory()\n",
+ "\n",
+ "# 定义Filter\n",
+ "sr_filter = SequenceRecoveryFilter()\n",
+ "sr_filter.mutation_threshold(999)\n",
+ "sr_filter.reference_pose(ref_pose)\n",
+ "sr_filter.task_factory(tf) # 设置packable残基\n",
+ "sr_filter.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "25cdf122-9e70-4305-84fd-8a3c92bb8248",
+ "metadata": {},
+ "source": [
+ "### 10. bonding"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "399b9e36-9134-4703-a7ec-9993c8794988",
+ "metadata": {},
+ "source": [
+ "#### 10.1 ChainBreak(不work)\n",
+ "基于pose中链断裂数目的filter。这里的break指的是当某键长偏离平均键长（1.33）+/- tolerance (默认0.13为tolerance)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 52,
+ "id": "0e683435-045a-461c-87c3-3b7fc6fda9af",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/break_pose.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.simple_filters.ChainBreak: {0} \u001b[0mWill check peptide bond lengths between 1 to 33\n",
+ "\u001b[0mprotocols.simple_filters.ChainBreak: {0} \u001b[0mbond length tolerance value is:0.13\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "0"
+ ]
+ },
+ "execution_count": 52,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import ChainBreak\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/break_pose.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "chain_break_filter = ChainBreak()\n",
+ "chain_break_filter.chain_num(1) # 指定检查的链号\n",
+ "chain_break_filter.compute(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "50dbeb54-d697-45ef-8fea-a1913b08085e",
+ "metadata": {},
+ "source": [
+ "#### 10.2 HbondsToResidue\n",
+ "基于某残基的氢键连接数目的filter。计算与某残基形成氢键的残基数目，且每一个氢键必须要超过一定的energy_cutoff值。对于骨架间的氢键，需要开放bb_bb选项。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 53,
+ "id": "ffbf2030-b416-4269-aacf-7dc2549b653c",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_hee.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.HbondsToResidueFilter: {0} \u001b[0mNo scorefunction loaded. Getting global default scorefunction.\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.protein_interface_design.design_utils: {0} \u001b[0m 5 12 I F 0.000 -2.211 0.000 0.000 4.712\n",
+ " 5 12 I F 0.000 -2.211 0.000 0.000 4.712\n",
+ "\u001b[0mprotocols.protein_interface_design.filters.HbondsToResidueFilter: {0} \u001b[0mfound 2 hbond to target residue 5. passing.\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 53,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.protein_interface_design.filters import HbondsToResidueFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/denovo_hee.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "hbond_filter = HbondsToResidueFilter()\n",
+ "hbond_filter.set_resnum(5)\n",
+ "hbond_filter.set_bb_bb(True) # 是否包含主链-主链氢键？\n",
+ "hbond_filter.set_sidechain(True) # 检查侧链氢键\n",
+ "hbond_filter.set_from_same_chain(True) # 统计同一条链残基上的氢键\n",
+ "hbond_filter.set_from_other_chains(False) # 统计其他链对resnum残基的氢键\n",
+ "# hbond_filter.set_selector() # 当设置时，只有选择的区域用于与resnum残基进行氢键检查。\n",
+ "hbond_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "71284909-94d7-4fc4-9d85-c6d690441467",
+ "metadata": {},
+ "source": [
+ "#### 10.3 SimpleHbondsToAtom\n",
+ "基于某原子的氢键数目的filter。检查目标原子是否存在至少n_partners指定的氢键partner"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 1,
+ "id": "5a779362-1f13-4f6b-8e33-8074c991f168",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.31+release.c7009b3115c22daa9efe2805d9d1ebba08426a54 2021-08-07T10:04:12] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r292 2021.31+release.c7009b3115c c7009b3115c22daa9efe2805d9d1ebba08426a54 http://www.pyrosetta.org 2021-08-07T10:04:12\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=817792676 seed_offset=0 real_seed=817792676 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=817792676 RG_type=mt19937\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 983 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.683086 seconds.\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/denovo_hee.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 18 20\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 18 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 20 CYD\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama_str.dat.\n",
+ "\u001b[0mprotocols.simple_filters.SimpleHbondsToAtomFilter: {0} \u001b[0mSimpleHbondsToAtomFilter\n",
+ "\u001b[0mprotocols.simple_filters.SimpleHbondsToAtomFilter: {0} \u001b[0mWill look for 1 Hbonds to atom O in residue 26.\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined filter named \"atom_hbonds_filter\" of type SimpleHbondsToAtomFilter\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.177736 seconds to load from binary\n",
+ "\u001b[0mprotocols.simple_filters.SimpleHbondsToAtomFilter: {0} \u001b[0mDone populating HBondSet, 30 Hbonds found.\n",
+ "\u001b[0mprotocols.simple_filters.SimpleHbondsToAtomFilter: {0} \u001b[0mDone looking for Hbonds to O, found 1 Hbonds, here's the list:\n",
+ "\u001b[0mprotocols.simple_filters.SimpleHbondsToAtomFilter: {0} \u001b[0m2 don: protein backbone 30 12 acc: protein backbone 26 4 -0.983549 1\n",
+ "\u001b[0mprotocols.simple_filters.SimpleHbondsToAtomFilter: {0} \u001b[0mThis Hbond passes cutoff -0.5, adding to counter.\n",
+ "\u001b[0mprotocols.simple_filters.SimpleHbondsToAtomFilter: {0} \u001b[0mCurrent number of Hbonds: 1.\n",
+ "\u001b[0mprotocols.simple_filters.SimpleHbondsToAtomFilter: {0} \u001b[0mNow looking for Hbonds to H atoms attached to heavy atom.\n",
+ "\u001b[0mprotocols.simple_filters.SimpleHbondsToAtomFilter: {0} \u001b[0mFound 1 Hbonds, 1 expected.\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 1,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts\n",
+ "from pyrosetta import init, pose_from_pdb\n",
+ "\n",
+ "# 读取复合物结构\n",
+ "init()\n",
+ "pose = pose_from_pdb('./data/denovo_hee.pdb')\n",
+ "\n",
+ "# 定义Filter, 26号谷氨酸残基的原子O\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "\n",
+ "''')\n",
+ "\n",
+ "atom_hbonds_filter = xml.get_filter('atom_hbonds_filter')\n",
+ "atom_hbonds_filter.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "43bfcf95-f179-4c85-a020-2baf2ad6880f",
+ "metadata": {},
+ "source": [
+ "#### 10.4 PeptideInternalHbondsFilter\n",
+ "在一个pose或selection中的氢键数目，exclusion_distance可以设定排除在一级序列一定范围内的残基氢键统计。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 55,
+ "id": "03ea4677-b170-4a2f-8da6-e53f32484323",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-1780545172 seed_offset=0 real_seed=-1780545172 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-1780545172 RG_type=mt19937\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/t6c.40.92.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mLoading (but possibly not actually using) 'DSE' from the PDB components dictionary for residue type 'pdb_DSE'\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue DTHR:CtermProteinFull 9\n",
+ "\u001b[0mprotocols.cyclic_peptide.PeptideInternalHbondsMetric: {0} \u001b[0mNo scorefunction was provided to the PeptideInternalHbondsMetric. Fetching default scorefunction.\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.cyclic_peptide.PeptideInternalHbondsMetric: {0} \u001b[0mCounted 4 hbonds in selection.\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "4.0"
+ ]
+ },
+ "execution_count": 55,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.select.residue_selector import ChainSelector\n",
+ "from pyrosetta.rosetta.protocols.cyclic_peptide import PeptideInternalHbondsFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "init()\n",
+ "pose = pose_from_pdb('./data/t6c.40.92.pdb')\n",
+ "pep_selector = ChainSelector(1)\n",
+ "\n",
+ "# 定义Filter\n",
+ "total_hbonds = PeptideInternalHbondsFilter()\n",
+ "total_hbonds.set_hbond_cutoff(2) # 3 hbond;\n",
+ "total_hbonds.set_exclusion_distance(1)\n",
+ "total_hbonds.set_residue_selector(pep_selector)\n",
+ "total_hbonds.score(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "5a9f0fe5-1eff-4f6a-b32e-0b75645953d2",
+ "metadata": {},
+ "source": [
+ "#### 10.5 BuriedUnsatHbonds\n",
+ "基于被包埋的不饱和氢键的最大数目的filter。\n",
+ "\n",
+ "更多信息: https://new.rosettacommons.org/docs/latest/scripting_documentation/RosettaScripts/Filters/filter_pages/BuriedUnsatHbondsFilter\n",
+ "\n",
+ "以下提供无bug版本:"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 56,
+ "id": "7536c01c-90e9-42b9-8808-c9dfa0e1fee7",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -holes:dalphaball ./data/DAlphaBall.macgcc -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=1814558810 seed_offset=0 real_seed=1814558810 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=1814558810 RG_type=mt19937\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/t6c.40.92.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue DTHR:CtermProteinFull 9\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m/////////////////////////////////////////////////////////////////////////////////////////\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m USING DEFAULT BEHAVIOR: filter will report total number of heavy-atom donor/acceptor buried unsats\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m/////////////////////////////////////////////////////////////////////////////////////////\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/sp2_elec_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/sp2_elec_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/sp2_elec_params/HBEval.csv\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m buried unsats in input pose:\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m all_heavy_atom_unsats = 0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m bb_heavy_atom_unsats = 0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m sc_heavy_atom_unsats = 0\n",
+ "\u001b[0mprotocols.simple_filters.BuriedUnsatHbondFilter: {0} \u001b[0m countable_nonheavy_unsats = 0\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "0.0"
+ ]
+ },
+ "execution_count": 56,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.simple_filters import BuriedUnsatHbondFilter\n",
+ "# 初始化DAlphaBall\n",
+ "DAlphaBall_path = './data/DAlphaBall.macgcc'\n",
+ "init(f'-holes:dalphaball {DAlphaBall_path}')\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/t6c.40.92.pdb')\n",
+ "\n",
+ "# 定义Filter\n",
+ "cutoff = 0\n",
+ "byhf = BuriedUnsatHbondFilter(cutoff)\n",
+ "byhf.set_report_all_heavy_atom_unsats(True)\n",
+ "byhf.set_residue_surface_cutoff(20)\n",
+ "byhf.set_ignore_surface_res(True)\n",
+ "byhf.set_dalphaball_sasa()\n",
+ "byhf.set_probe_radius(1.1) # a probe_radius≈1.1 best correlates with new_buns_all_heavy\n",
+ "byhf.compute(pose)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "09b0d231-7e0f-4f1c-9faa-5fcd4e246012",
+ "metadata": {},
+ "source": [
+ "#### 10.6 OversaturatedHbondAcceptorFilter\n",
+ "过饱和氢键受体的filter。超过一个供体的氢键受体属于此类。当一个氢键受体多于1个供体时，是物理不真实的。\n",
+ "\n",
+ "重要参数:\n",
+ "- max_allowed_oversaturated: 最大允许过饱和数，默认为0。既通过的pose不含有任何过饱和氢键受体。\n",
+ "- set_consider_mainchain_only: 是否只考虑主链氢键？"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 57,
+ "id": "7881a822-6c91-4cab-b32b-543b9cad32f0",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/t6c.40.92.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue DTHR:CtermProteinFull 9\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "0.0"
+ ]
+ },
+ "execution_count": 57,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.select.residue_selector import ChainSelector\n",
+ "from pyrosetta.rosetta.protocols.cyclic_peptide import OversaturatedHbondAcceptorFilter\n",
+ "\n",
+ "# 读取结构\n",
+ "pose = pose_from_pdb('./data/t6c.40.92.pdb')\n",
+ "pep_selector = ChainSelector(1)\n",
+ "\n",
+ "# 定义Filter\n",
+ "overhbond = OversaturatedHbondAcceptorFilter()\n",
+ "overhbond.set_consider_mainchain_only(False)\n",
+ "overhbond.set_max_allowed_oversaturated(0)\n",
+ "overhbond.set_acceptor_selector(pep_selector)\n",
+ "overhbond.set_donor_selector(pep_selector)\n",
+ "overhbond.score(pose)"
+ ]
+ }
+ ],
+ "metadata": {
+ "kernelspec": {
+ "display_name": "Python 3",
+ "language": "python",
+ "name": "python3"
+ },
+ "language_info": {
+ "codemirror_mode": {
+ "name": "ipython",
+ "version": 3
+ },
+ "file_extension": ".py",
+ "mimetype": "text/x-python",
+ "name": "python",
+ "nbconvert_exporter": "python",
+ "pygments_lexer": "ipython3",
+ "version": "3.7.10"
+ }
+ },
+ "nbformat": 4,
+ "nbformat_minor": 5
+}
diff --git a/8_Filter/data/DAlphaBall.gcc b/8_Filter/data/DAlphaBall.gcc
new file mode 100644
index 0000000..b30b051
Binary files /dev/null and b/8_Filter/data/DAlphaBall.gcc differ
diff --git a/8_Filter/data/DAlphaBall.macgcc b/8_Filter/data/DAlphaBall.macgcc
new file mode 100755
index 0000000..d8085f9
Binary files /dev/null and b/8_Filter/data/DAlphaBall.macgcc differ
diff --git a/8_Filter/data/break_pose.pdb b/8_Filter/data/break_pose.pdb
new file mode 100644
index 0000000..a6ee464
--- /dev/null
+++ b/8_Filter/data/break_pose.pdb
@@ -0,0 +1,287 @@
+ATOM 1 N THR A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA THR A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C THR A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O THR A 1 1.703 2.215 -0.889 1.00 0.00 O
+ATOM 5 CB THR A 1 2.012 -0.770 -1.213 1.00 0.00 C
+ATOM 6 CG2 THR A 1 3.532 -0.717 -1.229 1.00 0.00 C
+ATOM 7 OG1 THR A 1 1.586 -2.137 -1.150 1.00 0.00 O
+ATOM 8 N THR A 2 2.822 1.734 1.003 1.00 0.00 N
+ATOM 9 CA THR A 2 3.436 3.052 1.108 1.00 0.00 C
+ATOM 10 C THR A 2 4.953 2.963 1.006 1.00 0.00 C
+ATOM 11 O THR A 2 5.591 2.209 1.741 1.00 0.00 O
+ATOM 12 CB THR A 2 3.046 3.742 2.428 1.00 0.00 C
+ATOM 13 CG2 THR A 2 3.703 5.110 2.530 1.00 0.00 C
+ATOM 14 OG1 THR A 2 1.622 3.894 2.488 1.00 0.00 O
+ATOM 15 N LEU A 3 5.526 3.738 0.090 1.00 0.00 N
+ATOM 16 CA LEU A 3 6.975 3.801 -0.061 1.00 0.00 C
+ATOM 17 C LEU A 3 7.505 5.187 0.286 1.00 0.00 C
+ATOM 18 O LEU A 3 6.860 6.197 0.003 1.00 0.00 O
+ATOM 19 CB LEU A 3 7.374 3.439 -1.497 1.00 0.00 C
+ATOM 20 CG LEU A 3 6.845 2.096 -2.016 1.00 0.00 C
+ATOM 21 CD1 LEU A 3 7.198 1.945 -3.489 1.00 0.00 C
+ATOM 22 CD2 LEU A 3 7.439 0.963 -1.193 1.00 0.00 C
+ATOM 23 N ARG A 4 8.682 5.228 0.900 1.00 0.00 N
+ATOM 24 CA ARG A 4 9.332 6.491 1.226 1.00 0.00 C
+ATOM 25 C ARG A 4 10.807 6.466 0.845 1.00 0.00 C
+ATOM 26 O ARG A 4 11.526 5.522 1.172 1.00 0.00 O
+ATOM 27 CB ARG A 4 9.200 6.794 2.711 1.00 0.00 C
+ATOM 28 CG ARG A 4 7.794 7.151 3.168 1.00 0.00 C
+ATOM 29 CD ARG A 4 7.695 7.202 4.649 1.00 0.00 C
+ATOM 30 NE ARG A 4 8.438 8.322 5.204 1.00 0.00 N
+ATOM 31 CZ ARG A 4 8.650 8.523 6.520 1.00 0.00 C
+ATOM 32 NH1 ARG A 4 8.169 7.673 7.400 1.00 0.00 N1+
+ATOM 33 NH2 ARG A 4 9.340 9.574 6.925 1.00 0.00 N
+ATOM 34 N ARG A 5 11.252 7.509 0.153 1.00 0.00 N
+ATOM 35 CA ARG A 5 12.654 7.632 -0.230 1.00 0.00 C
+ATOM 36 C ARG A 5 13.146 9.064 -0.065 1.00 0.00 C
+ATOM 37 O ARG A 5 12.387 10.017 -0.243 1.00 0.00 O
+ATOM 38 CB ARG A 5 12.855 7.194 -1.673 1.00 0.00 C
+ATOM 39 CG ARG A 5 12.550 5.729 -1.945 1.00 0.00 C
+ATOM 40 CD ARG A 5 13.578 4.835 -1.352 1.00 0.00 C
+ATOM 41 NE ARG A 5 13.361 3.444 -1.715 1.00 0.00 N
+ATOM 42 CZ ARG A 5 12.552 2.597 -1.049 1.00 0.00 C
+ATOM 43 NH1 ARG A 5 11.891 3.014 0.008 1.00 0.00 N1+
+ATOM 44 NH2 ARG A 5 12.421 1.348 -1.460 1.00 0.00 N
+ATOM 45 N ARG A 6 14.422 9.210 0.277 1.00 0.00 N
+ATOM 46 CA ARG A 6 15.035 10.527 0.406 1.00 0.00 C
+ATOM 47 C ARG A 6 16.312 10.623 -0.417 1.00 0.00 C
+ATOM 48 O ARG A 6 17.258 9.865 -0.204 1.00 0.00 O
+ATOM 49 CB ARG A 6 15.350 10.830 1.863 1.00 0.00 C
+ATOM 50 CG ARG A 6 15.940 12.208 2.117 1.00 0.00 C
+ATOM 51 CD ARG A 6 16.196 12.439 3.562 1.00 0.00 C
+ATOM 52 NE ARG A 6 14.961 12.524 4.324 1.00 0.00 N
+ATOM 53 CZ ARG A 6 14.892 12.550 5.670 1.00 0.00 C
+ATOM 54 NH1 ARG A 6 15.994 12.496 6.385 1.00 0.00 N1+
+ATOM 55 NH2 ARG A 6 13.718 12.629 6.270 1.00 0.00 N
+ATOM 56 N ILE A 7 16.334 11.560 -1.359 1.00 0.00 N
+ATOM 57 CA ILE A 7 17.503 11.768 -2.205 1.00 0.00 C
+ATOM 58 C ILE A 7 17.922 13.233 -2.216 1.00 0.00 C
+ATOM 59 O ILE A 7 17.130 14.112 -2.555 1.00 0.00 O
+ATOM 60 CB ILE A 7 17.228 11.302 -3.647 1.00 0.00 C
+ATOM 61 CG1 ILE A 7 16.946 9.798 -3.677 1.00 0.00 C
+ATOM 62 CG2 ILE A 7 18.404 11.645 -4.550 1.00 0.00 C
+ATOM 63 CD1 ILE A 7 16.497 9.288 -5.027 1.00 0.00 C
+ATOM 64 N ASN A 8 19.171 13.489 -1.842 1.00 0.00 N
+ATOM 65 CA ASN A 8 19.704 14.846 -1.830 1.00 0.00 C
+ATOM 66 C ASN A 8 18.851 15.765 -0.965 1.00 0.00 C
+ATOM 67 O ASN A 8 18.675 16.943 -1.280 1.00 0.00 O
+ATOM 68 CB ASN A 8 19.812 15.390 -3.242 1.00 0.00 C
+ATOM 69 CG ASN A 8 20.763 14.597 -4.095 1.00 0.00 C
+ATOM 70 ND2 ASN A 8 20.471 14.508 -5.368 1.00 0.00 N
+ATOM 71 OD1 ASN A 8 21.763 14.064 -3.601 1.00 0.00 O
+ATOM 72 N GLY A 9 18.322 15.221 0.125 1.00 0.00 N
+ATOM 73 CA GLY A 9 17.603 16.022 1.110 1.00 0.00 C
+ATOM 74 C GLY A 9 16.113 16.069 0.799 1.00 0.00 C
+ATOM 75 O GLY A 9 15.313 16.526 1.616 1.00 0.00 O
+ATOM 76 N GLU A 10 15.746 15.594 -0.386 1.00 0.00 N
+ATOM 77 CA GLU A 10 14.356 15.623 -0.826 1.00 0.00 C
+ATOM 78 C GLU A 10 13.654 14.307 -0.520 1.00 0.00 C
+ATOM 79 O GLU A 10 14.059 13.249 -1.003 1.00 0.00 O
+ATOM 80 CB GLU A 10 14.277 15.919 -2.326 1.00 0.00 C
+ATOM 81 CG GLU A 10 12.860 16.000 -2.876 1.00 0.00 C
+ATOM 82 CD GLU A 10 12.822 16.179 -4.369 1.00 0.00 C
+ATOM 83 OE1 GLU A 10 13.829 16.539 -4.931 1.00 0.00 O
+ATOM 84 OE2 GLU A 10 11.785 15.956 -4.947 1.00 0.00 O1-
+ATOM 85 N GLU A 11 12.599 14.377 0.284 1.00 0.00 N
+ATOM 86 CA GLU A 11 11.839 13.190 0.657 1.00 0.00 C
+ATOM 87 C GLU A 11 10.501 13.142 -0.069 1.00 0.00 C
+ATOM 88 O GLU A 11 9.808 14.153 -0.182 1.00 0.00 O
+ATOM 89 CB GLU A 11 11.610 13.157 2.170 1.00 0.00 C
+ATOM 90 CG GLU A 11 10.885 11.915 2.669 1.00 0.00 C
+ATOM 91 CD GLU A 11 10.685 11.913 4.159 1.00 0.00 C
+ATOM 92 OE1 GLU A 11 11.115 12.843 4.798 1.00 0.00 O
+ATOM 93 OE2 GLU A 11 10.102 10.980 4.659 1.00 0.00 O1-
+ATOM 94 N ILE A 12 10.143 11.961 -0.561 1.00 0.00 N
+ATOM 95 CA ILE A 12 4.393 17.688 7.598 1.00 0.00 C
+ATOM 96 C ILE A 12 8.123 10.556 -0.531 1.00 0.00 C
+ATOM 97 O ILE A 12 8.752 9.549 -0.204 1.00 0.00 O
+ATOM 98 CB ILE A 12 8.954 11.527 -2.681 1.00 0.00 C
+ATOM 99 CG1 ILE A 12 7.568 11.503 -3.331 1.00 0.00 C
+ATOM 100 CG2 ILE A 12 9.704 10.236 -2.973 1.00 0.00 C
+ATOM 101 CD1 ILE A 12 7.597 11.629 -4.837 1.00 0.00 C
+ATOM 102 N GLU A 13 6.811 10.675 -0.362 1.00 0.00 N
+ATOM 103 CA GLU A 13 5.990 9.555 0.082 1.00 0.00 C
+ATOM 104 C GLU A 13 4.999 9.137 -0.996 1.00 0.00 C
+ATOM 105 O GLU A 13 4.217 9.952 -1.485 1.00 0.00 O
+ATOM 106 CB GLU A 13 5.240 9.920 1.365 1.00 0.00 C
+ATOM 107 CG GLU A 13 4.375 8.801 1.927 1.00 0.00 C
+ATOM 108 CD GLU A 13 3.789 9.133 3.271 1.00 0.00 C
+ATOM 109 OE1 GLU A 13 4.413 9.859 4.008 1.00 0.00 O
+ATOM 110 OE2 GLU A 13 2.715 8.661 3.561 1.00 0.00 O1-
+ATOM 111 N VAL A 14 5.036 7.860 -1.363 1.00 0.00 N
+ATOM 112 CA VAL A 14 4.202 7.350 -2.445 1.00 0.00 C
+ATOM 113 C VAL A 14 3.231 6.291 -1.938 1.00 0.00 C
+ATOM 114 O VAL A 14 3.637 5.306 -1.321 1.00 0.00 O
+ATOM 115 CB VAL A 14 5.080 6.747 -3.558 1.00 0.00 C
+ATOM 116 CG1 VAL A 14 4.212 6.134 -4.647 1.00 0.00 C
+ATOM 117 CG2 VAL A 14 5.993 7.818 -4.134 1.00 0.00 C
+ATOM 118 N ARG A 15 1.946 6.499 -2.203 1.00 0.00 N
+ATOM 119 CA ARG A 15 0.914 5.559 -1.781 1.00 0.00 C
+ATOM 120 C ARG A 15 0.124 5.036 -2.973 1.00 0.00 C
+ATOM 121 O ARG A 15 -0.225 5.792 -3.879 1.00 0.00 O
+ATOM 122 CB ARG A 15 -0.038 6.217 -0.794 1.00 0.00 C
+ATOM 123 CG ARG A 15 0.608 6.698 0.495 1.00 0.00 C
+ATOM 124 CD ARG A 15 -0.404 7.181 1.470 1.00 0.00 C
+ATOM 125 NE ARG A 15 0.215 7.739 2.662 1.00 0.00 N
+ATOM 126 CZ ARG A 15 -0.447 8.046 3.795 1.00 0.00 C
+ATOM 127 NH1 ARG A 15 -1.744 7.844 3.874 1.00 0.00 N1+
+ATOM 128 NH2 ARG A 15 0.207 8.550 4.827 1.00 0.00 N
+ATOM 129 N ALA A 16 -0.156 3.737 -2.967 1.00 0.00 N
+ATOM 130 CA ALA A 16 -0.991 3.128 -3.995 1.00 0.00 C
+ATOM 131 C ALA A 16 -1.634 1.842 -3.493 1.00 0.00 C
+ATOM 132 O ALA A 16 -1.181 1.252 -2.512 1.00 0.00 O
+ATOM 133 CB ALA A 16 -0.174 2.856 -5.250 1.00 0.00 C
+ATOM 134 N ASP A 17 -2.692 1.411 -4.171 1.00 0.00 N
+ATOM 135 CA ASP A 17 -3.332 0.137 -3.864 1.00 0.00 C
+ATOM 136 C ASP A 17 -2.701 -1.001 -4.656 1.00 0.00 C
+ATOM 137 O ASP A 17 -3.193 -2.129 -4.639 1.00 0.00 O
+ATOM 138 CB ASP A 17 -4.832 0.205 -4.163 1.00 0.00 C
+ATOM 139 CG ASP A 17 -5.132 0.599 -5.603 1.00 0.00 C
+ATOM 140 OD1 ASP A 17 -4.321 1.272 -6.195 1.00 0.00 O
+ATOM 141 OD2 ASP A 17 -6.168 0.225 -6.097 1.00 0.00 O1-
+ATOM 142 N CYS A 18 -1.609 -0.698 -5.348 1.00 0.00 N
+ATOM 143 CA CYS A 18 -0.864 -1.712 -6.086 1.00 0.00 C
+ATOM 144 C CYS A 18 0.637 -1.468 -5.995 1.00 0.00 C
+ATOM 145 O CYS A 18 1.102 -0.338 -6.144 1.00 0.00 O
+ATOM 146 CB CYS A 18 -1.285 -1.725 -7.556 1.00 0.00 C
+ATOM 147 SG CYS A 18 -0.450 -2.983 -8.552 1.00 0.00 S
+ATOM 148 N ASP A 19 1.390 -2.535 -5.749 1.00 0.00 N
+ATOM 149 CA ASP A 19 2.846 -2.458 -5.736 1.00 0.00 C
+ATOM 150 C ASP A 19 3.384 -1.980 -7.079 1.00 0.00 C
+ATOM 151 O ASP A 19 4.394 -1.279 -7.140 1.00 0.00 O
+ATOM 152 CB ASP A 19 3.453 -3.820 -5.393 1.00 0.00 C
+ATOM 153 CG ASP A 19 3.197 -4.236 -3.950 1.00 0.00 C
+ATOM 154 OD1 ASP A 19 2.773 -3.407 -3.180 1.00 0.00 O
+ATOM 155 OD2 ASP A 19 3.428 -5.378 -3.633 1.00 0.00 O1-
+ATOM 156 N CYS A 20 2.703 -2.363 -8.154 1.00 0.00 N
+ATOM 157 CA CYS A 20 3.084 -1.937 -9.495 1.00 0.00 C
+ATOM 158 C CYS A 20 3.104 -0.418 -9.606 1.00 0.00 C
+ATOM 159 O CYS A 20 4.074 0.167 -10.087 1.00 0.00 O
+ATOM 160 CB CYS A 20 2.120 -2.506 -10.535 1.00 0.00 C
+ATOM 161 SG CYS A 20 0.398 -2.006 -10.297 1.00 0.00 S
+ATOM 162 N LYS A 21 2.026 0.217 -9.157 1.00 0.00 N
+ATOM 163 CA LYS A 21 1.885 1.664 -9.273 1.00 0.00 C
+ATOM 164 C LYS A 21 2.830 2.387 -8.321 1.00 0.00 C
+ATOM 165 O LYS A 21 3.435 3.396 -8.681 1.00 0.00 O
+ATOM 166 CB LYS A 21 0.440 2.085 -9.000 1.00 0.00 C
+ATOM 167 CG LYS A 21 -0.542 1.712 -10.103 1.00 0.00 C
+ATOM 168 CD LYS A 21 -1.886 2.395 -9.900 1.00 0.00 C
+ATOM 169 CE LYS A 21 -2.666 1.757 -8.759 1.00 0.00 C
+ATOM 170 NZ LYS A 21 -4.043 2.309 -8.650 1.00 0.00 N1+
+ATOM 171 N ALA A 22 2.951 1.864 -7.106 1.00 0.00 N
+ATOM 172 CA ALA A 22 3.803 2.474 -6.092 1.00 0.00 C
+ATOM 173 C ALA A 22 5.258 2.506 -6.541 1.00 0.00 C
+ATOM 174 O ALA A 22 5.954 3.504 -6.356 1.00 0.00 O
+ATOM 175 CB ALA A 22 3.674 1.726 -4.772 1.00 0.00 C
+ATOM 176 N LYS A 23 5.714 1.407 -7.134 1.00 0.00 N
+ATOM 177 CA LYS A 23 7.091 1.303 -7.601 1.00 0.00 C
+ATOM 178 C LYS A 23 7.329 2.194 -8.814 1.00 0.00 C
+ATOM 179 O LYS A 23 8.367 2.848 -8.921 1.00 0.00 O
+ATOM 180 CB LYS A 23 7.434 -0.148 -7.940 1.00 0.00 C
+ATOM 181 CG LYS A 23 7.579 -1.059 -6.728 1.00 0.00 C
+ATOM 182 CD LYS A 23 7.876 -2.492 -7.146 1.00 0.00 C
+ATOM 183 CE LYS A 23 8.024 -3.403 -5.937 1.00 0.00 C
+ATOM 184 NZ LYS A 23 8.295 -4.812 -6.331 1.00 0.00 N1+
+ATOM 185 N GLU A 24 6.363 2.216 -9.725 1.00 0.00 N
+ATOM 186 CA GLU A 24 6.471 3.019 -10.937 1.00 0.00 C
+ATOM 187 C GLU A 24 6.593 4.501 -10.607 1.00 0.00 C
+ATOM 188 O GLU A 24 7.420 5.209 -11.183 1.00 0.00 O
+ATOM 189 CB GLU A 24 5.258 2.786 -11.841 1.00 0.00 C
+ATOM 190 CG GLU A 24 5.303 3.544 -13.161 1.00 0.00 C
+ATOM 191 CD GLU A 24 4.134 3.233 -14.054 1.00 0.00 C
+ATOM 192 OE1 GLU A 24 3.289 2.470 -13.651 1.00 0.00 O
+ATOM 193 OE2 GLU A 24 4.086 3.759 -15.140 1.00 0.00 O1-
+ATOM 194 N ILE A 25 5.766 4.965 -9.677 1.00 0.00 N
+ATOM 195 CA ILE A 25 5.769 6.368 -9.280 1.00 0.00 C
+ATOM 196 C ILE A 25 7.073 6.740 -8.586 1.00 0.00 C
+ATOM 197 O ILE A 25 7.679 7.767 -8.893 1.00 0.00 O
+ATOM 198 CB ILE A 25 4.584 6.677 -8.346 1.00 0.00 C
+ATOM 199 CG1 ILE A 25 3.260 6.548 -9.104 1.00 0.00 C
+ATOM 200 CG2 ILE A 25 4.726 8.069 -7.750 1.00 0.00 C
+ATOM 201 CD1 ILE A 25 2.047 6.479 -8.205 1.00 0.00 C
+ATOM 202 N MET A 26 7.501 5.900 -7.650 1.00 0.00 N
+ATOM 203 CA MET A 26 8.736 6.138 -6.913 1.00 0.00 C
+ATOM 204 C MET A 26 9.946 6.095 -7.837 1.00 0.00 C
+ATOM 205 O MET A 26 10.861 6.910 -7.716 1.00 0.00 O
+ATOM 206 CB MET A 26 8.886 5.114 -5.790 1.00 0.00 C
+ATOM 207 CG MET A 26 10.074 5.358 -4.870 1.00 0.00 C
+ATOM 208 SD MET A 26 9.954 6.921 -3.978 1.00 0.00 S
+ATOM 209 CE MET A 26 8.901 6.450 -2.609 1.00 0.00 C
+ATOM 210 N LYS A 27 9.945 5.139 -8.760 1.00 0.00 N
+ATOM 211 CA LYS A 27 11.060 4.965 -9.684 1.00 0.00 C
+ATOM 212 C LYS A 27 11.275 6.214 -10.529 1.00 0.00 C
+ATOM 213 O LYS A 27 12.402 6.681 -10.689 1.00 0.00 O
+ATOM 214 CB LYS A 27 10.824 3.753 -10.586 1.00 0.00 C
+ATOM 215 CG LYS A 27 11.950 3.474 -11.573 1.00 0.00 C
+ATOM 216 CD LYS A 27 11.657 2.240 -12.412 1.00 0.00 C
+ATOM 217 CE LYS A 27 12.824 1.903 -13.328 1.00 0.00 C
+ATOM 218 NZ LYS A 27 13.006 2.924 -14.395 1.00 0.00 N1+
+ATOM 219 N ARG A 28 10.186 6.751 -11.070 1.00 0.00 N
+ATOM 220 CA ARG A 28 10.253 7.946 -11.902 1.00 0.00 C
+ATOM 221 C ARG A 28 10.837 9.122 -11.130 1.00 0.00 C
+ATOM 222 O ARG A 28 11.646 9.884 -11.660 1.00 0.00 O
+ATOM 223 CB ARG A 28 8.871 8.317 -12.419 1.00 0.00 C
+ATOM 224 CG ARG A 28 8.310 7.379 -13.475 1.00 0.00 C
+ATOM 225 CD ARG A 28 6.930 7.761 -13.872 1.00 0.00 C
+ATOM 226 NE ARG A 28 6.307 6.748 -14.709 1.00 0.00 N
+ATOM 227 CZ ARG A 28 6.478 6.646 -16.041 1.00 0.00 C
+ATOM 228 NH1 ARG A 28 7.255 7.499 -16.672 1.00 0.00 N1+
+ATOM 229 NH2 ARG A 28 5.866 5.688 -16.715 1.00 0.00 N
+ATOM 230 N TRP A 29 10.421 9.265 -9.877 1.00 0.00 N
+ATOM 231 CA TRP A 29 10.945 10.315 -9.011 1.00 0.00 C
+ATOM 232 C TRP A 29 12.442 10.147 -8.784 1.00 0.00 C
+ATOM 233 O TRP A 29 13.207 11.105 -8.891 1.00 0.00 O
+ATOM 234 CB TRP A 29 10.218 10.309 -7.665 1.00 0.00 C
+ATOM 235 CG TRP A 29 10.798 11.264 -6.667 1.00 0.00 C
+ATOM 236 CD1 TRP A 29 10.557 12.602 -6.583 1.00 0.00 C
+ATOM 237 CD2 TRP A 29 11.726 10.956 -5.598 1.00 0.00 C
+ATOM 238 CE2 TRP A 29 11.987 12.154 -4.927 1.00 0.00 C
+ATOM 239 CE3 TRP A 29 12.346 9.778 -5.163 1.00 0.00 C
+ATOM 240 NE1 TRP A 29 11.267 13.147 -5.542 1.00 0.00 N
+ATOM 241 CZ2 TRP A 29 12.845 12.215 -3.841 1.00 0.00 C
+ATOM 242 CZ3 TRP A 29 13.205 9.839 -4.072 1.00 0.00 C
+ATOM 243 CH2 TRP A 29 13.448 11.026 -3.429 1.00 0.00 C
+ATOM 244 N GLU A 30 12.854 8.923 -8.471 1.00 0.00 N
+ATOM 245 CA GLU A 30 14.255 8.634 -8.189 1.00 0.00 C
+ATOM 246 C GLU A 30 15.143 9.019 -9.365 1.00 0.00 C
+ATOM 247 O GLU A 30 16.234 9.560 -9.181 1.00 0.00 O
+ATOM 248 CB GLU A 30 14.439 7.151 -7.863 1.00 0.00 C
+ATOM 249 CG GLU A 30 13.901 6.735 -6.501 1.00 0.00 C
+ATOM 250 CD GLU A 30 14.103 5.274 -6.213 1.00 0.00 C
+ATOM 251 OE1 GLU A 30 14.506 4.563 -7.102 1.00 0.00 O
+ATOM 252 OE2 GLU A 30 13.854 4.868 -5.102 1.00 0.00 O1-
+ATOM 253 N GLU A 31 14.671 8.738 -10.575 1.00 0.00 N
+ATOM 254 CA GLU A 31 15.424 9.049 -11.783 1.00 0.00 C
+ATOM 255 C GLU A 31 15.651 10.550 -11.919 1.00 0.00 C
+ATOM 256 O GLU A 31 16.710 10.988 -12.368 1.00 0.00 O
+ATOM 257 CB GLU A 31 14.692 8.521 -13.019 1.00 0.00 C
+ATOM 258 CG GLU A 31 14.694 7.005 -13.151 1.00 0.00 C
+ATOM 259 CD GLU A 31 13.852 6.515 -14.296 1.00 0.00 C
+ATOM 260 OE1 GLU A 31 13.271 7.330 -14.972 1.00 0.00 O
+ATOM 261 OE2 GLU A 31 13.790 5.325 -14.495 1.00 0.00 O1-
+ATOM 262 N LYS A 32 14.651 11.332 -11.528 1.00 0.00 N
+ATOM 263 CA LYS A 32 14.731 12.785 -11.629 1.00 0.00 C
+ATOM 264 C LYS A 32 15.422 13.384 -10.411 1.00 0.00 C
+ATOM 265 O LYS A 32 16.092 14.412 -10.509 1.00 0.00 O
+ATOM 266 CB LYS A 32 13.334 13.387 -11.791 1.00 0.00 C
+ATOM 267 CG LYS A 32 12.658 13.060 -13.116 1.00 0.00 C
+ATOM 268 CD LYS A 32 11.265 13.668 -13.191 1.00 0.00 C
+ATOM 269 CE LYS A 32 10.584 13.331 -14.509 1.00 0.00 C
+ATOM 270 NZ LYS A 32 9.202 13.881 -14.577 1.00 0.00 N1+
+ATOM 271 N ALA A 33 15.254 12.736 -9.263 1.00 0.00 N
+ATOM 272 CA ALA A 33 15.792 13.249 -8.009 1.00 0.00 C
+ATOM 273 C ALA A 33 17.311 13.143 -7.976 1.00 0.00 C
+ATOM 274 O ALA A 33 17.991 14.007 -7.423 1.00 0.00 O
+ATOM 275 CB ALA A 33 15.184 12.505 -6.829 1.00 0.00 C
+ATOM 276 N LYS A 34 17.838 12.079 -8.572 1.00 0.00 N
+ATOM 277 CA LYS A 34 19.277 11.844 -8.589 1.00 0.00 C
+ATOM 278 C LYS A 34 19.981 12.808 -9.535 1.00 0.00 C
+ATOM 279 O LYS A 34 19.407 13.246 -10.532 1.00 0.00 O
+ATOM 280 CB LYS A 34 19.579 10.400 -8.989 1.00 0.00 C
+ATOM 281 CG LYS A 34 19.181 9.362 -7.948 1.00 0.00 C
+ATOM 282 CD LYS A 34 19.512 7.953 -8.417 1.00 0.00 C
+ATOM 283 CE LYS A 34 19.098 6.914 -7.386 1.00 0.00 C
+ATOM 284 NZ LYS A 34 19.414 5.530 -7.833 1.00 0.00 N1+
+ATOM 285 OXT LYS A 34 21.110 13.150 -9.312 1.00 0.00 O1-
+TER
+END
diff --git a/8_Filter/data/denovo_binder.pdb b/8_Filter/data/denovo_binder.pdb
new file mode 100644
index 0000000..d39369b
--- /dev/null
+++ b/8_Filter/data/denovo_binder.pdb
@@ -0,0 +1,3446 @@
+HEADER xx-MMM-xx
+SSBOND CYS B 148 CYS B 186 2.03
+ATOM 1 N THR A 1 7.915 -5.917 -68.902 1.00 0.00 N
+ATOM 2 CA THR A 1 8.314 -4.811 -67.968 1.00 0.00 C
+ATOM 3 C THR A 1 7.276 -4.710 -66.838 1.00 0.00 C
+ATOM 4 O THR A 1 6.699 -3.623 -66.629 1.00 0.00 O
+ATOM 5 CB THR A 1 8.431 -3.455 -68.689 1.00 0.00 C
+ATOM 6 OG1 THR A 1 7.198 -3.158 -69.357 1.00 0.00 O
+ATOM 7 CG2 THR A 1 9.560 -3.489 -69.708 1.00 0.00 C
+ATOM 8 1H THR A 1 8.586 -5.989 -69.641 1.00 0.00 H
+ATOM 9 2H THR A 1 7.879 -6.782 -68.401 1.00 0.00 H
+ATOM 10 3H THR A 1 7.014 -5.719 -69.290 1.00 0.00 H
+ATOM 11 HA THR A 1 9.239 -5.097 -67.468 1.00 0.00 H
+ATOM 12 HB THR A 1 8.631 -2.671 -67.959 1.00 0.00 H
+ATOM 13 HG1 THR A 1 6.549 -2.864 -68.713 1.00 0.00 H
+ATOM 14 1HG2 THR A 1 9.628 -2.522 -70.207 1.00 0.00 H
+ATOM 15 2HG2 THR A 1 10.501 -3.703 -69.201 1.00 0.00 H
+ATOM 16 3HG2 THR A 1 9.361 -4.265 -70.446 1.00 0.00 H
+ATOM 17 N GLN A 2 7.085 -5.826 -66.133 1.00 0.00 N
+ATOM 18 CA GLN A 2 6.207 -5.983 -64.943 1.00 0.00 C
+ATOM 19 C GLN A 2 7.086 -6.405 -63.759 1.00 0.00 C
+ATOM 20 O GLN A 2 6.525 -6.736 -62.697 1.00 0.00 O
+ATOM 21 CB GLN A 2 5.104 -7.016 -65.187 1.00 0.00 C
+ATOM 22 CG GLN A 2 5.616 -8.414 -65.490 1.00 0.00 C
+ATOM 23 CD GLN A 2 4.491 -9.416 -65.668 1.00 0.00 C
+ATOM 24 OE1 GLN A 2 3.883 -9.868 -64.694 1.00 0.00 O
+ATOM 25 NE2 GLN A 2 4.207 -9.770 -66.917 1.00 0.00 N
+ATOM 26 H GLN A 2 7.602 -6.625 -66.471 1.00 0.00 H
+ATOM 27 HA GLN A 2 5.732 -5.024 -64.735 1.00 0.00 H
+ATOM 28 1HB GLN A 2 4.461 -7.076 -64.309 1.00 0.00 H
+ATOM 29 2HB GLN A 2 4.484 -6.696 -66.025 1.00 0.00 H
+ATOM 30 1HG GLN A 2 6.197 -8.385 -66.411 1.00 0.00 H
+ATOM 31 2HG GLN A 2 6.243 -8.747 -64.663 1.00 0.00 H
+ATOM 32 1HE2 GLN A 2 3.475 -10.428 -67.097 1.00 0.00 H
+ATOM 33 2HE2 GLN A 2 4.726 -9.379 -67.678 1.00 0.00 H
+ATOM 34 N ASN A 3 8.412 -6.403 -63.944 1.00 0.00 N
+ATOM 35 CA ASN A 3 9.402 -6.937 -62.967 1.00 0.00 C
+ATOM 36 C ASN A 3 9.389 -6.069 -61.706 1.00 0.00 C
+ATOM 37 O ASN A 3 9.547 -6.641 -60.601 1.00 0.00 O
+ATOM 38 CB ASN A 3 10.796 -6.994 -63.565 1.00 0.00 C
+ATOM 39 CG ASN A 3 10.945 -8.098 -64.575 1.00 0.00 C
+ATOM 40 OD1 ASN A 3 10.169 -9.061 -64.582 1.00 0.00 O
+ATOM 41 ND2 ASN A 3 11.929 -7.979 -65.429 1.00 0.00 N
+ATOM 42 H ASN A 3 8.742 -6.007 -64.813 1.00 0.00 H
+ATOM 43 HA ASN A 3 9.096 -7.944 -62.681 1.00 0.00 H
+ATOM 44 1HB ASN A 3 11.026 -6.044 -64.047 1.00 0.00 H
+ATOM 45 2HB ASN A 3 11.527 -7.145 -62.770 1.00 0.00 H
+ATOM 46 1HD2 ASN A 3 12.078 -8.683 -66.124 1.00 0.00 H
+ATOM 47 2HD2 ASN A 3 12.534 -7.183 -65.388 1.00 0.00 H
+ATOM 48 N VAL A 4 9.190 -4.753 -61.873 1.00 0.00 N
+ATOM 49 CA VAL A 4 9.191 -3.738 -60.773 1.00 0.00 C
+ATOM 50 C VAL A 4 8.037 -4.057 -59.816 1.00 0.00 C
+ATOM 51 O VAL A 4 8.258 -4.033 -58.589 1.00 0.00 O
+ATOM 52 CB VAL A 4 9.026 -2.310 -61.324 1.00 0.00 C
+ATOM 53 CG1 VAL A 4 8.820 -1.320 -60.187 1.00 0.00 C
+ATOM 54 CG2 VAL A 4 10.242 -1.931 -62.155 1.00 0.00 C
+ATOM 55 H VAL A 4 9.029 -4.450 -62.822 1.00 0.00 H
+ATOM 56 HA VAL A 4 10.135 -3.817 -60.231 1.00 0.00 H
+ATOM 57 HB VAL A 4 8.133 -2.272 -61.949 1.00 0.00 H
+ATOM 58 1HG1 VAL A 4 8.704 -0.316 -60.595 1.00 0.00 H
+ATOM 59 2HG1 VAL A 4 7.924 -1.590 -59.628 1.00 0.00 H
+ATOM 60 3HG1 VAL A 4 9.683 -1.344 -59.523 1.00 0.00 H
+ATOM 61 1HG2 VAL A 4 10.118 -0.920 -62.542 1.00 0.00 H
+ATOM 62 2HG2 VAL A 4 11.136 -1.974 -61.532 1.00 0.00 H
+ATOM 63 3HG2 VAL A 4 10.346 -2.628 -62.987 1.00 0.00 H
+ATOM 64 N LEU A 5 6.852 -4.329 -60.364 1.00 0.00 N
+ATOM 65 CA LEU A 5 5.628 -4.631 -59.578 1.00 0.00 C
+ATOM 66 C LEU A 5 5.799 -5.964 -58.831 1.00 0.00 C
+ATOM 67 O LEU A 5 5.435 -6.008 -57.638 1.00 0.00 O
+ATOM 68 CB LEU A 5 4.412 -4.625 -60.510 1.00 0.00 C
+ATOM 69 CG LEU A 5 3.729 -3.264 -60.660 1.00 0.00 C
+ATOM 70 CD1 LEU A 5 4.699 -2.205 -61.167 1.00 0.00 C
+ATOM 71 CD2 LEU A 5 2.518 -3.364 -61.572 1.00 0.00 C
+ATOM 72 H LEU A 5 6.800 -4.325 -61.373 1.00 0.00 H
+ATOM 73 HA LEU A 5 5.504 -3.857 -58.821 1.00 0.00 H
+ATOM 74 1HB LEU A 5 4.729 -4.957 -61.497 1.00 0.00 H
+ATOM 75 2HB LEU A 5 3.678 -5.334 -60.127 1.00 0.00 H
+ATOM 76 HG LEU A 5 3.401 -2.911 -59.681 1.00 0.00 H
+ATOM 77 1HD1 LEU A 5 4.180 -1.251 -61.262 1.00 0.00 H
+ATOM 78 2HD1 LEU A 5 5.525 -2.100 -60.463 1.00 0.00 H
+ATOM 79 3HD1 LEU A 5 5.087 -2.504 -62.140 1.00 0.00 H
+ATOM 80 1HD2 LEU A 5 2.047 -2.384 -61.664 1.00 0.00 H
+ATOM 81 2HD2 LEU A 5 2.832 -3.708 -62.558 1.00 0.00 H
+ATOM 82 3HD2 LEU A 5 1.803 -4.072 -61.153 1.00 0.00 H
+ATOM 83 N TYR A 6 6.355 -6.998 -59.476 1.00 0.00 N
+ATOM 84 CA TYR A 6 6.534 -8.343 -58.863 1.00 0.00 C
+ATOM 85 C TYR A 6 7.563 -8.271 -57.738 1.00 0.00 C
+ATOM 86 O TYR A 6 7.319 -8.883 -56.685 1.00 0.00 O
+ATOM 87 CB TYR A 6 6.965 -9.374 -59.908 1.00 0.00 C
+ATOM 88 CG TYR A 6 7.022 -10.791 -59.380 1.00 0.00 C
+ATOM 89 CD1 TYR A 6 5.962 -11.300 -58.643 1.00 0.00 C
+ATOM 90 CD2 TYR A 6 8.133 -11.581 -59.633 1.00 0.00 C
+ATOM 91 CE1 TYR A 6 6.015 -12.593 -58.161 1.00 0.00 C
+ATOM 92 CE2 TYR A 6 8.186 -12.874 -59.150 1.00 0.00 C
+ATOM 93 CZ TYR A 6 7.132 -13.380 -58.418 1.00 0.00 C
+ATOM 94 OH TYR A 6 7.184 -14.668 -57.937 1.00 0.00 O
+ATOM 95 H TYR A 6 6.664 -6.846 -60.425 1.00 0.00 H
+ATOM 96 HA TYR A 6 5.579 -8.662 -58.445 1.00 0.00 H
+ATOM 97 1HB TYR A 6 6.271 -9.353 -60.750 1.00 0.00 H
+ATOM 98 2HB TYR A 6 7.951 -9.115 -60.291 1.00 0.00 H
+ATOM 99 HD1 TYR A 6 5.088 -10.679 -58.444 1.00 0.00 H
+ATOM 100 HD2 TYR A 6 8.966 -11.181 -60.211 1.00 0.00 H
+ATOM 101 HE1 TYR A 6 5.182 -12.993 -57.581 1.00 0.00 H
+ATOM 102 HE2 TYR A 6 9.060 -13.495 -59.349 1.00 0.00 H
+ATOM 103 HH TYR A 6 6.360 -14.876 -57.491 1.00 0.00 H
+ATOM 104 N GLU A 7 8.678 -7.570 -57.959 1.00 0.00 N
+ATOM 105 CA GLU A 7 9.747 -7.399 -56.939 1.00 0.00 C
+ATOM 106 C GLU A 7 9.218 -6.560 -55.764 1.00 0.00 C
+ATOM 107 O GLU A 7 9.610 -6.866 -54.619 1.00 0.00 O
+ATOM 108 CB GLU A 7 11.011 -6.802 -57.565 1.00 0.00 C
+ATOM 109 CG GLU A 7 11.757 -7.775 -58.470 1.00 0.00 C
+ATOM 110 CD GLU A 7 12.301 -9.030 -57.798 1.00 0.00 C
+ATOM 111 OE1 GLU A 7 13.020 -8.897 -56.782 1.00 0.00 O
+ATOM 112 OE2 GLU A 7 11.999 -10.150 -58.288 1.00 0.00 O
+ATOM 113 H GLU A 7 8.789 -7.140 -58.866 1.00 0.00 H
+ATOM 114 HA GLU A 7 9.996 -8.378 -56.530 1.00 0.00 H
+ATOM 115 1HB GLU A 7 10.746 -5.922 -58.152 1.00 0.00 H
+ATOM 116 2HB GLU A 7 11.690 -6.476 -56.777 1.00 0.00 H
+ATOM 117 1HG GLU A 7 11.088 -8.098 -59.267 1.00 0.00 H
+ATOM 118 2HG GLU A 7 12.599 -7.257 -58.927 1.00 0.00 H
+ATOM 119 N ASN A 8 8.360 -5.562 -56.024 1.00 0.00 N
+ATOM 120 CA ASN A 8 7.706 -4.728 -54.975 1.00 0.00 C
+ATOM 121 C ASN A 8 6.801 -5.625 -54.122 1.00 0.00 C
+ATOM 122 O ASN A 8 6.777 -5.436 -52.893 1.00 0.00 O
+ATOM 123 CB ASN A 8 6.929 -3.539 -55.558 1.00 0.00 C
+ATOM 124 CG ASN A 8 7.803 -2.376 -55.987 1.00 0.00 C
+ATOM 125 OD1 ASN A 8 8.955 -2.274 -55.572 1.00 0.00 O
+ATOM 126 ND2 ASN A 8 7.254 -1.484 -56.802 1.00 0.00 N
+ATOM 127 H ASN A 8 8.154 -5.381 -56.996 1.00 0.00 H
+ATOM 128 HA ASN A 8 8.482 -4.323 -54.323 1.00 0.00 H
+ATOM 129 1HB ASN A 8 6.355 -3.868 -56.425 1.00 0.00 H
+ATOM 130 2HB ASN A 8 6.218 -3.171 -54.817 1.00 0.00 H
+ATOM 131 1HD2 ASN A 8 7.788 -0.698 -57.115 1.00 0.00 H
+ATOM 132 2HD2 ASN A 8 6.308 -1.598 -57.103 1.00 0.00 H
+ATOM 133 N GLN A 9 6.097 -6.581 -54.737 1.00 0.00 N
+ATOM 134 CA GLN A 9 5.203 -7.521 -54.005 1.00 0.00 C
+ATOM 135 C GLN A 9 6.039 -8.378 -53.051 1.00 0.00 C
+ATOM 136 O GLN A 9 5.593 -8.576 -51.905 1.00 0.00 O
+ATOM 137 CB GLN A 9 4.422 -8.431 -54.953 1.00 0.00 C
+ATOM 138 CG GLN A 9 3.312 -7.714 -55.701 1.00 0.00 C
+ATOM 139 CD GLN A 9 2.523 -8.624 -56.609 1.00 0.00 C
+ATOM 140 OE1 GLN A 9 2.886 -9.774 -56.850 1.00 0.00 O
+ATOM 141 NE2 GLN A 9 1.421 -8.104 -57.125 1.00 0.00 N
+ATOM 142 H GLN A 9 6.183 -6.664 -55.740 1.00 0.00 H
+ATOM 143 HA GLN A 9 4.481 -6.936 -53.435 1.00 0.00 H
+ATOM 144 1HB GLN A 9 5.104 -8.866 -55.684 1.00 0.00 H
+ATOM 145 2HB GLN A 9 3.981 -9.252 -54.388 1.00 0.00 H
+ATOM 146 1HG GLN A 9 2.621 -7.282 -54.977 1.00 0.00 H
+ATOM 147 2HG GLN A 9 3.750 -6.927 -56.314 1.00 0.00 H
+ATOM 148 1HE2 GLN A 9 0.849 -8.651 -57.737 1.00 0.00 H
+ATOM 149 2HE2 GLN A 9 1.160 -7.164 -56.904 1.00 0.00 H
+ATOM 150 N LYS A 10 7.196 -8.861 -53.510 1.00 0.00 N
+ATOM 151 CA LYS A 10 8.145 -9.654 -52.685 1.00 0.00 C
+ATOM 152 C LYS A 10 8.608 -8.824 -51.484 1.00 0.00 C
+ATOM 153 O LYS A 10 8.632 -9.369 -50.370 1.00 0.00 O
+ATOM 154 CB LYS A 10 9.367 -10.070 -53.503 1.00 0.00 C
+ATOM 155 CG LYS A 10 9.136 -11.168 -54.530 1.00 0.00 C
+ATOM 156 CD LYS A 10 10.414 -11.522 -55.253 1.00 0.00 C
+ATOM 157 CE LYS A 10 10.227 -12.596 -56.300 1.00 0.00 C
+ATOM 158 NZ LYS A 10 11.460 -12.798 -57.100 1.00 0.00 N
+ATOM 159 H LYS A 10 7.424 -8.669 -54.475 1.00 0.00 H
+ATOM 160 HA LYS A 10 7.637 -10.555 -52.343 1.00 0.00 H
+ATOM 161 1HB LYS A 10 9.757 -9.206 -54.041 1.00 0.00 H
+ATOM 162 2HB LYS A 10 10.153 -10.419 -52.832 1.00 0.00 H
+ATOM 163 1HG LYS A 10 8.753 -12.058 -54.029 1.00 0.00 H
+ATOM 164 2HG LYS A 10 8.396 -10.836 -55.258 1.00 0.00 H
+ATOM 165 1HD LYS A 10 10.811 -10.633 -55.747 1.00 0.00 H
+ATOM 166 2HD LYS A 10 11.153 -11.877 -54.535 1.00 0.00 H
+ATOM 167 1HE LYS A 10 9.962 -13.534 -55.815 1.00 0.00 H
+ATOM 168 2HE LYS A 10 9.413 -12.315 -56.968 1.00 0.00 H
+ATOM 169 1HZ LYS A 10 11.300 -13.519 -57.789 1.00 0.00 H
+ATOM 170 2HZ LYS A 10 11.704 -11.935 -57.568 1.00 0.00 H
+ATOM 171 3HZ LYS A 10 12.216 -13.075 -56.491 1.00 0.00 H
+ATOM 172 N LEU A 11 8.974 -7.560 -51.705 1.00 0.00 N
+ATOM 173 CA LEU A 11 9.466 -6.652 -50.634 1.00 0.00 C
+ATOM 174 C LEU A 11 8.348 -6.409 -49.619 1.00 0.00 C
+ATOM 175 O LEU A 11 8.640 -6.438 -48.412 1.00 0.00 O
+ATOM 176 CB LEU A 11 9.937 -5.315 -51.219 1.00 0.00 C
+ATOM 177 CG LEU A 11 11.219 -5.371 -52.060 1.00 0.00 C
+ATOM 178 CD1 LEU A 11 11.414 -4.043 -52.779 1.00 0.00 C
+ATOM 179 CD2 LEU A 11 12.404 -5.684 -51.158 1.00 0.00 C
+ATOM 180 H LEU A 11 8.909 -7.215 -52.652 1.00 0.00 H
+ATOM 181 HA LEU A 11 10.304 -7.133 -50.131 1.00 0.00 H
+ATOM 182 1HB LEU A 11 9.145 -4.913 -51.849 1.00 0.00 H
+ATOM 183 2HB LEU A 11 10.109 -4.618 -50.399 1.00 0.00 H
+ATOM 184 HG LEU A 11 11.124 -6.149 -52.817 1.00 0.00 H
+ATOM 185 1HD1 LEU A 11 12.325 -4.083 -53.376 1.00 0.00 H
+ATOM 186 2HD1 LEU A 11 10.561 -3.854 -53.431 1.00 0.00 H
+ATOM 187 3HD1 LEU A 11 11.496 -3.241 -52.046 1.00 0.00 H
+ATOM 188 1HD2 LEU A 11 13.315 -5.725 -51.756 1.00 0.00 H
+ATOM 189 2HD2 LEU A 11 12.501 -4.906 -50.401 1.00 0.00 H
+ATOM 190 3HD2 LEU A 11 12.247 -6.646 -50.671 1.00 0.00 H
+ATOM 191 N ILE A 12 7.122 -6.185 -50.093 1.00 0.00 N
+ATOM 192 CA ILE A 12 5.941 -5.923 -49.218 1.00 0.00 C
+ATOM 193 C ILE A 12 5.702 -7.177 -48.369 1.00 0.00 C
+ATOM 194 O ILE A 12 5.589 -7.036 -47.134 1.00 0.00 O
+ATOM 195 CB ILE A 12 4.677 -5.587 -50.030 1.00 0.00 C
+ATOM 196 CG1 ILE A 12 4.818 -4.215 -50.694 1.00 0.00 C
+ATOM 197 CG2 ILE A 12 3.446 -5.625 -49.138 1.00 0.00 C
+ATOM 198 CD1 ILE A 12 3.777 -3.940 -51.755 1.00 0.00 C
+ATOM 199 H ILE A 12 6.998 -6.196 -51.096 1.00 0.00 H
+ATOM 200 HA ILE A 12 6.187 -5.104 -48.542 1.00 0.00 H
+ATOM 201 HB ILE A 12 4.556 -6.314 -50.832 1.00 0.00 H
+ATOM 202 1HG1 ILE A 12 4.748 -3.435 -49.936 1.00 0.00 H
+ATOM 203 2HG1 ILE A 12 5.803 -4.133 -51.155 1.00 0.00 H
+ATOM 204 1HG2 ILE A 12 2.562 -5.385 -49.727 1.00 0.00 H
+ATOM 205 2HG2 ILE A 12 3.337 -6.622 -48.711 1.00 0.00 H
+ATOM 206 3HG2 ILE A 12 3.555 -4.897 -48.334 1.00 0.00 H
+ATOM 207 1HD1 ILE A 12 3.943 -2.949 -52.180 1.00 0.00 H
+ATOM 208 2HD1 ILE A 12 3.854 -4.690 -52.543 1.00 0.00 H
+ATOM 209 3HD1 ILE A 12 2.784 -3.981 -51.310 1.00 0.00 H
+ATOM 210 N ALA A 13 5.676 -8.352 -49.008 1.00 0.00 N
+ATOM 211 CA ALA A 13 5.426 -9.663 -48.365 1.00 0.00 C
+ATOM 212 C ALA A 13 6.516 -9.967 -47.335 1.00 0.00 C
+ATOM 213 O ALA A 13 6.167 -10.482 -46.256 1.00 0.00 O
+ATOM 214 CB ALA A 13 5.350 -10.751 -49.398 1.00 0.00 C
+ATOM 215 H ALA A 13 5.842 -8.316 -50.003 1.00 0.00 H
+ATOM 216 HA ALA A 13 4.471 -9.608 -47.841 1.00 0.00 H
+ATOM 217 1HB ALA A 13 5.167 -11.708 -48.908 1.00 0.00 H
+ATOM 218 2HB ALA A 13 4.537 -10.538 -50.092 1.00 0.00 H
+ATOM 219 3HB ALA A 13 6.291 -10.800 -49.945 1.00 0.00 H
+ATOM 220 N ASN A 14 7.778 -9.680 -47.670 1.00 0.00 N
+ATOM 221 CA ASN A 14 8.950 -9.994 -46.809 1.00 0.00 C
+ATOM 222 C ASN A 14 8.891 -9.097 -45.571 1.00 0.00 C
+ATOM 223 O ASN A 14 9.024 -9.647 -44.464 1.00 0.00 O
+ATOM 224 CB ASN A 14 10.274 -9.875 -47.566 1.00 0.00 C
+ATOM 225 CG ASN A 14 10.489 -11.020 -48.534 1.00 0.00 C
+ATOM 226 OD1 ASN A 14 9.875 -12.086 -48.412 1.00 0.00 O
+ATOM 227 ND2 ASN A 14 11.363 -10.803 -49.504 1.00 0.00 N
+ATOM 228 H ASN A 14 7.930 -9.224 -48.559 1.00 0.00 H
+ATOM 229 HA ASN A 14 8.857 -11.023 -46.458 1.00 0.00 H
+ATOM 230 1HB ASN A 14 10.296 -8.935 -48.118 1.00 0.00 H
+ATOM 231 2HB ASN A 14 11.100 -9.855 -46.854 1.00 0.00 H
+ATOM 232 1HD2 ASN A 14 11.552 -11.518 -50.178 1.00 0.00 H
+ATOM 233 2HD2 ASN A 14 11.835 -9.924 -49.564 1.00 0.00 H
+ATOM 234 N GLN A 15 8.656 -7.794 -45.765 1.00 0.00 N
+ATOM 235 CA GLN A 15 8.582 -6.774 -44.683 1.00 0.00 C
+ATOM 236 C GLN A 15 7.345 -7.024 -43.810 1.00 0.00 C
+ATOM 237 O GLN A 15 7.422 -6.796 -42.585 1.00 0.00 O
+ATOM 238 CB GLN A 15 8.518 -5.363 -45.270 1.00 0.00 C
+ATOM 239 CG GLN A 15 9.784 -4.920 -45.993 1.00 0.00 C
+ATOM 240 CD GLN A 15 10.972 -4.795 -45.070 1.00 0.00 C
+ATOM 241 OE1 GLN A 15 11.815 -5.692 -44.996 1.00 0.00 O
+ATOM 242 NE2 GLN A 15 11.050 -3.674 -44.370 1.00 0.00 N
+ATOM 243 H GLN A 15 8.523 -7.504 -46.723 1.00 0.00 H
+ATOM 244 HA GLN A 15 9.481 -6.854 -44.071 1.00 0.00 H
+ATOM 245 1HB GLN A 15 7.691 -5.301 -45.979 1.00 0.00 H
+ATOM 246 2HB GLN A 15 8.320 -4.646 -44.474 1.00 0.00 H
+ATOM 247 1HG GLN A 15 10.028 -5.654 -46.760 1.00 0.00 H
+ATOM 248 2HG GLN A 15 9.607 -3.946 -46.450 1.00 0.00 H
+ATOM 249 1HE2 GLN A 15 11.814 -3.529 -43.739 1.00 0.00 H
+ATOM 250 2HE2 GLN A 15 10.346 -2.972 -44.470 1.00 0.00 H
+ATOM 251 N PHE A 16 6.245 -7.461 -44.426 1.00 0.00 N
+ATOM 252 CA PHE A 16 4.971 -7.794 -43.737 1.00 0.00 C
+ATOM 253 C PHE A 16 5.196 -9.003 -42.813 1.00 0.00 C
+ATOM 254 O PHE A 16 4.852 -8.911 -41.626 1.00 0.00 O
+ATOM 255 CB PHE A 16 3.861 -8.026 -44.767 1.00 0.00 C
+ATOM 256 CG PHE A 16 2.560 -8.498 -44.180 1.00 0.00 C
+ATOM 257 CD1 PHE A 16 1.840 -7.683 -43.326 1.00 0.00 C
+ATOM 258 CD2 PHE A 16 2.073 -9.763 -44.460 1.00 0.00 C
+ATOM 259 CE1 PHE A 16 0.649 -8.124 -42.770 1.00 0.00 C
+ATOM 260 CE2 PHE A 16 0.874 -10.197 -43.917 1.00 0.00 C
+ATOM 261 CZ PHE A 16 0.157 -9.372 -43.080 1.00 0.00 C
+ATOM 262 H PHE A 16 6.303 -7.565 -45.429 1.00 0.00 H
+ATOM 263 HA PHE A 16 4.690 -6.954 -43.101 1.00 0.00 H
+ATOM 264 1HB PHE A 16 3.667 -7.101 -45.308 1.00 0.00 H
+ATOM 265 2HB PHE A 16 4.188 -8.767 -45.494 1.00 0.00 H
+ATOM 266 HD1 PHE A 16 2.219 -6.687 -43.095 1.00 0.00 H
+ATOM 267 HD2 PHE A 16 2.640 -10.419 -45.122 1.00 0.00 H
+ATOM 268 HE1 PHE A 16 0.099 -7.480 -42.083 1.00 0.00 H
+ATOM 269 HE2 PHE A 16 0.499 -11.193 -44.151 1.00 0.00 H
+ATOM 270 HZ PHE A 16 -0.792 -9.703 -42.664 1.00 0.00 H
+ATOM 271 N ASN A 17 5.798 -10.075 -43.340 1.00 0.00 N
+ATOM 272 CA ASN A 17 6.073 -11.352 -42.619 1.00 0.00 C
+ATOM 273 C ASN A 17 7.059 -11.091 -41.474 1.00 0.00 C
+ATOM 274 O ASN A 17 6.882 -11.680 -40.409 1.00 0.00 O
+ATOM 275 CB ASN A 17 6.612 -12.415 -43.558 1.00 0.00 C
+ATOM 276 CG ASN A 17 5.553 -12.974 -44.467 1.00 0.00 C
+ATOM 277 OD1 ASN A 17 4.357 -12.911 -44.159 1.00 0.00 O
+ATOM 278 ND2 ASN A 17 5.968 -13.519 -45.582 1.00 0.00 N
+ATOM 279 H ASN A 17 6.079 -9.986 -44.306 1.00 0.00 H
+ATOM 280 HA ASN A 17 5.140 -11.710 -42.183 1.00 0.00 H
+ATOM 281 1HB ASN A 17 7.411 -11.992 -44.168 1.00 0.00 H
+ATOM 282 2HB ASN A 17 7.041 -13.231 -42.976 1.00 0.00 H
+ATOM 283 1HD2 ASN A 17 5.307 -13.907 -46.225 1.00 0.00 H
+ATOM 284 2HD2 ASN A 17 6.945 -13.548 -45.790 1.00 0.00 H
+ATOM 285 N SER A 18 8.059 -10.235 -41.692 1.00 0.00 N
+ATOM 286 CA SER A 18 9.097 -9.898 -40.686 1.00 0.00 C
+ATOM 287 C SER A 18 8.440 -9.061 -39.586 1.00 0.00 C
+ATOM 288 O SER A 18 8.730 -9.328 -38.419 1.00 0.00 O
+ATOM 289 CB SER A 18 10.245 -9.132 -41.316 1.00 0.00 C
+ATOM 290 OG SER A 18 9.850 -7.835 -41.668 1.00 0.00 O
+ATOM 291 H SER A 18 8.097 -9.801 -42.603 1.00 0.00 H
+ATOM 292 HA SER A 18 9.447 -10.823 -40.225 1.00 0.00 H
+ATOM 293 1HB SER A 18 11.078 -9.084 -40.615 1.00 0.00 H
+ATOM 294 2HB SER A 18 10.592 -9.662 -42.202 1.00 0.00 H
+ATOM 295 HG SER A 18 10.523 -7.507 -42.269 1.00 0.00 H
+ATOM 296 N ALA A 19 7.534 -8.144 -39.942 1.00 0.00 N
+ATOM 297 CA ALA A 19 6.789 -7.276 -38.998 1.00 0.00 C
+ATOM 298 C ALA A 19 5.964 -8.131 -38.028 1.00 0.00 C
+ATOM 299 O ALA A 19 5.996 -7.854 -36.817 1.00 0.00 O
+ATOM 300 CB ALA A 19 5.906 -6.322 -39.760 1.00 0.00 C
+ATOM 301 H ALA A 19 7.361 -8.056 -40.933 1.00 0.00 H
+ATOM 302 HA ALA A 19 7.515 -6.703 -38.419 1.00 0.00 H
+ATOM 303 1HB ALA A 19 5.364 -5.689 -39.057 1.00 0.00 H
+ATOM 304 2HB ALA A 19 6.519 -5.700 -40.411 1.00 0.00 H
+ATOM 305 3HB ALA A 19 5.196 -6.887 -40.362 1.00 0.00 H
+ATOM 306 N ILE A 20 5.245 -9.128 -38.542 1.00 0.00 N
+ATOM 307 CA ILE A 20 4.361 -10.004 -37.721 1.00 0.00 C
+ATOM 308 C ILE A 20 5.216 -10.759 -36.706 1.00 0.00 C
+ATOM 309 O ILE A 20 4.809 -10.816 -35.538 1.00 0.00 O
+ATOM 310 CB ILE A 20 3.580 -11.009 -38.588 1.00 0.00 C
+ATOM 311 CG1 ILE A 20 2.510 -10.286 -39.410 1.00 0.00 C
+ATOM 312 CG2 ILE A 20 2.950 -12.086 -37.718 1.00 0.00 C
+ATOM 313 CD1 ILE A 20 1.876 -11.147 -40.479 1.00 0.00 C
+ATOM 314 H ILE A 20 5.311 -9.289 -39.536 1.00 0.00 H
+ATOM 315 HA ILE A 20 3.660 -9.374 -37.176 1.00 0.00 H
+ATOM 316 HB ILE A 20 4.258 -11.480 -39.299 1.00 0.00 H
+ATOM 317 1HG1 ILE A 20 1.722 -9.929 -38.748 1.00 0.00 H
+ATOM 318 2HG1 ILE A 20 2.949 -9.413 -39.892 1.00 0.00 H
+ATOM 319 1HG2 ILE A 20 2.402 -12.787 -38.347 1.00 0.00 H
+ATOM 320 2HG2 ILE A 20 3.732 -12.618 -37.176 1.00 0.00 H
+ATOM 321 3HG2 ILE A 20 2.265 -11.624 -37.006 1.00 0.00 H
+ATOM 322 1HD1 ILE A 20 1.128 -10.564 -41.019 1.00 0.00 H
+ATOM 323 2HD1 ILE A 20 2.644 -11.486 -41.176 1.00 0.00 H
+ATOM 324 3HD1 ILE A 20 1.398 -12.009 -40.016 1.00 0.00 H
+ATOM 325 N GLY A 21 6.337 -11.329 -37.151 1.00 0.00 N
+ATOM 326 CA GLY A 21 7.309 -12.025 -36.287 1.00 0.00 C
+ATOM 327 C GLY A 21 7.694 -11.156 -35.109 1.00 0.00 C
+ATOM 328 O GLY A 21 7.543 -11.632 -33.970 1.00 0.00 O
+ATOM 329 H GLY A 21 6.516 -11.269 -38.143 1.00 0.00 H
+ATOM 330 1HA GLY A 21 6.874 -12.961 -35.933 1.00 0.00 H
+ATOM 331 2HA GLY A 21 8.194 -12.280 -36.866 1.00 0.00 H
+ATOM 332 N LYS A 22 8.122 -9.912 -35.379 1.00 0.00 N
+ATOM 333 CA LYS A 22 8.484 -8.893 -34.353 1.00 0.00 C
+ATOM 334 C LYS A 22 7.274 -8.620 -33.447 1.00 0.00 C
+ATOM 335 O LYS A 22 7.479 -8.515 -32.232 1.00 0.00 O
+ATOM 336 CB LYS A 22 8.960 -7.595 -35.006 1.00 0.00 C
+ATOM 337 CG LYS A 22 10.297 -7.707 -35.727 1.00 0.00 C
+ATOM 338 CD LYS A 22 10.578 -6.468 -36.564 1.00 0.00 C
+ATOM 339 CE LYS A 22 11.855 -6.626 -37.377 1.00 0.00 C
+ATOM 340 NZ LYS A 22 12.057 -5.495 -38.322 1.00 0.00 N
+ATOM 341 H LYS A 22 8.197 -9.672 -36.357 1.00 0.00 H
+ATOM 342 HA LYS A 22 9.332 -9.268 -33.779 1.00 0.00 H
+ATOM 343 1HB LYS A 22 8.217 -7.257 -35.728 1.00 0.00 H
+ATOM 344 2HB LYS A 22 9.055 -6.819 -34.246 1.00 0.00 H
+ATOM 345 1HG LYS A 22 11.096 -7.830 -34.996 1.00 0.00 H
+ATOM 346 2HG LYS A 22 10.286 -8.580 -36.379 1.00 0.00 H
+ATOM 347 1HD LYS A 22 9.744 -6.290 -37.245 1.00 0.00 H
+ATOM 348 2HD LYS A 22 10.681 -5.602 -35.910 1.00 0.00 H
+ATOM 349 1HE LYS A 22 12.710 -6.678 -36.704 1.00 0.00 H
+ATOM 350 2HE LYS A 22 11.812 -7.555 -37.946 1.00 0.00 H
+ATOM 351 1HZ LYS A 22 12.912 -5.637 -38.841 1.00 0.00 H
+ATOM 352 2HZ LYS A 22 11.278 -5.448 -38.964 1.00 0.00 H
+ATOM 353 3HZ LYS A 22 12.118 -4.630 -37.805 1.00 0.00 H
+ATOM 354 N ILE A 23 6.071 -8.472 -34.014 1.00 0.00 N
+ATOM 355 CA ILE A 23 4.830 -8.095 -33.265 1.00 0.00 C
+ATOM 356 C ILE A 23 4.443 -9.253 -32.327 1.00 0.00 C
+ATOM 357 O ILE A 23 4.139 -8.976 -31.134 1.00 0.00 O
+ATOM 358 CB ILE A 23 3.658 -7.783 -34.213 1.00 0.00 C
+ATOM 359 CG1 ILE A 23 3.930 -6.492 -34.991 1.00 0.00 C
+ATOM 360 CG2 ILE A 23 2.357 -7.674 -33.434 1.00 0.00 C
+ATOM 361 CD1 ILE A 23 3.046 -6.312 -36.204 1.00 0.00 C
+ATOM 362 H ILE A 23 6.016 -8.626 -35.012 1.00 0.00 H
+ATOM 363 HA ILE A 23 5.052 -7.233 -32.637 1.00 0.00 H
+ATOM 364 HB ILE A 23 3.564 -8.580 -34.950 1.00 0.00 H
+ATOM 365 1HG1 ILE A 23 3.788 -5.635 -34.334 1.00 0.00 H
+ATOM 366 2HG1 ILE A 23 4.969 -6.479 -35.322 1.00 0.00 H
+ATOM 367 1HG2 ILE A 23 1.539 -7.452 -34.120 1.00 0.00 H
+ATOM 368 2HG2 ILE A 23 2.158 -8.616 -32.925 1.00 0.00 H
+ATOM 369 3HG2 ILE A 23 2.439 -6.874 -32.698 1.00 0.00 H
+ATOM 370 1HD1 ILE A 23 3.299 -5.376 -36.702 1.00 0.00 H
+ATOM 371 2HD1 ILE A 23 3.200 -7.143 -36.893 1.00 0.00 H
+ATOM 372 3HD1 ILE A 23 2.003 -6.286 -35.893 1.00 0.00 H
+ATOM 373 N GLN A 24 4.462 -10.492 -32.849 1.00 0.00 N
+ATOM 374 CA GLN A 24 4.115 -11.743 -32.117 1.00 0.00 C
+ATOM 375 C GLN A 24 5.033 -11.890 -30.900 1.00 0.00 C
+ATOM 376 O GLN A 24 4.550 -12.375 -29.858 1.00 0.00 O
+ATOM 377 CB GLN A 24 4.276 -12.977 -33.008 1.00 0.00 C
+ATOM 378 CG GLN A 24 3.177 -13.165 -34.047 1.00 0.00 C
+ATOM 379 CD GLN A 24 3.442 -14.307 -35.003 1.00 0.00 C
+ATOM 380 OE1 GLN A 24 4.574 -14.542 -35.419 1.00 0.00 O
+ATOM 381 NE2 GLN A 24 2.387 -15.013 -35.386 1.00 0.00 N
+ATOM 382 H GLN A 24 4.736 -10.550 -33.819 1.00 0.00 H
+ATOM 383 HA GLN A 24 3.074 -11.683 -31.802 1.00 0.00 H
+ATOM 384 1HB GLN A 24 5.226 -12.921 -33.541 1.00 0.00 H
+ATOM 385 2HB GLN A 24 4.300 -13.873 -32.389 1.00 0.00 H
+ATOM 386 1HG GLN A 24 2.238 -13.372 -33.534 1.00 0.00 H
+ATOM 387 2HG GLN A 24 3.089 -12.251 -34.635 1.00 0.00 H
+ATOM 388 1HE2 GLN A 24 2.500 -15.781 -36.018 1.00 0.00 H
+ATOM 389 2HE2 GLN A 24 1.477 -14.779 -35.044 1.00 0.00 H
+ATOM 390 N ASP A 25 6.309 -11.513 -31.054 1.00 0.00 N
+ATOM 391 CA ASP A 25 7.344 -11.585 -29.982 1.00 0.00 C
+ATOM 392 C ASP A 25 6.893 -10.645 -28.857 1.00 0.00 C
+ATOM 393 O ASP A 25 6.920 -11.069 -27.688 1.00 0.00 O
+ATOM 394 CB ASP A 25 8.728 -11.179 -30.493 1.00 0.00 C
+ATOM 395 CG ASP A 25 9.822 -11.360 -29.449 1.00 0.00 C
+ATOM 396 OD1 ASP A 25 9.964 -12.451 -28.948 1.00 0.00 O
+ATOM 397 OD2 ASP A 25 10.505 -10.406 -29.161 1.00 0.00 O
+ATOM 398 H ASP A 25 6.568 -11.159 -31.963 1.00 0.00 H
+ATOM 399 HA ASP A 25 7.338 -12.592 -29.563 1.00 0.00 H
+ATOM 400 1HB ASP A 25 8.982 -11.775 -31.370 1.00 0.00 H
+ATOM 401 2HB ASP A 25 8.710 -10.133 -30.801 1.00 0.00 H
+ATOM 402 N SER A 26 6.432 -9.442 -29.203 1.00 0.00 N
+ATOM 403 CA SER A 26 6.067 -8.383 -28.228 1.00 0.00 C
+ATOM 404 C SER A 26 4.749 -8.756 -27.555 1.00 0.00 C
+ATOM 405 O SER A 26 4.592 -8.436 -26.361 1.00 0.00 O
+ATOM 406 CB SER A 26 5.937 -7.035 -28.911 1.00 0.00 C
+ATOM 407 OG SER A 26 4.839 -7.017 -29.781 1.00 0.00 O
+ATOM 408 H SER A 26 6.332 -9.257 -30.191 1.00 0.00 H
+ATOM 409 HA SER A 26 6.850 -8.325 -27.470 1.00 0.00 H
+ATOM 410 1HB SER A 26 5.821 -6.256 -28.158 1.00 0.00 H
+ATOM 411 2HB SER A 26 6.849 -6.820 -29.466 1.00 0.00 H
+ATOM 412 HG SER A 26 4.963 -6.250 -30.346 1.00 0.00 H
+ATOM 413 N LEU A 27 3.845 -9.406 -28.299 1.00 0.00 N
+ATOM 414 CA LEU A 27 2.530 -9.868 -27.779 1.00 0.00 C
+ATOM 415 C LEU A 27 2.729 -10.975 -26.745 1.00 0.00 C
+ATOM 416 O LEU A 27 2.055 -10.942 -25.707 1.00 0.00 O
+ATOM 417 CB LEU A 27 1.643 -10.384 -28.919 1.00 0.00 C
+ATOM 418 CG LEU A 27 1.109 -9.314 -29.882 1.00 0.00 C
+ATOM 419 CD1 LEU A 27 0.458 -9.991 -31.081 1.00 0.00 C
+ATOM 420 CD2 LEU A 27 0.117 -8.423 -29.151 1.00 0.00 C
+ATOM 421 H LEU A 27 4.084 -9.587 -29.263 1.00 0.00 H
+ATOM 422 HA LEU A 27 2.034 -9.026 -27.296 1.00 0.00 H
+ATOM 423 1HB LEU A 27 2.214 -11.103 -29.506 1.00 0.00 H
+ATOM 424 2HB LEU A 27 0.786 -10.898 -28.487 1.00 0.00 H
+ATOM 425 HG LEU A 27 1.938 -8.710 -30.251 1.00 0.00 H
+ATOM 426 1HD1 LEU A 27 0.079 -9.232 -31.765 1.00 0.00 H
+ATOM 427 2HD1 LEU A 27 1.194 -10.608 -31.596 1.00 0.00 H
+ATOM 428 3HD1 LEU A 27 -0.367 -10.616 -30.742 1.00 0.00 H
+ATOM 429 1HD2 LEU A 27 -0.262 -7.662 -29.835 1.00 0.00 H
+ATOM 430 2HD2 LEU A 27 -0.713 -9.027 -28.783 1.00 0.00 H
+ATOM 431 3HD2 LEU A 27 0.614 -7.939 -28.310 1.00 0.00 H
+ATOM 432 N SER A 28 3.622 -11.917 -27.018 1.00 0.00 N
+ATOM 433 CA SER A 28 3.989 -12.993 -26.063 1.00 0.00 C
+ATOM 434 C SER A 28 4.653 -12.394 -24.817 1.00 0.00 C
+ATOM 435 O SER A 28 4.269 -12.812 -23.713 1.00 0.00 O
+ATOM 436 CB SER A 28 4.924 -13.992 -26.717 1.00 0.00 C
+ATOM 437 OG SER A 28 5.264 -15.018 -25.827 1.00 0.00 O
+ATOM 438 H SER A 28 4.069 -11.891 -27.924 1.00 0.00 H
+ATOM 439 HA SER A 28 3.073 -13.477 -25.719 1.00 0.00 H
+ATOM 440 1HB SER A 28 4.446 -14.416 -27.599 1.00 0.00 H
+ATOM 441 2HB SER A 28 5.827 -13.480 -27.048 1.00 0.00 H
+ATOM 442 HG SER A 28 5.850 -15.605 -26.310 1.00 0.00 H
+ATOM 443 N SER A 29 5.584 -11.447 -24.966 1.00 0.00 N
+ATOM 444 CA SER A 29 6.269 -10.783 -23.822 1.00 0.00 C
+ATOM 445 C SER A 29 5.260 -9.976 -22.989 1.00 0.00 C
+ATOM 446 O SER A 29 5.383 -10.000 -21.755 1.00 0.00 O
+ATOM 447 CB SER A 29 7.373 -9.870 -24.317 1.00 0.00 C
+ATOM 448 OG SER A 29 8.397 -10.605 -24.930 1.00 0.00 O
+ATOM 449 H SER A 29 5.827 -11.176 -25.909 1.00 0.00 H
+ATOM 450 HA SER A 29 6.676 -11.555 -23.167 1.00 0.00 H
+ATOM 451 1HB SER A 29 6.961 -9.153 -25.027 1.00 0.00 H
+ATOM 452 2HB SER A 29 7.780 -9.304 -23.480 1.00 0.00 H
+ATOM 453 HG SER A 29 8.077 -10.822 -25.809 1.00 0.00 H
+ATOM 454 N THR A 30 4.325 -9.272 -23.643 1.00 0.00 N
+ATOM 455 CA THR A 30 3.284 -8.438 -22.985 1.00 0.00 C
+ATOM 456 C THR A 30 2.425 -9.353 -22.108 1.00 0.00 C
+ATOM 457 O THR A 30 2.247 -9.035 -20.918 1.00 0.00 O
+ATOM 458 CB THR A 30 2.398 -7.699 -24.005 1.00 0.00 C
+ATOM 459 OG1 THR A 30 3.201 -6.791 -24.770 1.00 0.00 O
+ATOM 460 CG2 THR A 30 1.300 -6.923 -23.294 1.00 0.00 C
+ATOM 461 H THR A 30 4.348 -9.326 -24.651 1.00 0.00 H
+ATOM 462 HA THR A 30 3.778 -7.706 -22.347 1.00 0.00 H
+ATOM 463 HB THR A 30 1.944 -8.421 -24.683 1.00 0.00 H
+ATOM 464 HG1 THR A 30 3.771 -7.289 -25.362 1.00 0.00 H
+ATOM 465 1HG2 THR A 30 0.684 -6.407 -24.030 1.00 0.00 H
+ATOM 466 2HG2 THR A 30 0.681 -7.612 -22.720 1.00 0.00 H
+ATOM 467 3HG2 THR A 30 1.748 -6.193 -22.621 1.00 0.00 H
+ATOM 468 N ALA A 31 1.942 -10.460 -22.676 1.00 0.00 N
+ATOM 469 CA ALA A 31 1.089 -11.465 -21.994 1.00 0.00 C
+ATOM 470 C ALA A 31 1.823 -12.086 -20.799 1.00 0.00 C
+ATOM 471 O ALA A 31 1.178 -12.312 -19.761 1.00 0.00 O
+ATOM 472 CB ALA A 31 0.671 -12.520 -22.977 1.00 0.00 C
+ATOM 473 H ALA A 31 2.191 -10.601 -23.645 1.00 0.00 H
+ATOM 474 HA ALA A 31 0.203 -10.956 -21.615 1.00 0.00 H
+ATOM 475 1HB ALA A 31 0.045 -13.258 -22.474 1.00 0.00 H
+ATOM 476 2HB ALA A 31 0.110 -12.060 -23.788 1.00 0.00 H
+ATOM 477 3HB ALA A 31 1.555 -13.011 -23.380 1.00 0.00 H
+ATOM 478 N SER A 32 3.122 -12.361 -20.953 1.00 0.00 N
+ATOM 479 CA SER A 32 4.003 -12.929 -19.902 1.00 0.00 C
+ATOM 480 C SER A 32 4.172 -11.891 -18.788 1.00 0.00 C
+ATOM 481 O SER A 32 4.093 -12.259 -17.609 1.00 0.00 O
+ATOM 482 CB SER A 32 5.356 -13.310 -20.472 1.00 0.00 C
+ATOM 483 OG SER A 32 5.232 -14.340 -21.413 1.00 0.00 O
+ATOM 484 H SER A 32 3.510 -12.158 -21.863 1.00 0.00 H
+ATOM 485 HA SER A 32 3.512 -13.805 -19.475 1.00 0.00 H
+ATOM 486 1HB SER A 32 5.811 -12.438 -20.941 1.00 0.00 H
+ATOM 487 2HB SER A 32 6.014 -13.628 -19.664 1.00 0.00 H
+ATOM 488 HG SER A 32 4.924 -13.925 -22.222 1.00 0.00 H
+ATOM 489 N ALA A 33 4.383 -10.630 -19.155 1.00 0.00 N
+ATOM 490 CA ALA A 33 4.571 -9.510 -18.201 1.00 0.00 C
+ATOM 491 C ALA A 33 3.282 -9.343 -17.390 1.00 0.00 C
+ATOM 492 O ALA A 33 3.358 -9.170 -16.151 1.00 0.00 O
+ATOM 493 CB ALA A 33 4.950 -8.231 -18.928 1.00 0.00 C
+ATOM 494 H ALA A 33 4.416 -10.442 -20.147 1.00 0.00 H
+ATOM 495 HA ALA A 33 5.379 -9.775 -17.520 1.00 0.00 H
+ATOM 496 1HB ALA A 33 5.081 -7.426 -18.203 1.00 0.00 H
+ATOM 497 2HB ALA A 33 5.881 -8.385 -19.471 1.00 0.00 H
+ATOM 498 3HB ALA A 33 4.160 -7.962 -19.629 1.00 0.00 H
+ATOM 499 N LEU A 34 2.132 -9.395 -18.065 1.00 0.00 N
+ATOM 500 CA LEU A 34 0.820 -9.250 -17.390 1.00 0.00 C
+ATOM 501 C LEU A 34 0.626 -10.419 -16.417 1.00 0.00 C
+ATOM 502 O LEU A 34 0.161 -10.169 -15.289 1.00 0.00 O
+ATOM 503 CB LEU A 34 -0.278 -9.168 -18.449 1.00 0.00 C
+ATOM 504 CG LEU A 34 -0.267 -7.885 -19.273 1.00 0.00 C
+ATOM 505 CD1 LEU A 34 -1.150 -8.037 -20.494 1.00 0.00 C
+ATOM 506 CD2 LEU A 34 -0.705 -6.682 -18.450 1.00 0.00 C
+ATOM 507 H LEU A 34 2.157 -9.539 -19.063 1.00 0.00 H
+ATOM 508 HA LEU A 34 0.831 -8.327 -16.810 1.00 0.00 H
+ATOM 509 1HB LEU A 34 -0.170 -10.013 -19.127 1.00 0.00 H
+ATOM 510 2HB LEU A 34 -1.245 -9.250 -17.953 1.00 0.00 H
+ATOM 511 HG LEU A 34 0.741 -7.699 -19.643 1.00 0.00 H
+ATOM 512 1HD1 LEU A 34 -1.132 -7.114 -21.073 1.00 0.00 H
+ATOM 513 2HD1 LEU A 34 -0.780 -8.858 -21.110 1.00 0.00 H
+ATOM 514 3HD1 LEU A 34 -2.172 -8.249 -20.180 1.00 0.00 H
+ATOM 515 1HD2 LEU A 34 -0.683 -5.787 -19.074 1.00 0.00 H
+ATOM 516 2HD2 LEU A 34 -1.720 -6.842 -18.082 1.00 0.00 H
+ATOM 517 3HD2 LEU A 34 -0.029 -6.553 -17.606 1.00 0.00 H
+ATOM 518 N GLY A 35 1.022 -11.631 -16.817 1.00 0.00 N
+ATOM 519 CA GLY A 35 0.997 -12.836 -15.966 1.00 0.00 C
+ATOM 520 C GLY A 35 1.843 -12.687 -14.712 1.00 0.00 C
+ATOM 521 O GLY A 35 1.330 -12.969 -13.614 1.00 0.00 O
+ATOM 522 H GLY A 35 1.356 -11.707 -17.767 1.00 0.00 H
+ATOM 523 1HA GLY A 35 -0.031 -13.054 -15.675 1.00 0.00 H
+ATOM 524 2HA GLY A 35 1.358 -13.692 -16.536 1.00 0.00 H
+ATOM 525 N LYS A 36 3.095 -12.256 -14.851 1.00 0.00 N
+ATOM 526 CA LYS A 36 4.023 -12.069 -13.705 1.00 0.00 C
+ATOM 527 C LYS A 36 3.451 -11.017 -12.743 1.00 0.00 C
+ATOM 528 O LYS A 36 3.553 -11.267 -11.525 1.00 0.00 O
+ATOM 529 CB LYS A 36 5.414 -11.648 -14.182 1.00 0.00 C
+ATOM 530 CG LYS A 36 6.216 -12.761 -14.842 1.00 0.00 C
+ATOM 531 CD LYS A 36 6.763 -13.735 -13.809 1.00 0.00 C
+ATOM 532 CE LYS A 36 7.670 -14.774 -14.452 1.00 0.00 C
+ATOM 533 NZ LYS A 36 6.897 -15.790 -15.218 1.00 0.00 N
+ATOM 534 H LYS A 36 3.419 -12.048 -15.786 1.00 0.00 H
+ATOM 535 HA LYS A 36 4.081 -13.006 -13.150 1.00 0.00 H
+ATOM 536 1HB LYS A 36 5.321 -10.832 -14.900 1.00 0.00 H
+ATOM 537 2HB LYS A 36 5.992 -11.275 -13.336 1.00 0.00 H
+ATOM 538 1HG LYS A 36 5.579 -13.305 -15.540 1.00 0.00 H
+ATOM 539 2HG LYS A 36 7.048 -12.330 -15.398 1.00 0.00 H
+ATOM 540 1HD LYS A 36 7.330 -13.187 -13.056 1.00 0.00 H
+ATOM 541 2HD LYS A 36 5.935 -14.245 -13.316 1.00 0.00 H
+ATOM 542 1HE LYS A 36 8.367 -14.281 -15.127 1.00 0.00 H
+ATOM 543 2HE LYS A 36 8.246 -15.283 -13.679 1.00 0.00 H
+ATOM 544 1HZ LYS A 36 7.533 -16.459 -15.628 1.00 0.00 H
+ATOM 545 2HZ LYS A 36 6.259 -16.268 -14.597 1.00 0.00 H
+ATOM 546 3HZ LYS A 36 6.373 -15.332 -15.951 1.00 0.00 H
+ATOM 547 N LEU A 37 2.862 -9.917 -13.249 1.00 0.00 N
+ATOM 548 CA LEU A 37 2.201 -8.859 -12.429 1.00 0.00 C
+ATOM 549 C LEU A 37 1.002 -9.454 -11.685 1.00 0.00 C
+ATOM 550 O LEU A 37 0.833 -9.143 -10.478 1.00 0.00 O
+ATOM 551 CB LEU A 37 1.735 -7.692 -13.309 1.00 0.00 C
+ATOM 552 CG LEU A 37 2.841 -6.759 -13.816 1.00 0.00 C
+ATOM 553 CD1 LEU A 37 2.291 -5.877 -14.929 1.00 0.00 C
+ATOM 554 CD2 LEU A 37 3.365 -5.918 -12.661 1.00 0.00 C
+ATOM 555 H LEU A 37 2.881 -9.821 -14.254 1.00 0.00 H
+ATOM 556 HA LEU A 37 2.922 -8.483 -11.704 1.00 0.00 H
+ATOM 557 1HB LEU A 37 1.219 -8.097 -14.178 1.00 0.00 H
+ATOM 558 2HB LEU A 37 1.027 -7.089 -12.740 1.00 0.00 H
+ATOM 559 HG LEU A 37 3.656 -7.352 -14.232 1.00 0.00 H
+ATOM 560 1HD1 LEU A 37 3.078 -5.213 -15.290 1.00 0.00 H
+ATOM 561 2HD1 LEU A 37 1.942 -6.503 -15.750 1.00 0.00 H
+ATOM 562 3HD1 LEU A 37 1.463 -5.283 -14.547 1.00 0.00 H
+ATOM 563 1HD2 LEU A 37 4.152 -5.255 -13.022 1.00 0.00 H
+ATOM 564 2HD2 LEU A 37 2.552 -5.323 -12.245 1.00 0.00 H
+ATOM 565 3HD2 LEU A 37 3.768 -6.573 -11.888 1.00 0.00 H
+ATOM 566 N GLN A 38 0.197 -10.269 -12.372 1.00 0.00 N
+ATOM 567 CA GLN A 38 -1.020 -10.898 -11.787 1.00 0.00 C
+ATOM 568 C GLN A 38 -0.595 -11.776 -10.605 1.00 0.00 C
+ATOM 569 O GLN A 38 -1.208 -11.647 -9.548 1.00 0.00 O
+ATOM 570 CB GLN A 38 -1.802 -11.700 -12.833 1.00 0.00 C
+ATOM 571 CG GLN A 38 -3.084 -12.345 -12.299 1.00 0.00 C
+ATOM 572 CD GLN A 38 -3.878 -13.081 -13.357 1.00 0.00 C
+ATOM 573 OE1 GLN A 38 -3.335 -13.570 -14.342 1.00 0.00 O
+ATOM 574 NE2 GLN A 38 -5.184 -13.177 -13.165 1.00 0.00 N
+ATOM 575 H GLN A 38 0.435 -10.459 -13.335 1.00 0.00 H
+ATOM 576 HA GLN A 38 -1.672 -10.108 -11.411 1.00 0.00 H
+ATOM 577 1HB GLN A 38 -2.075 -11.048 -13.664 1.00 0.00 H
+ATOM 578 2HB GLN A 38 -1.169 -12.492 -13.233 1.00 0.00 H
+ATOM 579 1HG GLN A 38 -2.820 -13.066 -11.523 1.00 0.00 H
+ATOM 580 2HG GLN A 38 -3.725 -11.567 -11.884 1.00 0.00 H
+ATOM 581 1HE2 GLN A 38 -5.755 -13.654 -13.834 1.00 0.00 H
+ATOM 582 2HE2 GLN A 38 -5.602 -12.776 -12.350 1.00 0.00 H
+ATOM 583 N ASP A 39 0.442 -12.601 -10.775 1.00 0.00 N
+ATOM 584 CA ASP A 39 0.933 -13.539 -9.727 1.00 0.00 C
+ATOM 585 C ASP A 39 1.345 -12.741 -8.487 1.00 0.00 C
+ATOM 586 O ASP A 39 0.841 -13.045 -7.390 1.00 0.00 O
+ATOM 587 CB ASP A 39 2.128 -14.383 -10.187 1.00 0.00 C
+ATOM 588 CG ASP A 39 1.802 -15.504 -11.161 1.00 0.00 C
+ATOM 589 OD1 ASP A 39 0.593 -15.830 -11.326 1.00 0.00 O
+ATOM 590 OD2 ASP A 39 2.773 -16.050 -11.743 1.00 0.00 O
+ATOM 591 H ASP A 39 0.907 -12.576 -11.671 1.00 0.00 H
+ATOM 592 HA ASP A 39 0.126 -14.229 -9.474 1.00 0.00 H
+ATOM 593 1HB ASP A 39 2.863 -13.738 -10.669 1.00 0.00 H
+ATOM 594 2HB ASP A 39 2.609 -14.837 -9.320 1.00 0.00 H
+ATOM 595 N VAL A 40 2.201 -11.742 -8.678 1.00 0.00 N
+ATOM 596 CA VAL A 40 2.793 -10.929 -7.578 1.00 0.00 C
+ATOM 597 C VAL A 40 1.715 -10.069 -6.896 1.00 0.00 C
+ATOM 598 O VAL A 40 1.747 -9.993 -5.650 1.00 0.00 O
+ATOM 599 CB VAL A 40 3.906 -10.012 -8.118 1.00 0.00 C
+ATOM 600 CG1 VAL A 40 4.377 -9.052 -7.036 1.00 0.00 C
+ATOM 601 CG2 VAL A 40 5.064 -10.853 -8.634 1.00 0.00 C
+ATOM 602 H VAL A 40 2.454 -11.534 -9.634 1.00 0.00 H
+ATOM 603 HA VAL A 40 3.176 -11.606 -6.815 1.00 0.00 H
+ATOM 604 HB VAL A 40 3.504 -9.408 -8.931 1.00 0.00 H
+ATOM 605 1HG1 VAL A 40 5.164 -8.412 -7.434 1.00 0.00 H
+ATOM 606 2HG1 VAL A 40 3.540 -8.436 -6.707 1.00 0.00 H
+ATOM 607 3HG1 VAL A 40 4.766 -9.620 -6.190 1.00 0.00 H
+ATOM 608 1HG2 VAL A 40 5.847 -10.198 -9.015 1.00 0.00 H
+ATOM 609 2HG2 VAL A 40 5.462 -11.462 -7.822 1.00 0.00 H
+ATOM 610 3HG2 VAL A 40 4.713 -11.502 -9.436 1.00 0.00 H
+ATOM 611 N VAL A 41 0.804 -9.431 -7.641 1.00 0.00 N
+ATOM 612 CA VAL A 41 -0.271 -8.602 -7.011 1.00 0.00 C
+ATOM 613 C VAL A 41 -1.140 -9.501 -6.126 1.00 0.00 C
+ATOM 614 O VAL A 41 -1.471 -9.065 -5.004 1.00 0.00 O
+ATOM 615 CB VAL A 41 -1.154 -7.924 -8.075 1.00 0.00 C
+ATOM 616 CG1 VAL A 41 -2.403 -7.338 -7.436 1.00 0.00 C
+ATOM 617 CG2 VAL A 41 -0.359 -6.845 -8.796 1.00 0.00 C
+ATOM 618 H VAL A 41 0.840 -9.509 -8.648 1.00 0.00 H
+ATOM 619 HA VAL A 41 0.198 -7.858 -6.366 1.00 0.00 H
+ATOM 620 HB VAL A 41 -1.482 -8.676 -8.794 1.00 0.00 H
+ATOM 621 1HG1 VAL A 41 -3.016 -6.863 -8.204 1.00 0.00 H
+ATOM 622 2HG1 VAL A 41 -2.976 -8.133 -6.959 1.00 0.00 H
+ATOM 623 3HG1 VAL A 41 -2.118 -6.596 -6.691 1.00 0.00 H
+ATOM 624 1HG2 VAL A 41 -0.989 -6.371 -9.547 1.00 0.00 H
+ATOM 625 2HG2 VAL A 41 -0.026 -6.098 -8.076 1.00 0.00 H
+ATOM 626 3HG2 VAL A 41 0.508 -7.295 -9.280 1.00 0.00 H
+ATOM 627 N ASN A 42 -1.477 -10.699 -6.615 1.00 0.00 N
+ATOM 628 CA ASN A 42 -2.319 -11.705 -5.910 1.00 0.00 C
+ATOM 629 C ASN A 42 -1.605 -12.171 -4.625 1.00 0.00 C
+ATOM 630 O ASN A 42 -2.277 -12.273 -3.584 1.00 0.00 O
+ATOM 631 CB ASN A 42 -2.728 -12.843 -6.858 1.00 0.00 C
+ATOM 632 CG ASN A 42 -3.820 -12.461 -7.848 1.00 0.00 C
+ATOM 633 OD1 ASN A 42 -4.518 -11.463 -7.681 1.00 0.00 O
+ATOM 634 ND2 ASN A 42 -3.986 -13.254 -8.895 1.00 0.00 N
+ATOM 635 H ASN A 42 -1.118 -10.916 -7.534 1.00 0.00 H
+ATOM 636 HA ASN A 42 -3.225 -11.210 -5.555 1.00 0.00 H
+ATOM 637 1HB ASN A 42 -1.858 -13.175 -7.425 1.00 0.00 H
+ATOM 638 2HB ASN A 42 -3.083 -13.693 -6.274 1.00 0.00 H
+ATOM 639 1HD2 ASN A 42 -4.691 -13.045 -9.573 1.00 0.00 H
+ATOM 640 2HD2 ASN A 42 -3.408 -14.062 -9.006 1.00 0.00 H
+ATOM 641 N GLN A 43 -0.295 -12.426 -4.675 1.00 0.00 N
+ATOM 642 CA GLN A 43 0.512 -12.854 -3.494 1.00 0.00 C
+ATOM 643 C GLN A 43 0.556 -11.739 -2.444 1.00 0.00 C
+ATOM 644 O GLN A 43 0.519 -12.057 -1.246 1.00 0.00 O
+ATOM 645 CB GLN A 43 1.976 -13.141 -3.849 1.00 0.00 C
+ATOM 646 CG GLN A 43 2.224 -14.420 -4.640 1.00 0.00 C
+ATOM 647 CD GLN A 43 3.698 -14.595 -4.928 1.00 0.00 C
+ATOM 648 OE1 GLN A 43 4.552 -14.111 -4.184 1.00 0.00 O
+ATOM 649 NE2 GLN A 43 4.020 -15.276 -6.020 1.00 0.00 N
+ATOM 650 H GLN A 43 0.162 -12.316 -5.570 1.00 0.00 H
+ATOM 651 HA GLN A 43 0.083 -13.775 -3.099 1.00 0.00 H
+ATOM 652 1HB GLN A 43 2.376 -12.315 -4.437 1.00 0.00 H
+ATOM 653 2HB GLN A 43 2.566 -13.206 -2.934 1.00 0.00 H
+ATOM 654 1HG GLN A 43 1.871 -15.271 -4.054 1.00 0.00 H
+ATOM 655 2HG GLN A 43 1.680 -14.364 -5.582 1.00 0.00 H
+ATOM 656 1HE2 GLN A 43 4.983 -15.420 -6.255 1.00 0.00 H
+ATOM 657 2HE2 GLN A 43 3.302 -15.649 -6.607 1.00 0.00 H
+ATOM 658 N ASN A 44 0.705 -10.489 -2.888 1.00 0.00 N
+ATOM 659 CA ASN A 44 0.752 -9.293 -2.006 1.00 0.00 C
+ATOM 660 C ASN A 44 -0.639 -9.060 -1.421 1.00 0.00 C
+ATOM 661 O ASN A 44 -0.715 -8.660 -0.239 1.00 0.00 O
+ATOM 662 CB ASN A 44 1.237 -8.064 -2.753 1.00 0.00 C
+ATOM 663 CG ASN A 44 2.707 -8.117 -3.059 1.00 0.00 C
+ATOM 664 OD1 ASN A 44 3.449 -8.914 -2.470 1.00 0.00 O
+ATOM 665 ND2 ASN A 44 3.145 -7.287 -3.971 1.00 0.00 N
+ATOM 666 H ASN A 44 0.787 -10.366 -3.887 1.00 0.00 H
+ATOM 667 HA ASN A 44 1.420 -9.505 -1.170 1.00 0.00 H
+ATOM 668 1HB ASN A 44 0.685 -7.965 -3.688 1.00 0.00 H
+ATOM 669 2HB ASN A 44 1.035 -7.173 -2.158 1.00 0.00 H
+ATOM 670 1HD2 ASN A 44 4.115 -7.278 -4.216 1.00 0.00 H
+ATOM 671 2HD2 ASN A 44 2.509 -6.660 -4.423 1.00 0.00 H
+ATOM 672 N ALA A 45 -1.690 -9.313 -2.206 1.00 0.00 N
+ATOM 673 CA ALA A 45 -3.087 -9.140 -1.758 1.00 0.00 C
+ATOM 674 C ALA A 45 -3.340 -10.121 -0.617 1.00 0.00 C
+ATOM 675 O ALA A 45 -4.021 -9.748 0.360 1.00 0.00 O
+ATOM 676 CB ALA A 45 -4.057 -9.337 -2.891 1.00 0.00 C
+ATOM 677 H ALA A 45 -1.510 -9.636 -3.146 1.00 0.00 H
+ATOM 678 HA ALA A 45 -3.199 -8.122 -1.383 1.00 0.00 H
+ATOM 679 1HB ALA A 45 -5.076 -9.201 -2.526 1.00 0.00 H
+ATOM 680 2HB ALA A 45 -3.854 -8.608 -3.675 1.00 0.00 H
+ATOM 681 3HB ALA A 45 -3.946 -10.343 -3.293 1.00 0.00 H
+ATOM 682 N GLN A 46 -2.776 -11.321 -0.721 1.00 0.00 N
+ATOM 683 CA GLN A 46 -2.928 -12.354 0.336 1.00 0.00 C
+ATOM 684 C GLN A 46 -2.041 -11.968 1.534 1.00 0.00 C
+ATOM 685 O GLN A 46 -2.530 -12.070 2.681 1.00 0.00 O
+ATOM 686 CB GLN A 46 -2.625 -13.749 -0.215 1.00 0.00 C
+ATOM 687 CG GLN A 46 -2.856 -14.852 0.814 1.00 0.00 C
+ATOM 688 CD GLN A 46 -2.347 -16.200 0.364 1.00 0.00 C
+ATOM 689 OE1 GLN A 46 -2.061 -17.079 1.176 1.00 0.00 O
+ATOM 690 NE2 GLN A 46 -2.225 -16.379 -0.943 1.00 0.00 N
+ATOM 691 H GLN A 46 -2.228 -11.534 -1.542 1.00 0.00 H
+ATOM 692 HA GLN A 46 -3.958 -12.340 0.689 1.00 0.00 H
+ATOM 693 1HB GLN A 46 -3.256 -13.941 -1.083 1.00 0.00 H
+ATOM 694 2HB GLN A 46 -1.588 -13.792 -0.549 1.00 0.00 H
+ATOM 695 1HG GLN A 46 -2.337 -14.588 1.736 1.00 0.00 H
+ATOM 696 2HG GLN A 46 -3.926 -14.942 1.001 1.00 0.00 H
+ATOM 697 1HE2 GLN A 46 -1.893 -17.252 -1.300 1.00 0.00 H
+ATOM 698 2HE2 GLN A 46 -2.465 -15.639 -1.573 1.00 0.00 H
+ATOM 699 N ALA A 47 -0.810 -11.503 1.283 1.00 0.00 N
+ATOM 700 CA ALA A 47 0.187 -11.160 2.325 1.00 0.00 C
+ATOM 701 C ALA A 47 -0.409 -10.109 3.268 1.00 0.00 C
+ATOM 702 O ALA A 47 -0.169 -10.212 4.477 1.00 0.00 O
+ATOM 703 CB ALA A 47 1.469 -10.673 1.694 1.00 0.00 C
+ATOM 704 H ALA A 47 -0.564 -11.387 0.309 1.00 0.00 H
+ATOM 705 HA ALA A 47 0.398 -12.061 2.902 1.00 0.00 H
+ATOM 706 1HB ALA A 47 2.188 -10.426 2.474 1.00 0.00 H
+ATOM 707 2HB ALA A 47 1.879 -11.456 1.056 1.00 0.00 H
+ATOM 708 3HB ALA A 47 1.265 -9.787 1.095 1.00 0.00 H
+ATOM 709 N LEU A 48 -1.170 -9.149 2.727 1.00 0.00 N
+ATOM 710 CA LEU A 48 -1.937 -8.142 3.511 1.00 0.00 C
+ATOM 711 C LEU A 48 -3.091 -8.835 4.248 1.00 0.00 C
+ATOM 712 O LEU A 48 -3.295 -8.508 5.433 1.00 0.00 O
+ATOM 713 CB LEU A 48 -2.489 -7.041 2.598 1.00 0.00 C
+ATOM 714 CG LEU A 48 -3.315 -5.952 3.294 1.00 0.00 C
+ATOM 715 CD1 LEU A 48 -2.456 -5.250 4.337 1.00 0.00 C
+ATOM 716 CD2 LEU A 48 -3.832 -4.965 2.258 1.00 0.00 C
+ATOM 717 H LEU A 48 -1.214 -9.125 1.719 1.00 0.00 H
+ATOM 718 HA LEU A 48 -1.273 -7.706 4.257 1.00 0.00 H
+ATOM 719 1HB LEU A 48 -1.654 -6.553 2.098 1.00 0.00 H
+ATOM 720 2HB LEU A 48 -3.121 -7.502 1.840 1.00 0.00 H
+ATOM 721 HG LEU A 48 -4.159 -6.410 3.811 1.00 0.00 H
+ATOM 722 1HD1 LEU A 48 -3.044 -4.476 4.832 1.00 0.00 H
+ATOM 723 2HD1 LEU A 48 -2.117 -5.975 5.077 1.00 0.00 H
+ATOM 724 3HD1 LEU A 48 -1.594 -4.795 3.851 1.00 0.00 H
+ATOM 725 1HD2 LEU A 48 -4.420 -4.192 2.752 1.00 0.00 H
+ATOM 726 2HD2 LEU A 48 -2.989 -4.506 1.741 1.00 0.00 H
+ATOM 727 3HD2 LEU A 48 -4.458 -5.490 1.535 1.00 0.00 H
+ATOM 728 N ASN A 49 -1.433 -10.045 -64.270 1.00 0.00 N
+ATOM 729 CA ASN A 49 -2.277 -11.289 -64.323 1.00 0.00 C
+ATOM 730 C ASN A 49 -2.332 -11.896 -62.909 1.00 0.00 C
+ATOM 731 O ASN A 49 -3.310 -11.612 -62.177 1.00 0.00 O
+ATOM 732 CB ASN A 49 -1.833 -12.257 -65.442 1.00 0.00 C
+ATOM 733 CG ASN A 49 -0.352 -12.592 -65.488 1.00 0.00 C
+ATOM 734 OD1 ASN A 49 0.493 -11.816 -65.045 1.00 0.00 O
+ATOM 735 ND2 ASN A 49 -0.019 -13.735 -66.067 1.00 0.00 N
+ATOM 736 H ASN A 49 -1.117 -9.627 -65.133 1.00 0.00 H
+ATOM 737 HA ASN A 49 -3.308 -10.998 -64.528 1.00 0.00 H
+ATOM 738 1HB ASN A 49 -2.370 -13.201 -65.340 1.00 0.00 H
+ATOM 739 2HB ASN A 49 -2.095 -11.836 -66.413 1.00 0.00 H
+ATOM 740 1HD2 ASN A 49 0.943 -14.005 -66.125 1.00 0.00 H
+ATOM 741 2HD2 ASN A 49 -0.728 -14.328 -66.446 1.00 0.00 H
+ATOM 742 N VAL A 50 -1.321 -12.687 -62.540 1.00 0.00 N
+ATOM 743 CA VAL A 50 -1.169 -13.332 -61.201 1.00 0.00 C
+ATOM 744 C VAL A 50 -0.885 -12.226 -60.178 1.00 0.00 C
+ATOM 745 O VAL A 50 -1.220 -12.418 -58.997 1.00 0.00 O
+ATOM 746 CB VAL A 50 -0.021 -14.359 -61.192 1.00 0.00 C
+ATOM 747 CG1 VAL A 50 0.263 -14.830 -59.774 1.00 0.00 C
+ATOM 748 CG2 VAL A 50 -0.371 -15.535 -62.091 1.00 0.00 C
+ATOM 749 H VAL A 50 -0.614 -12.846 -63.244 1.00 0.00 H
+ATOM 750 HA VAL A 50 -2.121 -13.787 -60.925 1.00 0.00 H
+ATOM 751 HB VAL A 50 0.887 -13.878 -61.559 1.00 0.00 H
+ATOM 752 1HG1 VAL A 50 1.077 -15.555 -59.786 1.00 0.00 H
+ATOM 753 2HG1 VAL A 50 0.546 -13.977 -59.157 1.00 0.00 H
+ATOM 754 3HG1 VAL A 50 -0.631 -15.298 -59.361 1.00 0.00 H
+ATOM 755 1HG2 VAL A 50 0.446 -16.256 -62.082 1.00 0.00 H
+ATOM 756 2HG2 VAL A 50 -1.281 -16.011 -61.728 1.00 0.00 H
+ATOM 757 3HG2 VAL A 50 -0.529 -15.180 -63.110 1.00 0.00 H
+ATOM 758 N LEU A 51 -0.330 -11.098 -60.635 1.00 0.00 N
+ATOM 759 CA LEU A 51 0.029 -9.922 -59.799 1.00 0.00 C
+ATOM 760 C LEU A 51 -1.212 -9.377 -59.079 1.00 0.00 C
+ATOM 761 O LEU A 51 -1.093 -8.979 -57.903 1.00 0.00 O
+ATOM 762 CB LEU A 51 0.654 -8.816 -60.659 1.00 0.00 C
+ATOM 763 CG LEU A 51 2.046 -9.120 -61.227 1.00 0.00 C
+ATOM 764 CD1 LEU A 51 2.428 -8.050 -62.240 1.00 0.00 C
+ATOM 765 CD2 LEU A 51 3.055 -9.183 -60.090 1.00 0.00 C
+ATOM 766 H LEU A 51 -0.151 -11.068 -61.630 1.00 0.00 H
+ATOM 767 HA LEU A 51 0.755 -10.238 -59.051 1.00 0.00 H
+ATOM 768 1HB LEU A 51 -0.008 -8.612 -61.499 1.00 0.00 H
+ATOM 769 2HB LEU A 51 0.732 -7.909 -60.058 1.00 0.00 H
+ATOM 770 HG LEU A 51 2.025 -10.078 -61.746 1.00 0.00 H
+ATOM 771 1HD1 LEU A 51 3.418 -8.267 -62.642 1.00 0.00 H
+ATOM 772 2HD1 LEU A 51 1.701 -8.040 -63.051 1.00 0.00 H
+ATOM 773 3HD1 LEU A 51 2.441 -7.076 -61.751 1.00 0.00 H
+ATOM 774 1HD2 LEU A 51 4.046 -9.401 -60.493 1.00 0.00 H
+ATOM 775 2HD2 LEU A 51 3.078 -8.225 -59.570 1.00 0.00 H
+ATOM 776 3HD2 LEU A 51 2.768 -9.968 -59.390 1.00 0.00 H
+ATOM 777 N TYR A 52 -2.362 -9.359 -59.756 1.00 0.00 N
+ATOM 778 CA TYR A 52 -3.645 -8.900 -59.170 1.00 0.00 C
+ATOM 779 C TYR A 52 -4.042 -9.860 -58.040 1.00 0.00 C
+ATOM 780 O TYR A 52 -4.411 -9.378 -56.955 1.00 0.00 O
+ATOM 781 CB TYR A 52 -4.728 -8.763 -60.243 1.00 0.00 C
+ATOM 782 CG TYR A 52 -6.062 -8.305 -59.704 1.00 0.00 C
+ATOM 783 CD1 TYR A 52 -6.249 -6.998 -59.279 1.00 0.00 C
+ATOM 784 CD2 TYR A 52 -7.134 -9.178 -59.596 1.00 0.00 C
+ATOM 785 CE1 TYR A 52 -7.463 -6.566 -58.770 1.00 0.00 C
+ATOM 786 CE2 TYR A 52 -8.358 -8.761 -59.090 1.00 0.00 C
+ATOM 787 CZ TYR A 52 -8.524 -7.449 -58.676 1.00 0.00 C
+ATOM 788 OH TYR A 52 -9.715 -7.013 -58.171 1.00 0.00 O
+ATOM 789 H TYR A 52 -2.344 -9.675 -60.715 1.00 0.00 H
+ATOM 790 HA TYR A 52 -3.488 -7.921 -58.717 1.00 0.00 H
+ATOM 791 1HB TYR A 52 -4.403 -8.048 -61.000 1.00 0.00 H
+ATOM 792 2HB TYR A 52 -4.872 -9.722 -60.738 1.00 0.00 H
+ATOM 793 HD1 TYR A 52 -5.428 -6.282 -59.339 1.00 0.00 H
+ATOM 794 HD2 TYR A 52 -7.027 -10.216 -59.912 1.00 0.00 H
+ATOM 795 HE1 TYR A 52 -7.581 -5.533 -58.444 1.00 0.00 H
+ATOM 796 HE2 TYR A 52 -9.186 -9.466 -59.016 1.00 0.00 H
+ATOM 797 HH TYR A 52 -10.379 -7.699 -58.280 1.00 0.00 H
+ATOM 798 N GLU A 53 -3.941 -11.170 -58.267 1.00 0.00 N
+ATOM 799 CA GLU A 53 -4.306 -12.199 -57.255 1.00 0.00 C
+ATOM 800 C GLU A 53 -3.380 -12.060 -56.037 1.00 0.00 C
+ATOM 801 O GLU A 53 -3.875 -12.195 -54.906 1.00 0.00 O
+ATOM 802 CB GLU A 53 -4.261 -13.602 -57.865 1.00 0.00 C
+ATOM 803 CG GLU A 53 -5.306 -13.838 -58.944 1.00 0.00 C
+ATOM 804 CD GLU A 53 -6.731 -13.985 -58.437 1.00 0.00 C
+ATOM 805 OE1 GLU A 53 -7.198 -13.075 -57.713 1.00 0.00 O
+ATOM 806 OE2 GLU A 53 -7.379 -15.009 -58.768 1.00 0.00 O
+ATOM 807 H GLU A 53 -3.603 -11.469 -59.171 1.00 0.00 H
+ATOM 808 HA GLU A 53 -5.322 -12.003 -56.912 1.00 0.00 H
+ATOM 809 1HB GLU A 53 -3.278 -13.777 -58.301 1.00 0.00 H
+ATOM 810 2HB GLU A 53 -4.409 -14.344 -57.081 1.00 0.00 H
+ATOM 811 1HG GLU A 53 -5.286 -13.003 -59.644 1.00 0.00 H
+ATOM 812 2HG GLU A 53 -5.047 -14.743 -59.493 1.00 0.00 H
+ATOM 813 N ASN A 54 -2.098 -11.762 -56.256 1.00 0.00 N
+ATOM 814 CA ASN A 54 -1.093 -11.564 -55.178 1.00 0.00 C
+ATOM 815 C ASN A 54 -1.480 -10.356 -54.329 1.00 0.00 C
+ATOM 816 O ASN A 54 -1.360 -10.458 -53.097 1.00 0.00 O
+ATOM 817 CB ASN A 54 0.304 -11.392 -55.746 1.00 0.00 C
+ATOM 818 CG ASN A 54 0.880 -12.682 -56.261 1.00 0.00 C
+ATOM 819 OD1 ASN A 54 0.363 -13.767 -55.972 1.00 0.00 O
+ATOM 820 ND2 ASN A 54 1.943 -12.585 -57.018 1.00 0.00 N
+ATOM 821 H ASN A 54 -1.811 -11.667 -57.220 1.00 0.00 H
+ATOM 822 HA ASN A 54 -1.105 -12.442 -54.528 1.00 0.00 H
+ATOM 823 1HB ASN A 54 0.278 -10.668 -56.562 1.00 0.00 H
+ATOM 824 2HB ASN A 54 0.964 -10.994 -54.975 1.00 0.00 H
+ATOM 825 1HD2 ASN A 54 2.371 -13.410 -57.388 1.00 0.00 H
+ATOM 826 2HD2 ASN A 54 2.329 -11.687 -57.227 1.00 0.00 H
+ATOM 827 N GLN A 55 -1.923 -9.264 -54.960 1.00 0.00 N
+ATOM 828 CA GLN A 55 -2.352 -8.020 -54.257 1.00 0.00 C
+ATOM 829 C GLN A 55 -3.580 -8.312 -53.381 1.00 0.00 C
+ATOM 830 O GLN A 55 -3.622 -7.763 -52.270 1.00 0.00 O
+ATOM 831 CB GLN A 55 -2.670 -6.882 -55.230 1.00 0.00 C
+ATOM 832 CG GLN A 55 -1.441 -6.276 -55.891 1.00 0.00 C
+ATOM 833 CD GLN A 55 -1.779 -5.074 -56.739 1.00 0.00 C
+ATOM 834 OE1 GLN A 55 -2.939 -4.795 -57.038 1.00 0.00 O
+ATOM 835 NE2 GLN A 55 -0.752 -4.349 -57.138 1.00 0.00 N
+ATOM 836 H GLN A 55 -1.965 -9.298 -55.968 1.00 0.00 H
+ATOM 837 HA GLN A 55 -1.538 -7.688 -53.613 1.00 0.00 H
+ATOM 838 1HB GLN A 55 -3.332 -7.250 -56.015 1.00 0.00 H
+ATOM 839 2HB GLN A 55 -3.198 -6.088 -54.703 1.00 0.00 H
+ATOM 840 1HG GLN A 55 -0.742 -5.963 -55.117 1.00 0.00 H
+ATOM 841 2HG GLN A 55 -0.978 -7.028 -56.532 1.00 0.00 H
+ATOM 842 1HE2 GLN A 55 -0.902 -3.537 -57.703 1.00 0.00 H
+ATOM 843 2HE2 GLN A 55 0.176 -4.609 -56.873 1.00 0.00 H
+ATOM 844 N LYS A 56 -4.541 -9.111 -53.873 1.00 0.00 N
+ATOM 845 CA LYS A 56 -5.785 -9.473 -53.133 1.00 0.00 C
+ATOM 846 C LYS A 56 -5.391 -10.304 -51.909 1.00 0.00 C
+ATOM 847 O LYS A 56 -5.997 -10.082 -50.835 1.00 0.00 O
+ATOM 848 CB LYS A 56 -6.772 -10.307 -53.961 1.00 0.00 C
+ATOM 849 CG LYS A 56 -7.401 -9.651 -55.186 1.00 0.00 C
+ATOM 850 CD LYS A 56 -8.142 -8.360 -54.936 1.00 0.00 C
+ATOM 851 CE LYS A 56 -9.412 -8.528 -54.129 1.00 0.00 C
+ATOM 852 NZ LYS A 56 -10.145 -7.242 -54.006 1.00 0.00 N
+ATOM 853 H LYS A 56 -4.396 -9.480 -54.802 1.00 0.00 H
+ATOM 854 HA LYS A 56 -6.299 -8.554 -52.850 1.00 0.00 H
+ATOM 855 1HB LYS A 56 -6.275 -11.208 -54.322 1.00 0.00 H
+ATOM 856 2HB LYS A 56 -7.602 -10.622 -53.328 1.00 0.00 H
+ATOM 857 1HG LYS A 56 -6.622 -9.427 -55.918 1.00 0.00 H
+ATOM 858 2HG LYS A 56 -8.114 -10.338 -55.640 1.00 0.00 H
+ATOM 859 1HD LYS A 56 -7.496 -7.667 -54.394 1.00 0.00 H
+ATOM 860 2HD LYS A 56 -8.415 -7.905 -55.887 1.00 0.00 H
+ATOM 861 1HE LYS A 56 -10.055 -9.261 -54.612 1.00 0.00 H
+ATOM 862 2HE LYS A 56 -9.164 -8.895 -53.133 1.00 0.00 H
+ATOM 863 1HZ LYS A 56 -10.985 -7.384 -53.464 1.00 0.00 H
+ATOM 864 2HZ LYS A 56 -9.558 -6.562 -53.544 1.00 0.00 H
+ATOM 865 3HZ LYS A 56 -10.391 -6.906 -54.925 1.00 0.00 H
+ATOM 866 N LEU A 57 -4.426 -11.222 -52.081 1.00 0.00 N
+ATOM 867 CA LEU A 57 -3.870 -12.095 -51.007 1.00 0.00 C
+ATOM 868 C LEU A 57 -3.193 -11.228 -49.938 1.00 0.00 C
+ATOM 869 O LEU A 57 -3.520 -11.396 -48.758 1.00 0.00 O
+ATOM 870 CB LEU A 57 -2.859 -13.095 -51.581 1.00 0.00 C
+ATOM 871 CG LEU A 57 -2.140 -13.978 -50.553 1.00 0.00 C
+ATOM 872 CD1 LEU A 57 -3.161 -14.841 -49.823 1.00 0.00 C
+ATOM 873 CD2 LEU A 57 -1.102 -14.838 -51.259 1.00 0.00 C
+ATOM 874 H LEU A 57 -4.065 -11.306 -53.020 1.00 0.00 H
+ATOM 875 HA LEU A 57 -4.690 -12.645 -50.548 1.00 0.00 H
+ATOM 876 1HB LEU A 57 -3.377 -13.752 -52.277 1.00 0.00 H
+ATOM 877 2HB LEU A 57 -2.098 -12.543 -52.132 1.00 0.00 H
+ATOM 878 HG LEU A 57 -1.646 -13.348 -49.813 1.00 0.00 H
+ATOM 879 1HD1 LEU A 57 -2.650 -15.469 -49.092 1.00 0.00 H
+ATOM 880 2HD1 LEU A 57 -3.878 -14.201 -49.311 1.00 0.00 H
+ATOM 881 3HD1 LEU A 57 -3.683 -15.472 -50.541 1.00 0.00 H
+ATOM 882 1HD2 LEU A 57 -0.592 -15.466 -50.529 1.00 0.00 H
+ATOM 883 2HD2 LEU A 57 -1.596 -15.470 -51.999 1.00 0.00 H
+ATOM 884 3HD2 LEU A 57 -0.376 -14.196 -51.758 1.00 0.00 H
+ATOM 885 N ILE A 58 -2.304 -10.319 -50.350 1.00 0.00 N
+ATOM 886 CA ILE A 58 -1.533 -9.398 -49.451 1.00 0.00 C
+ATOM 887 C ILE A 58 -2.507 -8.495 -48.659 1.00 0.00 C
+ATOM 888 O ILE A 58 -2.353 -8.352 -47.424 1.00 0.00 O
+ATOM 889 CB ILE A 58 -0.553 -8.520 -50.250 1.00 0.00 C
+ATOM 890 CG1 ILE A 58 0.585 -9.372 -50.818 1.00 0.00 C
+ATOM 891 CG2 ILE A 58 -0.002 -7.406 -49.374 1.00 0.00 C
+ATOM 892 CD1 ILE A 58 1.405 -8.670 -51.876 1.00 0.00 C
+ATOM 893 H ILE A 58 -2.159 -10.269 -51.347 1.00 0.00 H
+ATOM 894 HA ILE A 58 -0.990 -9.999 -48.723 1.00 0.00 H
+ATOM 895 HB ILE A 58 -1.070 -8.078 -51.102 1.00 0.00 H
+ATOM 896 1HG1 ILE A 58 1.253 -9.672 -50.011 1.00 0.00 H
+ATOM 897 2HG1 ILE A 58 0.175 -10.283 -51.256 1.00 0.00 H
+ATOM 898 1HG2 ILE A 58 0.690 -6.796 -49.955 1.00 0.00 H
+ATOM 899 2HG2 ILE A 58 -0.822 -6.784 -49.018 1.00 0.00 H
+ATOM 900 3HG2 ILE A 58 0.523 -7.839 -48.522 1.00 0.00 H
+ATOM 901 1HD1 ILE A 58 2.192 -9.337 -52.231 1.00 0.00 H
+ATOM 902 2HD1 ILE A 58 0.761 -8.392 -52.711 1.00 0.00 H
+ATOM 903 3HD1 ILE A 58 1.855 -7.774 -51.452 1.00 0.00 H
+ATOM 904 N ALA A 59 -3.486 -7.906 -49.337 1.00 0.00 N
+ATOM 905 CA ALA A 59 -4.489 -7.007 -48.734 1.00 0.00 C
+ATOM 906 C ALA A 59 -5.322 -7.779 -47.715 1.00 0.00 C
+ATOM 907 O ALA A 59 -5.626 -7.202 -46.651 1.00 0.00 O
+ATOM 908 CB ALA A 59 -5.370 -6.421 -49.807 1.00 0.00 C
+ATOM 909 H ALA A 59 -3.529 -8.098 -50.328 1.00 0.00 H
+ATOM 910 HA ALA A 59 -3.961 -6.200 -48.228 1.00 0.00 H
+ATOM 911 1HB ALA A 59 -6.107 -5.760 -49.351 1.00 0.00 H
+ATOM 912 2HB ALA A 59 -4.759 -5.856 -50.509 1.00 0.00 H
+ATOM 913 3HB ALA A 59 -5.881 -7.225 -50.335 1.00 0.00 H
+ATOM 914 N ASN A 60 -5.695 -9.023 -48.046 1.00 0.00 N
+ATOM 915 CA ASN A 60 -6.579 -9.867 -47.200 1.00 0.00 C
+ATOM 916 C ASN A 60 -5.807 -10.250 -45.943 1.00 0.00 C
+ATOM 917 O ASN A 60 -6.371 -10.062 -44.849 1.00 0.00 O
+ATOM 918 CB ASN A 60 -7.116 -11.095 -47.941 1.00 0.00 C
+ATOM 919 CG ASN A 60 -8.212 -10.765 -48.934 1.00 0.00 C
+ATOM 920 OD1 ASN A 60 -8.837 -9.706 -48.858 1.00 0.00 O
+ATOM 921 ND2 ASN A 60 -8.456 -11.670 -49.872 1.00 0.00 N
+ATOM 922 H ASN A 60 -5.349 -9.393 -48.919 1.00 0.00 H
+ATOM 923 HA ASN A 60 -7.437 -9.267 -46.894 1.00 0.00 H
+ATOM 924 1HB ASN A 60 -6.301 -11.583 -48.476 1.00 0.00 H
+ATOM 925 2HB ASN A 60 -7.511 -11.810 -47.219 1.00 0.00 H
+ATOM 926 1HD2 ASN A 60 -9.169 -11.503 -50.555 1.00 0.00 H
+ATOM 927 2HD2 ASN A 60 -7.929 -12.518 -49.897 1.00 0.00 H
+ATOM 928 N GLN A 61 -4.563 -10.714 -46.111 1.00 0.00 N
+ATOM 929 CA GLN A 61 -3.676 -11.173 -45.009 1.00 0.00 C
+ATOM 930 C GLN A 61 -3.318 -9.965 -44.136 1.00 0.00 C
+ATOM 931 O GLN A 61 -3.232 -10.139 -42.898 1.00 0.00 O
+ATOM 932 CB GLN A 61 -2.409 -11.847 -45.554 1.00 0.00 C
+ATOM 933 CG GLN A 61 -2.636 -13.160 -46.300 1.00 0.00 C
+ATOM 934 CD GLN A 61 -3.232 -14.224 -45.418 1.00 0.00 C
+ATOM 935 OE1 GLN A 61 -4.429 -14.493 -45.479 1.00 0.00 O
+ATOM 936 NE2 GLN A 61 -2.401 -14.824 -44.580 1.00 0.00 N
+ATOM 937 H GLN A 61 -4.224 -10.747 -47.063 1.00 0.00 H
+ATOM 938 HA GLN A 61 -4.218 -11.902 -44.409 1.00 0.00 H
+ATOM 939 1HB GLN A 61 -1.900 -11.167 -46.237 1.00 0.00 H
+ATOM 940 2HB GLN A 61 -1.726 -12.057 -44.730 1.00 0.00 H
+ATOM 941 1HG GLN A 61 -3.321 -12.978 -47.130 1.00 0.00 H
+ATOM 942 2HG GLN A 61 -1.679 -13.521 -46.677 1.00 0.00 H
+ATOM 943 1HE2 GLN A 61 -2.738 -15.540 -43.968 1.00 0.00 H
+ATOM 944 2HE2 GLN A 61 -1.437 -14.562 -44.559 1.00 0.00 H
+ATOM 945 N PHE A 62 -3.133 -8.794 -44.756 1.00 0.00 N
+ATOM 946 CA PHE A 62 -2.824 -7.518 -44.065 1.00 0.00 C
+ATOM 947 C PHE A 62 -4.015 -7.072 -43.206 1.00 0.00 C
+ATOM 948 O PHE A 62 -3.791 -6.727 -42.032 1.00 0.00 O
+ATOM 949 CB PHE A 62 -2.468 -6.423 -45.067 1.00 0.00 C
+ATOM 950 CG PHE A 62 -2.193 -5.091 -44.423 1.00 0.00 C
+ATOM 951 CD1 PHE A 62 -1.114 -4.938 -43.572 1.00 0.00 C
+ATOM 952 CD2 PHE A 62 -3.022 -4.003 -44.641 1.00 0.00 C
+ATOM 953 CE1 PHE A 62 -0.858 -3.725 -42.959 1.00 0.00 C
+ATOM 954 CE2 PHE A 62 -2.758 -2.781 -44.039 1.00 0.00 C
+ATOM 955 CZ PHE A 62 -1.674 -2.645 -43.202 1.00 0.00 C
+ATOM 956 H PHE A 62 -3.214 -8.799 -45.763 1.00 0.00 H
+ATOM 957 HA PHE A 62 -1.964 -7.677 -43.410 1.00 0.00 H
+ATOM 958 1HB PHE A 62 -1.585 -6.720 -45.633 1.00 0.00 H
+ATOM 959 2HB PHE A 62 -3.285 -6.300 -45.777 1.00 0.00 H
+ATOM 960 HD1 PHE A 62 -0.458 -5.791 -43.386 1.00 0.00 H
+ATOM 961 HD2 PHE A 62 -3.881 -4.110 -45.304 1.00 0.00 H
+ATOM 962 HE1 PHE A 62 -0.008 -3.624 -42.284 1.00 0.00 H
+ATOM 963 HE2 PHE A 62 -3.411 -1.930 -44.228 1.00 0.00 H
+ATOM 964 HZ PHE A 62 -1.464 -1.686 -42.731 1.00 0.00 H
+ATOM 965 N ASN A 63 -5.228 -7.047 -43.770 1.00 0.00 N
+ATOM 966 CA ASN A 63 -6.455 -6.616 -43.047 1.00 0.00 C
+ATOM 967 C ASN A 63 -6.722 -7.607 -41.915 1.00 0.00 C
+ATOM 968 O ASN A 63 -7.158 -7.173 -40.841 1.00 0.00 O
+ATOM 969 CB ASN A 63 -7.651 -6.517 -43.974 1.00 0.00 C
+ATOM 970 CG ASN A 63 -7.557 -5.348 -44.916 1.00 0.00 C
+ATOM 971 OD1 ASN A 63 -6.875 -4.358 -44.629 1.00 0.00 O
+ATOM 972 ND2 ASN A 63 -8.229 -5.444 -46.035 1.00 0.00 N
+ATOM 973 H ASN A 63 -5.303 -7.336 -44.736 1.00 0.00 H
+ATOM 974 HA ASN A 63 -6.265 -5.639 -42.595 1.00 0.00 H
+ATOM 975 1HB ASN A 63 -7.736 -7.434 -44.559 1.00 0.00 H
+ATOM 976 2HB ASN A 63 -8.563 -6.420 -43.384 1.00 0.00 H
+ATOM 977 1HD2 ASN A 63 -8.203 -4.697 -46.700 1.00 0.00 H
+ATOM 978 2HD2 ASN A 63 -8.768 -6.265 -46.226 1.00 0.00 H
+ATOM 979 N SER A 64 -6.469 -8.891 -42.166 1.00 0.00 N
+ATOM 980 CA SER A 64 -6.649 -10.000 -41.192 1.00 0.00 C
+ATOM 981 C SER A 64 -5.696 -9.777 -40.008 1.00 0.00 C
+ATOM 982 O SER A 64 -6.146 -9.845 -38.850 1.00 0.00 O
+ATOM 983 CB SER A 64 -6.375 -11.342 -41.840 1.00 0.00 C
+ATOM 984 OG SER A 64 -6.522 -12.385 -40.917 1.00 0.00 O
+ATOM 985 H SER A 64 -6.131 -9.101 -43.094 1.00 0.00 H
+ATOM 986 HA SER A 64 -7.668 -9.956 -40.804 1.00 0.00 H
+ATOM 987 1HB SER A 64 -7.061 -11.491 -42.673 1.00 0.00 H
+ATOM 988 2HB SER A 64 -5.363 -11.351 -42.245 1.00 0.00 H
+ATOM 989 HG SER A 64 -6.428 -13.199 -41.418 1.00 0.00 H
+ATOM 990 N ALA A 65 -4.433 -9.464 -40.289 1.00 0.00 N
+ATOM 991 CA ALA A 65 -3.384 -9.219 -39.270 1.00 0.00 C
+ATOM 992 C ALA A 65 -3.791 -8.070 -38.350 1.00 0.00 C
+ATOM 993 O ALA A 65 -3.644 -8.198 -37.129 1.00 0.00 O
+ATOM 994 CB ALA A 65 -2.066 -8.909 -39.928 1.00 0.00 C
+ATOM 995 H ALA A 65 -4.194 -9.395 -41.268 1.00 0.00 H
+ATOM 996 HA ALA A 65 -3.275 -10.123 -38.672 1.00 0.00 H
+ATOM 997 1HB ALA A 65 -1.310 -8.731 -39.162 1.00 0.00 H
+ATOM 998 2HB ALA A 65 -1.763 -9.753 -40.548 1.00 0.00 H
+ATOM 999 3HB ALA A 65 -2.169 -8.021 -40.549 1.00 0.00 H
+ATOM 1000 N ILE A 66 -4.266 -6.973 -38.930 1.00 0.00 N
+ATOM 1001 CA ILE A 66 -4.685 -5.772 -38.159 1.00 0.00 C
+ATOM 1002 C ILE A 66 -5.854 -6.162 -37.255 1.00 0.00 C
+ATOM 1003 O ILE A 66 -5.822 -5.809 -36.079 1.00 0.00 O
+ATOM 1004 CB ILE A 66 -5.102 -4.611 -39.081 1.00 0.00 C
+ATOM 1005 CG1 ILE A 66 -3.878 -4.022 -39.786 1.00 0.00 C
+ATOM 1006 CG2 ILE A 66 -5.831 -3.537 -38.287 1.00 0.00 C
+ATOM 1007 CD1 ILE A 66 -4.219 -3.047 -40.890 1.00 0.00 C
+ATOM 1008 H ILE A 66 -4.339 -6.961 -39.939 1.00 0.00 H
+ATOM 1009 HA ILE A 66 -3.858 -5.464 -37.522 1.00 0.00 H
+ATOM 1010 HB ILE A 66 -5.765 -4.986 -39.860 1.00 0.00 H
+ATOM 1011 1HG1 ILE A 66 -3.251 -3.508 -39.059 1.00 0.00 H
+ATOM 1012 2HG1 ILE A 66 -3.283 -4.828 -40.217 1.00 0.00 H
+ATOM 1013 1HG2 ILE A 66 -6.118 -2.724 -38.954 1.00 0.00 H
+ATOM 1014 2HG2 ILE A 66 -6.723 -3.965 -37.832 1.00 0.00 H
+ATOM 1015 3HG2 ILE A 66 -5.173 -3.152 -37.508 1.00 0.00 H
+ATOM 1016 1HD1 ILE A 66 -3.300 -2.674 -41.343 1.00 0.00 H
+ATOM 1017 2HD1 ILE A 66 -4.818 -3.553 -41.649 1.00 0.00 H
+ATOM 1018 3HD1 ILE A 66 -4.784 -2.214 -40.477 1.00 0.00 H
+ATOM 1019 N GLY A 67 -6.843 -6.865 -37.794 1.00 0.00 N
+ATOM 1020 CA GLY A 67 -8.026 -7.325 -37.043 1.00 0.00 C
+ATOM 1021 C GLY A 67 -7.623 -7.998 -35.748 1.00 0.00 C
+ATOM 1022 O GLY A 67 -8.133 -7.604 -34.687 1.00 0.00 O
+ATOM 1023 H GLY A 67 -6.766 -7.088 -38.777 1.00 0.00 H
+ATOM 1024 1HA GLY A 67 -8.676 -6.476 -36.830 1.00 0.00 H
+ATOM 1025 2HA GLY A 67 -8.598 -8.021 -37.655 1.00 0.00 H
+ATOM 1026 N LYS A 68 -6.729 -8.985 -35.841 1.00 0.00 N
+ATOM 1027 CA LYS A 68 -6.217 -9.782 -34.698 1.00 0.00 C
+ATOM 1028 C LYS A 68 -5.438 -8.864 -33.750 1.00 0.00 C
+ATOM 1029 O LYS A 68 -5.567 -9.030 -32.520 1.00 0.00 O
+ATOM 1030 CB LYS A 68 -5.334 -10.919 -35.219 1.00 0.00 C
+ATOM 1031 CG LYS A 68 -6.082 -12.004 -35.976 1.00 0.00 C
+ATOM 1032 CD LYS A 68 -5.204 -13.083 -36.553 1.00 0.00 C
+ATOM 1033 CE LYS A 68 -6.020 -14.066 -37.359 1.00 0.00 C
+ATOM 1034 NZ LYS A 68 -5.174 -15.116 -37.972 1.00 0.00 N
+ATOM 1035 H LYS A 68 -6.391 -9.186 -36.772 1.00 0.00 H
+ATOM 1036 HA LYS A 68 -7.067 -10.208 -34.165 1.00 0.00 H
+ATOM 1037 1HB LYS A 68 -4.572 -10.513 -35.885 1.00 0.00 H
+ATOM 1038 2HB LYS A 68 -4.818 -11.391 -34.382 1.00 0.00 H
+ATOM 1039 1HG LYS A 68 -6.794 -12.490 -35.308 1.00 0.00 H
+ATOM 1040 2HG LYS A 68 -6.632 -11.557 -36.804 1.00 0.00 H
+ATOM 1041 1HD LYS A 68 -4.447 -12.631 -37.197 1.00 0.00 H
+ATOM 1042 2HD LYS A 68 -4.699 -13.612 -35.746 1.00 0.00 H
+ATOM 1043 1HE LYS A 68 -6.757 -14.542 -36.714 1.00 0.00 H
+ATOM 1044 2HE LYS A 68 -6.551 -13.537 -38.150 1.00 0.00 H
+ATOM 1045 1HZ LYS A 68 -5.754 -15.751 -38.501 1.00 0.00 H
+ATOM 1046 2HZ LYS A 68 -4.498 -14.686 -38.589 1.00 0.00 H
+ATOM 1047 3HZ LYS A 68 -4.691 -15.626 -37.246 1.00 0.00 H
+ATOM 1048 N ILE A 69 -4.648 -7.938 -34.295 1.00 0.00 N
+ATOM 1049 CA ILE A 69 -3.837 -6.978 -33.487 1.00 0.00 C
+ATOM 1050 C ILE A 69 -4.777 -6.044 -32.718 1.00 0.00 C
+ATOM 1051 O ILE A 69 -4.509 -5.776 -31.544 1.00 0.00 O
+ATOM 1052 CB ILE A 69 -2.889 -6.146 -34.369 1.00 0.00 C
+ATOM 1053 CG1 ILE A 69 -1.785 -7.033 -34.951 1.00 0.00 C
+ATOM 1054 CG2 ILE A 69 -2.289 -5.000 -33.570 1.00 0.00 C
+ATOM 1055 CD1 ILE A 69 -1.030 -6.396 -36.095 1.00 0.00 C
+ATOM 1056 H ILE A 69 -4.603 -7.893 -35.302 1.00 0.00 H
+ATOM 1057 HA ILE A 69 -3.265 -7.543 -32.750 1.00 0.00 H
+ATOM 1058 HB ILE A 69 -3.443 -5.737 -35.213 1.00 0.00 H
+ATOM 1059 1HG1 ILE A 69 -1.070 -7.285 -34.167 1.00 0.00 H
+ATOM 1060 2HG1 ILE A 69 -2.220 -7.967 -35.309 1.00 0.00 H
+ATOM 1061 1HG2 ILE A 69 -1.620 -4.422 -34.208 1.00 0.00 H
+ATOM 1062 2HG2 ILE A 69 -3.088 -4.356 -33.203 1.00 0.00 H
+ATOM 1063 3HG2 ILE A 69 -1.727 -5.399 -32.725 1.00 0.00 H
+ATOM 1064 1HD1 ILE A 69 -0.264 -7.084 -36.454 1.00 0.00 H
+ATOM 1065 2HD1 ILE A 69 -1.721 -6.167 -36.905 1.00 0.00 H
+ATOM 1066 3HD1 ILE A 69 -0.556 -5.477 -35.750 1.00 0.00 H
+ATOM 1067 N GLN A 70 -5.839 -5.560 -33.360 1.00 0.00 N
+ATOM 1068 CA GLN A 70 -6.804 -4.627 -32.728 1.00 0.00 C
+ATOM 1069 C GLN A 70 -7.361 -5.299 -31.468 1.00 0.00 C
+ATOM 1070 O GLN A 70 -7.445 -4.624 -30.424 1.00 0.00 O
+ATOM 1071 CB GLN A 70 -7.939 -4.256 -33.685 1.00 0.00 C
+ATOM 1072 CG GLN A 70 -7.532 -3.304 -34.796 1.00 0.00 C
+ATOM 1073 CD GLN A 70 -8.637 -3.095 -35.814 1.00 0.00 C
+ATOM 1074 OE1 GLN A 70 -9.272 -4.050 -36.268 1.00 0.00 O
+ATOM 1075 NE2 GLN A 70 -8.875 -1.840 -36.177 1.00 0.00 N
+ATOM 1076 H GLN A 70 -5.987 -5.845 -34.320 1.00 0.00 H
+ATOM 1077 HA GLN A 70 -6.274 -3.712 -32.460 1.00 0.00 H
+ATOM 1078 1HB GLN A 70 -8.337 -5.161 -34.146 1.00 0.00 H
+ATOM 1079 2HB GLN A 70 -8.750 -3.791 -33.124 1.00 0.00 H
+ATOM 1080 1HG GLN A 70 -7.281 -2.337 -34.359 1.00 0.00 H
+ATOM 1081 2HG GLN A 70 -6.665 -3.716 -35.313 1.00 0.00 H
+ATOM 1082 1HE2 GLN A 70 -9.592 -1.639 -36.845 1.00 0.00 H
+ATOM 1083 2HE2 GLN A 70 -8.337 -1.094 -35.784 1.00 0.00 H
+ATOM 1084 N ASP A 71 -7.725 -6.580 -31.584 1.00 0.00 N
+ATOM 1085 CA ASP A 71 -8.317 -7.396 -30.491 1.00 0.00 C
+ATOM 1086 C ASP A 71 -7.272 -7.562 -29.388 1.00 0.00 C
+ATOM 1087 O ASP A 71 -7.659 -7.483 -28.219 1.00 0.00 O
+ATOM 1088 CB ASP A 71 -8.771 -8.768 -30.995 1.00 0.00 C
+ATOM 1089 CG ASP A 71 -10.067 -8.708 -31.791 1.00 0.00 C
+ATOM 1090 OD1 ASP A 71 -10.733 -7.701 -31.729 1.00 0.00 O
+ATOM 1091 OD2 ASP A 71 -10.380 -9.669 -32.453 1.00 0.00 O
+ATOM 1092 H ASP A 71 -7.575 -7.002 -32.490 1.00 0.00 H
+ATOM 1093 HA ASP A 71 -9.163 -6.850 -30.073 1.00 0.00 H
+ATOM 1094 1HB ASP A 71 -7.994 -9.199 -31.626 1.00 0.00 H
+ATOM 1095 2HB ASP A 71 -8.913 -9.438 -30.146 1.00 0.00 H
+ATOM 1096 N SER A 72 -5.998 -7.762 -29.749 1.00 0.00 N
+ATOM 1097 CA SER A 72 -4.886 -7.981 -28.785 1.00 0.00 C
+ATOM 1098 C SER A 72 -4.570 -6.677 -28.047 1.00 0.00 C
+ATOM 1099 O SER A 72 -4.174 -6.779 -26.873 1.00 0.00 O
+ATOM 1100 CB SER A 72 -3.646 -8.481 -29.498 1.00 0.00 C
+ATOM 1101 OG SER A 72 -3.034 -7.450 -30.225 1.00 0.00 O
+ATOM 1102 H SER A 72 -5.799 -7.761 -30.739 1.00 0.00 H
+ATOM 1103 HA SER A 72 -5.213 -8.705 -28.038 1.00 0.00 H
+ATOM 1104 1HB SER A 72 -2.943 -8.882 -28.768 1.00 0.00 H
+ATOM 1105 2HB SER A 72 -3.915 -9.293 -30.171 1.00 0.00 H
+ATOM 1106 HG SER A 72 -2.448 -7.880 -30.853 1.00 0.00 H
+ATOM 1107 N LEU A 73 -4.744 -5.513 -28.700 1.00 0.00 N
+ATOM 1108 CA LEU A 73 -4.467 -4.179 -28.089 1.00 0.00 C
+ATOM 1109 C LEU A 73 -5.583 -3.868 -27.084 1.00 0.00 C
+ATOM 1110 O LEU A 73 -5.275 -3.395 -25.966 1.00 0.00 O
+ATOM 1111 CB LEU A 73 -4.396 -3.079 -29.156 1.00 0.00 C
+ATOM 1112 CG LEU A 73 -3.184 -3.139 -30.093 1.00 0.00 C
+ATOM 1113 CD1 LEU A 73 -3.355 -2.118 -31.210 1.00 0.00 C
+ATOM 1114 CD2 LEU A 73 -1.914 -2.872 -29.299 1.00 0.00 C
+ATOM 1115 H LEU A 73 -5.076 -5.557 -29.652 1.00 0.00 H
+ATOM 1116 HA LEU A 73 -3.524 -4.237 -27.545 1.00 0.00 H
+ATOM 1117 1HB LEU A 73 -5.294 -3.134 -29.771 1.00 0.00 H
+ATOM 1118 2HB LEU A 73 -4.382 -2.111 -28.656 1.00 0.00 H
+ATOM 1119 HG LEU A 73 -3.126 -4.127 -30.551 1.00 0.00 H
+ATOM 1120 1HD1 LEU A 73 -2.494 -2.160 -31.877 1.00 0.00 H
+ATOM 1121 2HD1 LEU A 73 -4.260 -2.344 -31.774 1.00 0.00 H
+ATOM 1122 3HD1 LEU A 73 -3.433 -1.119 -30.781 1.00 0.00 H
+ATOM 1123 1HD2 LEU A 73 -1.052 -2.915 -29.966 1.00 0.00 H
+ATOM 1124 2HD2 LEU A 73 -1.971 -1.884 -28.843 1.00 0.00 H
+ATOM 1125 3HD2 LEU A 73 -1.808 -3.626 -28.520 1.00 0.00 H
+ATOM 1126 N SER A 74 -6.832 -4.162 -27.439 1.00 0.00 N
+ATOM 1127 CA SER A 74 -8.010 -3.914 -26.573 1.00 0.00 C
+ATOM 1128 C SER A 74 -7.958 -4.849 -25.363 1.00 0.00 C
+ATOM 1129 O SER A 74 -8.394 -4.442 -24.281 1.00 0.00 O
+ATOM 1130 CB SER A 74 -9.300 -4.128 -27.340 1.00 0.00 C
+ATOM 1131 OG SER A 74 -9.502 -5.488 -27.613 1.00 0.00 O
+ATOM 1132 H SER A 74 -6.970 -4.574 -28.350 1.00 0.00 H
+ATOM 1133 HA SER A 74 -7.952 -2.892 -26.196 1.00 0.00 H
+ATOM 1134 1HB SER A 74 -10.137 -3.743 -26.759 1.00 0.00 H
+ATOM 1135 2HB SER A 74 -9.265 -3.569 -28.274 1.00 0.00 H
+ATOM 1136 HG SER A 74 -10.143 -5.523 -28.327 1.00 0.00 H
+ATOM 1137 N SER A 75 -7.449 -6.066 -25.548 1.00 0.00 N
+ATOM 1138 CA SER A 75 -7.246 -7.068 -24.466 1.00 0.00 C
+ATOM 1139 C SER A 75 -6.099 -6.619 -23.551 1.00 0.00 C
+ATOM 1140 O SER A 75 -6.227 -6.770 -22.339 1.00 0.00 O
+ATOM 1141 CB SER A 75 -6.938 -8.434 -25.047 1.00 0.00 C
+ATOM 1142 OG SER A 75 -8.029 -8.927 -25.776 1.00 0.00 O
+ATOM 1143 H SER A 75 -7.189 -6.305 -26.495 1.00 0.00 H
+ATOM 1144 HA SER A 75 -8.143 -7.095 -23.847 1.00 0.00 H
+ATOM 1145 1HB SER A 75 -6.065 -8.366 -25.696 1.00 0.00 H
+ATOM 1146 2HB SER A 75 -6.694 -9.125 -24.241 1.00 0.00 H
+ATOM 1147 HG SER A 75 -7.996 -8.488 -26.629 1.00 0.00 H
+ATOM 1148 N THR A 76 -5.020 -6.078 -24.115 1.00 0.00 N
+ATOM 1149 CA THR A 76 -3.863 -5.557 -23.338 1.00 0.00 C
+ATOM 1150 C THR A 76 -4.343 -4.376 -22.487 1.00 0.00 C
+ATOM 1151 O THR A 76 -4.012 -4.326 -21.289 1.00 0.00 O
+ATOM 1152 CB THR A 76 -2.704 -5.114 -24.249 1.00 0.00 C
+ATOM 1153 OG1 THR A 76 -2.242 -6.234 -25.016 1.00 0.00 O
+ATOM 1154 CG2 THR A 76 -1.554 -4.562 -23.420 1.00 0.00 C
+ATOM 1155 H THR A 76 -5.000 -6.024 -25.123 1.00 0.00 H
+ATOM 1156 HA THR A 76 -3.517 -6.341 -22.664 1.00 0.00 H
+ATOM 1157 HB THR A 76 -3.054 -4.341 -24.933 1.00 0.00 H
+ATOM 1158 HG1 THR A 76 -2.889 -6.445 -25.693 1.00 0.00 H
+ATOM 1159 1HG2 THR A 76 -0.744 -4.255 -24.080 1.00 0.00 H
+ATOM 1160 2HG2 THR A 76 -1.901 -3.704 -22.844 1.00 0.00 H
+ATOM 1161 3HG2 THR A 76 -1.194 -5.334 -22.741 1.00 0.00 H
+ATOM 1162 N ALA A 77 -5.125 -3.480 -23.078 1.00 0.00 N
+ATOM 1163 CA ALA A 77 -5.669 -2.271 -22.410 1.00 0.00 C
+ATOM 1164 C ALA A 77 -6.564 -2.688 -21.244 1.00 0.00 C
+ATOM 1165 O ALA A 77 -6.496 -2.040 -20.182 1.00 0.00 O
+ATOM 1166 CB ALA A 77 -6.432 -1.411 -23.393 1.00 0.00 C
+ATOM 1167 H ALA A 77 -5.350 -3.649 -24.049 1.00 0.00 H
+ATOM 1168 HA ALA A 77 -4.831 -1.695 -22.019 1.00 0.00 H
+ATOM 1169 1HB ALA A 77 -6.822 -0.532 -22.882 1.00 0.00 H
+ATOM 1170 2HB ALA A 77 -5.765 -1.097 -24.196 1.00 0.00 H
+ATOM 1171 3HB ALA A 77 -7.259 -1.983 -23.812 1.00 0.00 H
+ATOM 1172 N SER A 78 -7.361 -3.738 -21.451 1.00 0.00 N
+ATOM 1173 CA SER A 78 -8.294 -4.328 -20.452 1.00 0.00 C
+ATOM 1174 C SER A 78 -7.473 -4.883 -19.280 1.00 0.00 C
+ATOM 1175 O SER A 78 -7.767 -4.555 -18.121 1.00 0.00 O
+ATOM 1176 CB SER A 78 -9.131 -5.430 -21.072 1.00 0.00 C
+ATOM 1177 OG SER A 78 -9.988 -6.004 -20.123 1.00 0.00 O
+ATOM 1178 H SER A 78 -7.305 -4.147 -22.372 1.00 0.00 H
+ATOM 1179 HA SER A 78 -8.929 -3.534 -20.061 1.00 0.00 H
+ATOM 1180 1HB SER A 78 -9.717 -5.024 -21.896 1.00 0.00 H
+ATOM 1181 2HB SER A 78 -8.476 -6.197 -21.484 1.00 0.00 H
+ATOM 1182 HG SER A 78 -10.565 -6.596 -20.612 1.00 0.00 H
+ATOM 1183 N ALA A 79 -6.431 -5.650 -19.587 1.00 0.00 N
+ATOM 1184 CA ALA A 79 -5.543 -6.285 -18.589 1.00 0.00 C
+ATOM 1185 C ALA A 79 -4.860 -5.202 -17.754 1.00 0.00 C
+ATOM 1186 O ALA A 79 -4.854 -5.333 -16.524 1.00 0.00 O
+ATOM 1187 CB ALA A 79 -4.543 -7.169 -19.289 1.00 0.00 C
+ATOM 1188 H ALA A 79 -6.251 -5.797 -20.569 1.00 0.00 H
+ATOM 1189 HA ALA A 79 -6.159 -6.893 -17.927 1.00 0.00 H
+ATOM 1190 1HB ALA A 79 -3.891 -7.634 -18.550 1.00 0.00 H
+ATOM 1191 2HB ALA A 79 -5.070 -7.943 -19.847 1.00 0.00 H
+ATOM 1192 3HB ALA A 79 -3.945 -6.571 -19.974 1.00 0.00 H
+ATOM 1193 N LEU A 80 -4.318 -4.167 -18.406 1.00 0.00 N
+ATOM 1194 CA LEU A 80 -3.616 -3.047 -17.720 1.00 0.00 C
+ATOM 1195 C LEU A 80 -4.610 -2.257 -16.856 1.00 0.00 C
+ATOM 1196 O LEU A 80 -4.237 -1.890 -15.727 1.00 0.00 O
+ATOM 1197 CB LEU A 80 -2.927 -2.167 -18.764 1.00 0.00 C
+ATOM 1198 CG LEU A 80 -1.742 -2.822 -19.470 1.00 0.00 C
+ATOM 1199 CD1 LEU A 80 -1.287 -1.993 -20.651 1.00 0.00 C
+ATOM 1200 CD2 LEU A 80 -0.583 -3.049 -18.508 1.00 0.00 C
+ATOM 1201 H LEU A 80 -4.397 -4.156 -19.413 1.00 0.00 H
+ATOM 1202 HA LEU A 80 -2.864 -3.467 -17.053 1.00 0.00 H
+ATOM 1203 1HB LEU A 80 -3.660 -1.883 -19.519 1.00 0.00 H
+ATOM 1204 2HB LEU A 80 -2.572 -1.259 -18.274 1.00 0.00 H
+ATOM 1205 HG LEU A 80 -2.048 -3.785 -19.877 1.00 0.00 H
+ATOM 1206 1HD1 LEU A 80 -0.443 -2.482 -21.134 1.00 0.00 H
+ATOM 1207 2HD1 LEU A 80 -2.107 -1.894 -21.362 1.00 0.00 H
+ATOM 1208 3HD1 LEU A 80 -0.983 -1.005 -20.305 1.00 0.00 H
+ATOM 1209 1HD2 LEU A 80 0.245 -3.518 -19.040 1.00 0.00 H
+ATOM 1210 2HD2 LEU A 80 -0.256 -2.093 -18.099 1.00 0.00 H
+ATOM 1211 3HD2 LEU A 80 -0.907 -3.700 -17.695 1.00 0.00 H
+ATOM 1212 N GLY A 81 -5.836 -2.034 -17.335 1.00 0.00 N
+ATOM 1213 CA GLY A 81 -6.893 -1.377 -16.540 1.00 0.00 C
+ATOM 1214 C GLY A 81 -7.242 -2.157 -15.277 1.00 0.00 C
+ATOM 1215 O GLY A 81 -7.311 -1.549 -14.187 1.00 0.00 O
+ATOM 1216 H GLY A 81 -6.040 -2.328 -18.279 1.00 0.00 H
+ATOM 1217 1HA GLY A 81 -6.570 -0.373 -16.262 1.00 0.00 H
+ATOM 1218 2HA GLY A 81 -7.790 -1.267 -17.150 1.00 0.00 H
+ATOM 1219 N LYS A 82 -7.470 -3.466 -15.405 1.00 0.00 N
+ATOM 1220 CA LYS A 82 -7.838 -4.327 -14.247 1.00 0.00 C
+ATOM 1221 C LYS A 82 -6.698 -4.306 -13.233 1.00 0.00 C
+ATOM 1222 O LYS A 82 -7.002 -4.177 -12.045 1.00 0.00 O
+ATOM 1223 CB LYS A 82 -8.196 -5.743 -14.700 1.00 0.00 C
+ATOM 1224 CG LYS A 82 -9.527 -5.843 -15.437 1.00 0.00 C
+ATOM 1225 CD LYS A 82 -9.875 -7.241 -15.921 1.00 0.00 C
+ATOM 1226 CE LYS A 82 -11.202 -7.295 -16.656 1.00 0.00 C
+ATOM 1227 NZ LYS A 82 -11.515 -8.657 -17.152 1.00 0.00 N
+ATOM 1228 H LYS A 82 -7.389 -3.882 -16.321 1.00 0.00 H
+ATOM 1229 HA LYS A 82 -8.711 -3.894 -13.759 1.00 0.00 H
+ATOM 1230 1HB LYS A 82 -7.415 -6.122 -15.359 1.00 0.00 H
+ATOM 1231 2HB LYS A 82 -8.240 -6.401 -13.833 1.00 0.00 H
+ATOM 1232 1HG LYS A 82 -10.333 -5.517 -14.779 1.00 0.00 H
+ATOM 1233 2HG LYS A 82 -9.508 -5.192 -16.310 1.00 0.00 H
+ATOM 1234 1HD LYS A 82 -9.097 -7.598 -16.595 1.00 0.00 H
+ATOM 1235 2HD LYS A 82 -9.930 -7.918 -15.069 1.00 0.00 H
+ATOM 1236 1HE LYS A 82 -12.002 -6.975 -15.989 1.00 0.00 H
+ATOM 1237 2HE LYS A 82 -11.176 -6.613 -17.506 1.00 0.00 H
+ATOM 1238 1HZ LYS A 82 -12.404 -8.644 -17.632 1.00 0.00 H
+ATOM 1239 2HZ LYS A 82 -10.791 -8.957 -17.790 1.00 0.00 H
+ATOM 1240 3HZ LYS A 82 -11.564 -9.297 -16.373 1.00 0.00 H
+ATOM 1241 N LEU A 83 -5.443 -4.385 -13.692 1.00 0.00 N
+ATOM 1242 CA LEU A 83 -4.235 -4.307 -12.823 1.00 0.00 C
+ATOM 1243 C LEU A 83 -4.162 -2.930 -12.145 1.00 0.00 C
+ATOM 1244 O LEU A 83 -3.870 -2.908 -10.929 1.00 0.00 O
+ATOM 1245 CB LEU A 83 -2.960 -4.550 -13.640 1.00 0.00 C
+ATOM 1246 CG LEU A 83 -2.709 -6.002 -14.068 1.00 0.00 C
+ATOM 1247 CD1 LEU A 83 -1.616 -6.038 -15.127 1.00 0.00 C
+ATOM 1248 CD2 LEU A 83 -2.320 -6.829 -12.851 1.00 0.00 C
+ATOM 1249 H LEU A 83 -5.326 -4.506 -14.688 1.00 0.00 H
+ATOM 1250 HA LEU A 83 -4.316 -5.070 -12.049 1.00 0.00 H
+ATOM 1251 1HB LEU A 83 -3.005 -3.943 -14.542 1.00 0.00 H
+ATOM 1252 2HB LEU A 83 -2.102 -4.225 -13.050 1.00 0.00 H
+ATOM 1253 HG LEU A 83 -3.617 -6.412 -14.510 1.00 0.00 H
+ATOM 1254 1HD1 LEU A 83 -1.439 -7.071 -15.431 1.00 0.00 H
+ATOM 1255 2HD1 LEU A 83 -1.930 -5.456 -15.994 1.00 0.00 H
+ATOM 1256 3HD1 LEU A 83 -0.699 -5.618 -14.719 1.00 0.00 H
+ATOM 1257 1HD2 LEU A 83 -2.141 -7.861 -13.156 1.00 0.00 H
+ATOM 1258 2HD2 LEU A 83 -1.411 -6.420 -12.409 1.00 0.00 H
+ATOM 1259 3HD2 LEU A 83 -3.125 -6.800 -12.118 1.00 0.00 H
+ATOM 1260 N GLN A 84 -4.420 -1.830 -12.871 1.00 0.00 N
+ATOM 1261 CA GLN A 84 -4.378 -0.456 -12.292 1.00 0.00 C
+ATOM 1262 C GLN A 84 -5.383 -0.364 -11.138 1.00 0.00 C
+ATOM 1263 O GLN A 84 -4.998 0.138 -10.065 1.00 0.00 O
+ATOM 1264 CB GLN A 84 -4.677 0.641 -13.315 1.00 0.00 C
+ATOM 1265 CG GLN A 84 -4.595 2.052 -12.723 1.00 0.00 C
+ATOM 1266 CD GLN A 84 -4.823 3.186 -13.695 1.00 0.00 C
+ATOM 1267 OE1 GLN A 84 -5.564 3.072 -14.664 1.00 0.00 O
+ATOM 1268 NE2 GLN A 84 -4.214 4.327 -13.418 1.00 0.00 N
+ATOM 1269 H GLN A 84 -4.650 -1.945 -13.847 1.00 0.00 H
+ATOM 1270 HA GLN A 84 -3.376 -0.274 -11.905 1.00 0.00 H
+ATOM 1271 1HB GLN A 84 -3.969 0.571 -14.142 1.00 0.00 H
+ATOM 1272 2HB GLN A 84 -5.677 0.493 -13.726 1.00 0.00 H
+ATOM 1273 1HG GLN A 84 -5.354 2.152 -11.945 1.00 0.00 H
+ATOM 1274 2HG GLN A 84 -3.604 2.199 -12.299 1.00 0.00 H
+ATOM 1275 1HE2 GLN A 84 -4.325 5.114 -14.024 1.00 0.00 H
+ATOM 1276 2HE2 GLN A 84 -3.641 4.402 -12.601 1.00 0.00 H
+ATOM 1277 N ASP A 85 -6.616 -0.835 -11.348 1.00 0.00 N
+ATOM 1278 CA ASP A 85 -7.716 -0.743 -10.350 1.00 0.00 C
+ATOM 1279 C ASP A 85 -7.321 -1.548 -9.107 1.00 0.00 C
+ATOM 1280 O ASP A 85 -7.374 -0.995 -7.990 1.00 0.00 O
+ATOM 1281 CB ASP A 85 -9.036 -1.269 -10.919 1.00 0.00 C
+ATOM 1282 CG ASP A 85 -9.671 -0.316 -11.923 1.00 0.00 C
+ATOM 1283 OD1 ASP A 85 -9.256 0.817 -11.980 1.00 0.00 O
+ATOM 1284 OD2 ASP A 85 -10.566 -0.729 -12.620 1.00 0.00 O
+ATOM 1285 H ASP A 85 -6.795 -1.274 -12.240 1.00 0.00 H
+ATOM 1286 HA ASP A 85 -7.815 0.297 -10.039 1.00 0.00 H
+ATOM 1287 1HB ASP A 85 -8.863 -2.228 -11.410 1.00 0.00 H
+ATOM 1288 2HB ASP A 85 -9.741 -1.441 -10.106 1.00 0.00 H
+ATOM 1289 N VAL A 86 -6.884 -2.792 -9.284 1.00 0.00 N
+ATOM 1290 CA VAL A 86 -6.589 -3.698 -8.141 1.00 0.00 C
+ATOM 1291 C VAL A 86 -5.373 -3.179 -7.367 1.00 0.00 C
+ATOM 1292 O VAL A 86 -5.423 -3.216 -6.125 1.00 0.00 O
+ATOM 1293 CB VAL A 86 -6.309 -5.131 -8.630 1.00 0.00 C
+ATOM 1294 CG1 VAL A 86 -5.800 -5.994 -7.486 1.00 0.00 C
+ATOM 1295 CG2 VAL A 86 -7.571 -5.727 -9.236 1.00 0.00 C
+ATOM 1296 H VAL A 86 -6.750 -3.131 -10.227 1.00 0.00 H
+ATOM 1297 HA VAL A 86 -7.437 -3.675 -7.454 1.00 0.00 H
+ATOM 1298 HB VAL A 86 -5.523 -5.100 -9.384 1.00 0.00 H
+ATOM 1299 1HG1 VAL A 86 -5.608 -7.004 -7.850 1.00 0.00 H
+ATOM 1300 2HG1 VAL A 86 -4.877 -5.570 -7.091 1.00 0.00 H
+ATOM 1301 3HG1 VAL A 86 -6.551 -6.032 -6.697 1.00 0.00 H
+ATOM 1302 1HG2 VAL A 86 -7.365 -6.740 -9.581 1.00 0.00 H
+ATOM 1303 2HG2 VAL A 86 -8.359 -5.752 -8.484 1.00 0.00 H
+ATOM 1304 3HG2 VAL A 86 -7.893 -5.115 -10.079 1.00 0.00 H
+ATOM 1305 N VAL A 87 -4.309 -2.744 -8.039 1.00 0.00 N
+ATOM 1306 CA VAL A 87 -3.083 -2.262 -7.329 1.00 0.00 C
+ATOM 1307 C VAL A 87 -3.467 -1.050 -6.487 1.00 0.00 C
+ATOM 1308 O VAL A 87 -3.009 -0.977 -5.338 1.00 0.00 O
+ATOM 1309 CB VAL A 87 -1.971 -1.870 -8.320 1.00 0.00 C
+ATOM 1310 CG1 VAL A 87 -0.858 -1.121 -7.603 1.00 0.00 C
+ATOM 1311 CG2 VAL A 87 -1.428 -3.114 -9.007 1.00 0.00 C
+ATOM 1312 H VAL A 87 -4.327 -2.739 -9.049 1.00 0.00 H
+ATOM 1313 HA VAL A 87 -2.733 -3.054 -6.667 1.00 0.00 H
+ATOM 1314 HB VAL A 87 -2.385 -1.192 -9.068 1.00 0.00 H
+ATOM 1315 1HG1 VAL A 87 -0.081 -0.851 -8.318 1.00 0.00 H
+ATOM 1316 2HG1 VAL A 87 -1.263 -0.215 -7.150 1.00 0.00 H
+ATOM 1317 3HG1 VAL A 87 -0.432 -1.756 -6.827 1.00 0.00 H
+ATOM 1318 1HG2 VAL A 87 -0.642 -2.829 -9.707 1.00 0.00 H
+ATOM 1319 2HG2 VAL A 87 -1.019 -3.793 -8.260 1.00 0.00 H
+ATOM 1320 3HG2 VAL A 87 -2.232 -3.611 -9.548 1.00 0.00 H
+ATOM 1321 N ASN A 88 -4.281 -0.152 -7.055 1.00 0.00 N
+ATOM 1322 CA ASN A 88 -4.746 1.099 -6.397 1.00 0.00 C
+ATOM 1323 C ASN A 88 -5.600 0.747 -5.162 1.00 0.00 C
+ATOM 1324 O ASN A 88 -5.404 1.395 -4.102 1.00 0.00 O
+ATOM 1325 CB ASN A 88 -5.431 2.017 -7.410 1.00 0.00 C
+ATOM 1326 CG ASN A 88 -4.457 2.742 -8.315 1.00 0.00 C
+ATOM 1327 OD1 ASN A 88 -3.257 2.826 -8.055 1.00 0.00 O
+ATOM 1328 ND2 ASN A 88 -4.975 3.301 -9.389 1.00 0.00 N
+ATOM 1329 H ASN A 88 -4.589 -0.356 -7.994 1.00 0.00 H
+ATOM 1330 HA ASN A 88 -3.879 1.618 -5.988 1.00 0.00 H
+ATOM 1331 1HB ASN A 88 -6.109 1.431 -8.033 1.00 0.00 H
+ATOM 1332 2HB ASN A 88 -6.030 2.759 -6.882 1.00 0.00 H
+ATOM 1333 1HD2 ASN A 88 -4.386 3.796 -10.029 1.00 0.00 H
+ATOM 1334 2HD2 ASN A 88 -5.956 3.231 -9.566 1.00 0.00 H
+ATOM 1335 N GLN A 89 -6.488 -0.246 -5.264 1.00 0.00 N
+ATOM 1336 CA GLN A 89 -7.357 -0.682 -4.134 1.00 0.00 C
+ATOM 1337 C GLN A 89 -6.491 -1.292 -3.020 1.00 0.00 C
+ATOM 1338 O GLN A 89 -6.775 -1.031 -1.833 1.00 0.00 O
+ATOM 1339 CB GLN A 89 -8.399 -1.711 -4.583 1.00 0.00 C
+ATOM 1340 CG GLN A 89 -9.537 -1.128 -5.410 1.00 0.00 C
+ATOM 1341 CD GLN A 89 -10.620 -2.147 -5.682 1.00 0.00 C
+ATOM 1342 OE1 GLN A 89 -10.441 -3.350 -5.476 1.00 0.00 O
+ATOM 1343 NE2 GLN A 89 -11.766 -1.669 -6.146 1.00 0.00 N
+ATOM 1344 H GLN A 89 -6.566 -0.717 -6.155 1.00 0.00 H
+ATOM 1345 HA GLN A 89 -7.888 0.190 -3.750 1.00 0.00 H
+ATOM 1346 1HB GLN A 89 -7.914 -2.485 -5.177 1.00 0.00 H
+ATOM 1347 2HB GLN A 89 -8.834 -2.193 -3.708 1.00 0.00 H
+ATOM 1348 1HG GLN A 89 -9.977 -0.292 -4.867 1.00 0.00 H
+ATOM 1349 2HG GLN A 89 -9.139 -0.785 -6.366 1.00 0.00 H
+ATOM 1350 1HE2 GLN A 89 -12.524 -2.292 -6.347 1.00 0.00 H
+ATOM 1351 2HE2 GLN A 89 -11.874 -0.686 -6.297 1.00 0.00 H
+ATOM 1352 N ASN A 90 -5.475 -2.081 -3.393 1.00 0.00 N
+ATOM 1353 CA ASN A 90 -4.514 -2.716 -2.449 1.00 0.00 C
+ATOM 1354 C ASN A 90 -3.663 -1.627 -1.770 1.00 0.00 C
+ATOM 1355 O ASN A 90 -3.418 -1.744 -0.547 1.00 0.00 O
+ATOM 1356 CB ASN A 90 -3.630 -3.724 -3.159 1.00 0.00 C
+ATOM 1357 CG ASN A 90 -4.361 -4.992 -3.505 1.00 0.00 C
+ATOM 1358 OD1 ASN A 90 -5.452 -5.254 -2.986 1.00 0.00 O
+ATOM 1359 ND2 ASN A 90 -3.781 -5.783 -4.370 1.00 0.00 N
+ATOM 1360 H ASN A 90 -5.369 -2.242 -4.383 1.00 0.00 H
+ATOM 1361 HA ASN A 90 -5.080 -3.207 -1.657 1.00 0.00 H
+ATOM 1362 1HB ASN A 90 -3.237 -3.283 -4.076 1.00 0.00 H
+ATOM 1363 2HB ASN A 90 -2.778 -3.972 -2.525 1.00 0.00 H
+ATOM 1364 1HD2 ASN A 90 -4.222 -6.640 -4.638 1.00 0.00 H
+ATOM 1365 2HD2 ASN A 90 -2.898 -5.531 -4.765 1.00 0.00 H
+ATOM 1366 N ALA A 91 -3.248 -0.596 -2.511 1.00 0.00 N
+ATOM 1367 CA ALA A 91 -2.447 0.533 -1.984 1.00 0.00 C
+ATOM 1368 C ALA A 91 -3.275 1.298 -0.947 1.00 0.00 C
+ATOM 1369 O ALA A 91 -2.739 1.633 0.131 1.00 0.00 O
+ATOM 1370 CB ALA A 91 -2.013 1.439 -3.103 1.00 0.00 C
+ATOM 1371 H ALA A 91 -3.506 -0.600 -3.489 1.00 0.00 H
+ATOM 1372 HA ALA A 91 -1.561 0.121 -1.500 1.00 0.00 H
+ATOM 1373 1HB ALA A 91 -1.425 2.262 -2.698 1.00 0.00 H
+ATOM 1374 2HB ALA A 91 -1.408 0.874 -3.812 1.00 0.00 H
+ATOM 1375 3HB ALA A 91 -2.892 1.835 -3.609 1.00 0.00 H
+ATOM 1376 N GLN A 92 -4.555 1.524 -1.239 1.00 0.00 N
+ATOM 1377 CA GLN A 92 -5.478 2.222 -0.307 1.00 0.00 C
+ATOM 1378 C GLN A 92 -5.805 1.314 0.887 1.00 0.00 C
+ATOM 1379 O GLN A 92 -5.903 1.840 1.991 1.00 0.00 O
+ATOM 1380 CB GLN A 92 -6.767 2.638 -1.020 1.00 0.00 C
+ATOM 1381 CG GLN A 92 -7.742 3.406 -0.142 1.00 0.00 C
+ATOM 1382 CD GLN A 92 -7.141 4.683 0.412 1.00 0.00 C
+ATOM 1383 OE1 GLN A 92 -6.576 5.492 -0.328 1.00 0.00 O
+ATOM 1384 NE2 GLN A 92 -7.256 4.870 1.722 1.00 0.00 N
+ATOM 1385 H GLN A 92 -4.905 1.206 -2.131 1.00 0.00 H
+ATOM 1386 HA GLN A 92 -4.962 3.090 0.105 1.00 0.00 H
+ATOM 1387 1HB GLN A 92 -6.523 3.264 -1.879 1.00 0.00 H
+ATOM 1388 2HB GLN A 92 -7.277 1.752 -1.395 1.00 0.00 H
+ATOM 1389 1HG GLN A 92 -8.617 3.670 -0.735 1.00 0.00 H
+ATOM 1390 2HG GLN A 92 -8.036 2.774 0.696 1.00 0.00 H
+ATOM 1391 1HE2 GLN A 92 -6.879 5.695 2.146 1.00 0.00 H
+ATOM 1392 2HE2 GLN A 92 -7.721 4.187 2.286 1.00 0.00 H
+ATOM 1393 N ALA A 93 -5.979 0.008 0.676 1.00 0.00 N
+ATOM 1394 CA ALA A 93 -6.262 -0.987 1.740 1.00 0.00 C
+ATOM 1395 C ALA A 93 -5.092 -1.053 2.725 1.00 0.00 C
+ATOM 1396 O ALA A 93 -5.332 -1.243 3.920 1.00 0.00 O
+ATOM 1397 CB ALA A 93 -6.511 -2.342 1.130 1.00 0.00 C
+ATOM 1398 H ALA A 93 -5.908 -0.304 -0.283 1.00 0.00 H
+ATOM 1399 HA ALA A 93 -7.158 -0.667 2.273 1.00 0.00 H
+ATOM 1400 1HB ALA A 93 -6.718 -3.064 1.919 1.00 0.00 H
+ATOM 1401 2HB ALA A 93 -7.366 -2.286 0.456 1.00 0.00 H
+ATOM 1402 3HB ALA A 93 -5.630 -2.657 0.573 1.00 0.00 H
+ATOM 1403 N LEU A 94 -3.862 -0.923 2.233 1.00 0.00 N
+ATOM 1404 CA LEU A 94 -2.656 -0.928 3.092 1.00 0.00 C
+ATOM 1405 C LEU A 94 -2.553 0.393 3.855 1.00 0.00 C
+ATOM 1406 O LEU A 94 -2.311 0.335 5.064 1.00 0.00 O
+ATOM 1407 CB LEU A 94 -1.390 -1.144 2.254 1.00 0.00 C
+ATOM 1408 CG LEU A 94 -0.063 -1.065 3.020 1.00 0.00 C
+ATOM 1409 CD1 LEU A 94 -0.048 -2.115 4.123 1.00 0.00 C
+ATOM 1410 CD2 LEU A 94 1.095 -1.270 2.055 1.00 0.00 C
+ATOM 1411 H LEU A 94 -3.753 -0.816 1.235 1.00 0.00 H
+ATOM 1412 HA LEU A 94 -2.745 -1.747 3.807 1.00 0.00 H
+ATOM 1413 1HB LEU A 94 -1.444 -2.127 1.788 1.00 0.00 H
+ATOM 1414 2HB LEU A 94 -1.362 -0.392 1.465 1.00 0.00 H
+ATOM 1415 HG LEU A 94 0.028 -0.086 3.492 1.00 0.00 H
+ATOM 1416 1HD1 LEU A 94 0.894 -2.059 4.668 1.00 0.00 H
+ATOM 1417 2HD1 LEU A 94 -0.875 -1.933 4.810 1.00 0.00 H
+ATOM 1418 3HD1 LEU A 94 -0.154 -3.107 3.682 1.00 0.00 H
+ATOM 1419 1HD2 LEU A 94 2.037 -1.213 2.600 1.00 0.00 H
+ATOM 1420 2HD2 LEU A 94 1.006 -2.250 1.584 1.00 0.00 H
+ATOM 1421 3HD2 LEU A 94 1.071 -0.496 1.288 1.00 0.00 H
+ATOM 1422 N THR A 95 -4.172 -0.675 -66.644 1.00 0.00 N
+ATOM 1423 CA THR A 95 -4.276 -1.823 -65.695 1.00 0.00 C
+ATOM 1424 C THR A 95 -3.015 -1.839 -64.816 1.00 0.00 C
+ATOM 1425 O THR A 95 -3.167 -2.089 -63.609 1.00 0.00 O
+ATOM 1426 CB THR A 95 -4.426 -3.170 -66.427 1.00 0.00 C
+ATOM 1427 OG1 THR A 95 -3.392 -3.301 -67.410 1.00 0.00 O
+ATOM 1428 CG2 THR A 95 -5.783 -3.260 -67.108 1.00 0.00 C
+ATOM 1429 H THR A 95 -4.212 -0.852 -67.637 1.00 0.00 H
+ATOM 1430 HA THR A 95 -5.105 -1.634 -65.013 1.00 0.00 H
+ATOM 1431 HB THR A 95 -4.333 -3.985 -65.709 1.00 0.00 H
+ATOM 1432 HG1 THR A 95 -2.558 -3.493 -66.974 1.00 0.00 H
+ATOM 1433 1HG2 THR A 95 -5.872 -4.218 -67.619 1.00 0.00 H
+ATOM 1434 2HG2 THR A 95 -6.572 -3.172 -66.361 1.00 0.00 H
+ATOM 1435 3HG2 THR A 95 -5.879 -2.452 -67.833 1.00 0.00 H
+ATOM 1436 N GLN A 96 -1.838 -1.518 -65.375 1.00 0.00 N
+ATOM 1437 CA GLN A 96 -0.541 -1.463 -64.634 1.00 0.00 C
+ATOM 1438 C GLN A 96 -0.435 -0.163 -63.816 1.00 0.00 C
+ATOM 1439 O GLN A 96 0.344 -0.163 -62.843 1.00 0.00 O
+ATOM 1440 CB GLN A 96 0.662 -1.627 -65.570 1.00 0.00 C
+ATOM 1441 CG GLN A 96 1.070 -3.080 -65.801 1.00 0.00 C
+ATOM 1442 CD GLN A 96 0.010 -3.913 -66.486 1.00 0.00 C
+ATOM 1443 OE1 GLN A 96 -0.850 -3.404 -67.198 1.00 0.00 O
+ATOM 1444 NE2 GLN A 96 0.074 -5.219 -66.278 1.00 0.00 N
+ATOM 1445 H GLN A 96 -1.849 -1.303 -66.363 1.00 0.00 H
+ATOM 1446 HA GLN A 96 -0.521 -2.280 -63.913 1.00 0.00 H
+ATOM 1447 1HB GLN A 96 0.432 -1.181 -66.538 1.00 0.00 H
+ATOM 1448 2HB GLN A 96 1.519 -1.093 -65.159 1.00 0.00 H
+ATOM 1449 1HG GLN A 96 1.961 -3.101 -66.429 1.00 0.00 H
+ATOM 1450 2HG GLN A 96 1.281 -3.545 -64.838 1.00 0.00 H
+ATOM 1451 1HE2 GLN A 96 -0.599 -5.826 -66.702 1.00 0.00 H
+ATOM 1452 2HE2 GLN A 96 0.794 -5.598 -65.697 1.00 0.00 H
+ATOM 1453 N ASN A 97 -1.172 0.896 -64.186 1.00 0.00 N
+ATOM 1454 CA ASN A 97 -1.319 2.143 -63.375 1.00 0.00 C
+ATOM 1455 C ASN A 97 -2.071 1.796 -62.082 1.00 0.00 C
+ATOM 1456 O ASN A 97 -1.672 2.309 -61.010 1.00 0.00 O
+ATOM 1457 CB ASN A 97 -2.040 3.233 -64.147 1.00 0.00 C
+ATOM 1458 CG ASN A 97 -2.074 4.540 -63.405 1.00 0.00 C
+ATOM 1459 OD1 ASN A 97 -1.065 5.250 -63.329 1.00 0.00 O
+ATOM 1460 ND2 ASN A 97 -3.215 4.870 -62.856 1.00 0.00 N
+ATOM 1461 H ASN A 97 -1.651 0.829 -65.073 1.00 0.00 H
+ATOM 1462 HA ASN A 97 -0.324 2.499 -63.105 1.00 0.00 H
+ATOM 1463 1HB ASN A 97 -1.547 3.386 -65.107 1.00 0.00 H
+ATOM 1464 2HB ASN A 97 -3.064 2.917 -64.351 1.00 0.00 H
+ATOM 1465 1HD2 ASN A 97 -3.296 5.729 -62.350 1.00 0.00 H
+ATOM 1466 2HD2 ASN A 97 -4.005 4.264 -62.943 1.00 0.00 H
+ATOM 1467 N VAL A 98 -3.106 0.952 -62.182 1.00 0.00 N
+ATOM 1468 CA VAL A 98 -3.988 0.544 -61.045 1.00 0.00 C
+ATOM 1469 C VAL A 98 -3.178 -0.336 -60.089 1.00 0.00 C
+ATOM 1470 O VAL A 98 -3.263 -0.114 -58.869 1.00 0.00 O
+ATOM 1471 CB VAL A 98 -5.222 -0.232 -61.540 1.00 0.00 C
+ATOM 1472 CG1 VAL A 98 -6.016 -0.777 -60.363 1.00 0.00 C
+ATOM 1473 CG2 VAL A 98 -6.089 0.670 -62.405 1.00 0.00 C
+ATOM 1474 H VAL A 98 -3.283 0.575 -63.101 1.00 0.00 H
+ATOM 1475 HA VAL A 98 -4.310 1.443 -60.517 1.00 0.00 H
+ATOM 1476 HB VAL A 98 -4.890 -1.089 -62.128 1.00 0.00 H
+ATOM 1477 1HG1 VAL A 98 -6.886 -1.324 -60.731 1.00 0.00 H
+ATOM 1478 2HG1 VAL A 98 -5.388 -1.448 -59.780 1.00 0.00 H
+ATOM 1479 3HG1 VAL A 98 -6.348 0.049 -59.734 1.00 0.00 H
+ATOM 1480 1HG2 VAL A 98 -6.960 0.115 -62.753 1.00 0.00 H
+ATOM 1481 2HG2 VAL A 98 -6.417 1.530 -61.819 1.00 0.00 H
+ATOM 1482 3HG2 VAL A 98 -5.513 1.015 -63.264 1.00 0.00 H
+ATOM 1483 N LEU A 99 -2.441 -1.305 -60.636 1.00 0.00 N
+ATOM 1484 CA LEU A 99 -1.595 -2.249 -59.861 1.00 0.00 C
+ATOM 1485 C LEU A 99 -0.531 -1.462 -59.110 1.00 0.00 C
+ATOM 1486 O LEU A 99 -0.290 -1.787 -57.941 1.00 0.00 O
+ATOM 1487 CB LEU A 99 -0.929 -3.281 -60.781 1.00 0.00 C
+ATOM 1488 CG LEU A 99 -1.865 -4.328 -61.395 1.00 0.00 C
+ATOM 1489 CD1 LEU A 99 -1.127 -5.096 -62.483 1.00 0.00 C
+ATOM 1490 CD2 LEU A 99 -2.363 -5.268 -60.306 1.00 0.00 C
+ATOM 1491 H LEU A 99 -2.473 -1.386 -61.642 1.00 0.00 H
+ATOM 1492 HA LEU A 99 -2.231 -2.784 -59.155 1.00 0.00 H
+ATOM 1493 1HB LEU A 99 -0.441 -2.752 -61.598 1.00 0.00 H
+ATOM 1494 2HB LEU A 99 -0.165 -3.812 -60.213 1.00 0.00 H
+ATOM 1495 HG LEU A 99 -2.716 -3.828 -61.860 1.00 0.00 H
+ATOM 1496 1HD1 LEU A 99 -1.792 -5.839 -62.920 1.00 0.00 H
+ATOM 1497 2HD1 LEU A 99 -0.800 -4.402 -63.259 1.00 0.00 H
+ATOM 1498 3HD1 LEU A 99 -0.260 -5.594 -62.051 1.00 0.00 H
+ATOM 1499 1HD2 LEU A 99 -3.030 -6.011 -60.742 1.00 0.00 H
+ATOM 1500 2HD2 LEU A 99 -1.513 -5.768 -59.842 1.00 0.00 H
+ATOM 1501 3HD2 LEU A 99 -2.903 -4.695 -59.551 1.00 0.00 H
+ATOM 1502 N TYR A 100 0.065 -0.462 -59.759 1.00 0.00 N
+ATOM 1503 CA TYR A 100 1.146 0.364 -59.167 1.00 0.00 C
+ATOM 1504 C TYR A 100 0.554 1.232 -58.053 1.00 0.00 C
+ATOM 1505 O TYR A 100 1.165 1.289 -56.974 1.00 0.00 O
+ATOM 1506 CB TYR A 100 1.881 1.200 -60.217 1.00 0.00 C
+ATOM 1507 CG TYR A 100 3.060 1.960 -59.661 1.00 0.00 C
+ATOM 1508 CD1 TYR A 100 4.081 1.299 -58.989 1.00 0.00 C
+ATOM 1509 CD2 TYR A 100 3.157 3.338 -59.783 1.00 0.00 C
+ATOM 1510 CE1 TYR A 100 5.168 1.981 -58.461 1.00 0.00 C
+ATOM 1511 CE2 TYR A 100 4.239 4.034 -59.267 1.00 0.00 C
+ATOM 1512 CZ TYR A 100 5.249 3.355 -58.599 1.00 0.00 C
+ATOM 1513 OH TYR A 100 6.320 4.025 -58.082 1.00 0.00 O
+ATOM 1514 H TYR A 100 -0.246 -0.265 -60.700 1.00 0.00 H
+ATOM 1515 HA TYR A 100 1.875 -0.301 -58.702 1.00 0.00 H
+ATOM 1516 1HB TYR A 100 2.239 0.548 -61.016 1.00 0.00 H
+ATOM 1517 2HB TYR A 100 1.191 1.915 -60.662 1.00 0.00 H
+ATOM 1518 HD1 TYR A 100 4.042 0.217 -58.867 1.00 0.00 H
+ATOM 1519 HD2 TYR A 100 2.371 3.897 -60.291 1.00 0.00 H
+ATOM 1520 HE1 TYR A 100 5.952 1.434 -57.939 1.00 0.00 H
+ATOM 1521 HE2 TYR A 100 4.298 5.116 -59.385 1.00 0.00 H
+ATOM 1522 HH TYR A 100 6.249 4.958 -58.302 1.00 0.00 H
+ATOM 1523 N GLU A 101 -0.609 1.851 -58.282 1.00 0.00 N
+ATOM 1524 CA GLU A 101 -1.274 2.703 -57.258 1.00 0.00 C
+ATOM 1525 C GLU A 101 -1.703 1.809 -56.085 1.00 0.00 C
+ATOM 1526 O GLU A 101 -1.608 2.283 -54.938 1.00 0.00 O
+ATOM 1527 CB GLU A 101 -2.379 3.565 -57.885 1.00 0.00 C
+ATOM 1528 CG GLU A 101 -1.804 4.711 -58.720 1.00 0.00 C
+ATOM 1529 CD GLU A 101 -2.730 5.800 -59.242 1.00 0.00 C
+ATOM 1530 OE1 GLU A 101 -3.945 5.753 -58.967 1.00 0.00 O
+ATOM 1531 OE2 GLU A 101 -2.215 6.721 -59.915 1.00 0.00 O
+ATOM 1532 H GLU A 101 -1.046 1.733 -59.184 1.00 0.00 H
+ATOM 1533 HA GLU A 101 -0.527 3.368 -56.823 1.00 0.00 H
+ATOM 1534 1HB GLU A 101 -3.011 2.942 -58.518 1.00 0.00 H
+ATOM 1535 2HB GLU A 101 -3.011 3.976 -57.096 1.00 0.00 H
+ATOM 1536 1HG GLU A 101 -1.050 5.233 -58.130 1.00 0.00 H
+ATOM 1537 2HG GLU A 101 -1.314 4.295 -59.599 1.00 0.00 H
+ATOM 1538 N ASN A 102 -2.078 0.555 -56.350 1.00 0.00 N
+ATOM 1539 CA ASN A 102 -2.418 -0.439 -55.296 1.00 0.00 C
+ATOM 1540 C ASN A 102 -1.168 -0.727 -54.459 1.00 0.00 C
+ATOM 1541 O ASN A 102 -1.305 -0.853 -53.227 1.00 0.00 O
+ATOM 1542 CB ASN A 102 -3.011 -1.726 -55.875 1.00 0.00 C
+ATOM 1543 CG ASN A 102 -4.447 -1.568 -56.327 1.00 0.00 C
+ATOM 1544 OD1 ASN A 102 -5.100 -0.582 -55.990 1.00 0.00 O
+ATOM 1545 ND2 ASN A 102 -4.953 -2.534 -57.077 1.00 0.00 N
+ATOM 1546 H ASN A 102 -2.129 0.279 -57.320 1.00 0.00 H
+ATOM 1547 HA ASN A 102 -3.166 0.001 -54.634 1.00 0.00 H
+ATOM 1548 1HB ASN A 102 -2.412 -2.052 -56.725 1.00 0.00 H
+ATOM 1549 2HB ASN A 102 -2.969 -2.516 -55.123 1.00 0.00 H
+ATOM 1550 1HD2 ASN A 102 -5.898 -2.474 -57.400 1.00 0.00 H
+ATOM 1551 2HD2 ASN A 102 -4.392 -3.325 -57.320 1.00 0.00 H
+ATOM 1552 N GLN A 103 0.001 -0.829 -55.096 1.00 0.00 N
+ATOM 1553 CA GLN A 103 1.284 -1.106 -54.403 1.00 0.00 C
+ATOM 1554 C GLN A 103 1.586 0.073 -53.482 1.00 0.00 C
+ATOM 1555 O GLN A 103 1.989 -0.168 -52.337 1.00 0.00 O
+ATOM 1556 CB GLN A 103 2.417 -1.344 -55.399 1.00 0.00 C
+ATOM 1557 CG GLN A 103 2.294 -2.665 -56.142 1.00 0.00 C
+ATOM 1558 CD GLN A 103 2.734 -3.855 -55.327 1.00 0.00 C
+ATOM 1559 OE1 GLN A 103 3.924 -4.064 -55.101 1.00 0.00 O
+ATOM 1560 NE2 GLN A 103 1.764 -4.652 -54.896 1.00 0.00 N
+ATOM 1561 H GLN A 103 -0.001 -0.711 -56.100 1.00 0.00 H
+ATOM 1562 HA GLN A 103 1.164 -2.007 -53.802 1.00 0.00 H
+ATOM 1563 1HB GLN A 103 2.434 -0.536 -56.130 1.00 0.00 H
+ATOM 1564 2HB GLN A 103 3.372 -1.330 -54.874 1.00 0.00 H
+ATOM 1565 1HG GLN A 103 1.251 -2.819 -56.419 1.00 0.00 H
+ATOM 1566 2HG GLN A 103 2.916 -2.626 -57.037 1.00 0.00 H
+ATOM 1567 1HE2 GLN A 103 1.986 -5.461 -54.350 1.00 0.00 H
+ATOM 1568 2HE2 GLN A 103 0.811 -4.445 -55.118 1.00 0.00 H
+ATOM 1569 N LYS A 104 1.372 1.300 -53.961 1.00 0.00 N
+ATOM 1570 CA LYS A 104 1.598 2.532 -53.164 1.00 0.00 C
+ATOM 1571 C LYS A 104 0.674 2.492 -51.941 1.00 0.00 C
+ATOM 1572 O LYS A 104 1.168 2.754 -50.823 1.00 0.00 O
+ATOM 1573 CB LYS A 104 1.302 3.798 -53.971 1.00 0.00 C
+ATOM 1574 CG LYS A 104 2.242 4.149 -55.118 1.00 0.00 C
+ATOM 1575 CD LYS A 104 1.773 5.459 -55.742 1.00 0.00 C
+ATOM 1576 CE LYS A 104 2.457 5.885 -57.022 1.00 0.00 C
+ATOM 1577 NZ LYS A 104 1.915 7.193 -57.467 1.00 0.00 N
+ATOM 1578 H LYS A 104 1.038 1.383 -54.911 1.00 0.00 H
+ATOM 1579 HA LYS A 104 2.647 2.562 -52.865 1.00 0.00 H
+ATOM 1580 1HB LYS A 104 0.307 3.724 -54.410 1.00 0.00 H
+ATOM 1581 2HB LYS A 104 1.303 4.662 -53.307 1.00 0.00 H
+ATOM 1582 1HG LYS A 104 3.259 4.251 -54.738 1.00 0.00 H
+ATOM 1583 2HG LYS A 104 2.228 3.349 -55.858 1.00 0.00 H
+ATOM 1584 1HD LYS A 104 0.709 5.392 -55.972 1.00 0.00 H
+ATOM 1585 2HD LYS A 104 1.923 6.273 -55.032 1.00 0.00 H
+ATOM 1586 1HE LYS A 104 3.529 5.965 -56.851 1.00 0.00 H
+ATOM 1587 2HE LYS A 104 2.288 5.133 -57.791 1.00 0.00 H
+ATOM 1588 1HZ LYS A 104 2.374 7.475 -58.322 1.00 0.00 H
+ATOM 1589 2HZ LYS A 104 0.922 7.110 -57.629 1.00 0.00 H
+ATOM 1590 3HZ LYS A 104 2.082 7.888 -56.752 1.00 0.00 H
+ATOM 1591 N LEU A 105 -0.611 2.165 -52.155 1.00 0.00 N
+ATOM 1592 CA LEU A 105 -1.680 2.120 -51.115 1.00 0.00 C
+ATOM 1593 C LEU A 105 -1.302 1.099 -50.034 1.00 0.00 C
+ATOM 1594 O LEU A 105 -1.362 1.447 -48.834 1.00 0.00 O
+ATOM 1595 CB LEU A 105 -3.033 1.745 -51.733 1.00 0.00 C
+ATOM 1596 CG LEU A 105 -4.195 1.589 -50.744 1.00 0.00 C
+ATOM 1597 CD1 LEU A 105 -4.461 2.923 -50.058 1.00 0.00 C
+ATOM 1598 CD2 LEU A 105 -5.432 1.100 -51.486 1.00 0.00 C
+ATOM 1599 H LEU A 105 -0.844 1.934 -53.111 1.00 0.00 H
+ATOM 1600 HA LEU A 105 -1.760 3.106 -50.658 1.00 0.00 H
+ATOM 1601 1HB LEU A 105 -3.311 2.513 -52.452 1.00 0.00 H
+ATOM 1602 2HB LEU A 105 -2.923 0.799 -52.265 1.00 0.00 H
+ATOM 1603 HG LEU A 105 -3.925 0.866 -49.974 1.00 0.00 H
+ATOM 1604 1HD1 LEU A 105 -5.287 2.813 -49.356 1.00 0.00 H
+ATOM 1605 2HD1 LEU A 105 -3.568 3.239 -49.519 1.00 0.00 H
+ATOM 1606 3HD1 LEU A 105 -4.718 3.672 -50.806 1.00 0.00 H
+ATOM 1607 1HD2 LEU A 105 -6.258 0.990 -50.782 1.00 0.00 H
+ATOM 1608 2HD2 LEU A 105 -5.704 1.823 -52.255 1.00 0.00 H
+ATOM 1609 3HD2 LEU A 105 -5.219 0.138 -51.952 1.00 0.00 H
+ATOM 1610 N ILE A 106 -0.913 -0.113 -50.443 1.00 0.00 N
+ATOM 1611 CA ILE A 106 -0.553 -1.236 -49.523 1.00 0.00 C
+ATOM 1612 C ILE A 106 0.657 -0.820 -48.678 1.00 0.00 C
+ATOM 1613 O ILE A 106 0.623 -1.031 -47.461 1.00 0.00 O
+ATOM 1614 CB ILE A 106 -0.223 -2.527 -50.294 1.00 0.00 C
+ATOM 1615 CG1 ILE A 106 -1.483 -3.087 -50.960 1.00 0.00 C
+ATOM 1616 CG2 ILE A 106 0.395 -3.559 -49.364 1.00 0.00 C
+ATOM 1617 CD1 ILE A 106 -1.205 -4.150 -51.998 1.00 0.00 C
+ATOM 1618 H ILE A 106 -0.867 -0.261 -51.442 1.00 0.00 H
+ATOM 1619 HA ILE A 106 -1.393 -1.421 -48.857 1.00 0.00 H
+ATOM 1620 HB ILE A 106 0.483 -2.304 -51.095 1.00 0.00 H
+ATOM 1621 1HG1 ILE A 106 -2.136 -3.514 -50.200 1.00 0.00 H
+ATOM 1622 2HG1 ILE A 106 -2.031 -2.277 -51.442 1.00 0.00 H
+ATOM 1623 1HG2 ILE A 106 0.619 -4.467 -49.925 1.00 0.00 H
+ATOM 1624 2HG2 ILE A 106 1.313 -3.160 -48.937 1.00 0.00 H
+ATOM 1625 3HG2 ILE A 106 -0.306 -3.794 -48.563 1.00 0.00 H
+ATOM 1626 1HD1 ILE A 106 -2.146 -4.498 -52.424 1.00 0.00 H
+ATOM 1627 2HD1 ILE A 106 -0.581 -3.733 -52.788 1.00 0.00 H
+ATOM 1628 3HD1 ILE A 106 -0.689 -4.988 -51.530 1.00 0.00 H
+ATOM 1629 N ALA A 107 1.691 -0.269 -49.311 1.00 0.00 N
+ATOM 1630 CA ALA A 107 2.930 0.193 -48.642 1.00 0.00 C
+ATOM 1631 C ALA A 107 2.609 1.336 -47.673 1.00 0.00 C
+ATOM 1632 O ALA A 107 3.172 1.335 -46.569 1.00 0.00 O
+ATOM 1633 CB ALA A 107 3.965 0.608 -49.658 1.00 0.00 C
+ATOM 1634 H ALA A 107 1.607 -0.170 -50.313 1.00 0.00 H
+ATOM 1635 HA ALA A 107 3.328 -0.635 -48.055 1.00 0.00 H
+ATOM 1636 1HB ALA A 107 4.865 0.944 -49.143 1.00 0.00 H
+ATOM 1637 2HB ALA A 107 4.208 -0.242 -50.298 1.00 0.00 H
+ATOM 1638 3HB ALA A 107 3.571 1.419 -50.268 1.00 0.00 H
+ATOM 1639 N ASN A 108 1.738 2.268 -48.058 1.00 0.00 N
+ATOM 1640 CA ASN A 108 1.396 3.449 -47.217 1.00 0.00 C
+ATOM 1641 C ASN A 108 0.560 3.019 -46.002 1.00 0.00 C
+ATOM 1642 O ASN A 108 0.809 3.556 -44.891 1.00 0.00 O
+ATOM 1643 CB ASN A 108 0.700 4.538 -48.038 1.00 0.00 C
+ATOM 1644 CG ASN A 108 1.658 5.255 -48.972 1.00 0.00 C
+ATOM 1645 OD1 ASN A 108 2.869 5.305 -48.731 1.00 0.00 O
+ATOM 1646 ND2 ASN A 108 1.131 5.809 -50.053 1.00 0.00 N
+ATOM 1647 H ASN A 108 1.295 2.160 -48.959 1.00 0.00 H
+ATOM 1648 HA ASN A 108 2.318 3.866 -46.813 1.00 0.00 H
+ATOM 1649 1HB ASN A 108 -0.102 4.093 -48.627 1.00 0.00 H
+ATOM 1650 2HB ASN A 108 0.248 5.268 -47.366 1.00 0.00 H
+ATOM 1651 1HD2 ASN A 108 1.717 6.294 -50.703 1.00 0.00 H
+ATOM 1652 2HD2 ASN A 108 0.148 5.741 -50.220 1.00 0.00 H
+ATOM 1653 N GLN A 109 -0.408 2.121 -46.217 1.00 0.00 N
+ATOM 1654 CA GLN A 109 -1.331 1.610 -45.168 1.00 0.00 C
+ATOM 1655 C GLN A 109 -0.536 0.728 -44.195 1.00 0.00 C
+ATOM 1656 O GLN A 109 -0.814 0.772 -42.977 1.00 0.00 O
+ATOM 1657 CB GLN A 109 -2.488 0.816 -45.781 1.00 0.00 C
+ATOM 1658 CG GLN A 109 -3.469 1.659 -46.577 1.00 0.00 C
+ATOM 1659 CD GLN A 109 -4.222 2.648 -45.707 1.00 0.00 C
+ATOM 1660 OE1 GLN A 109 -3.778 3.781 -45.504 1.00 0.00 O
+ATOM 1661 NE2 GLN A 109 -5.369 2.224 -45.187 1.00 0.00 N
+ATOM 1662 H GLN A 109 -0.502 1.780 -47.163 1.00 0.00 H
+ATOM 1663 HA GLN A 109 -1.739 2.459 -44.623 1.00 0.00 H
+ATOM 1664 1HB GLN A 109 -2.091 0.046 -46.442 1.00 0.00 H
+ATOM 1665 2HB GLN A 109 -3.043 0.312 -44.990 1.00 0.00 H
+ATOM 1666 1HG GLN A 109 -2.920 2.220 -47.334 1.00 0.00 H
+ATOM 1667 2HG GLN A 109 -4.195 1.000 -47.054 1.00 0.00 H
+ATOM 1668 1HE2 GLN A 109 -5.910 2.832 -44.605 1.00 0.00 H
+ATOM 1669 2HE2 GLN A 109 -5.692 1.297 -45.378 1.00 0.00 H
+ATOM 1670 N PHE A 110 0.438 -0.023 -44.714 1.00 0.00 N
+ATOM 1671 CA PHE A 110 1.353 -0.885 -43.928 1.00 0.00 C
+ATOM 1672 C PHE A 110 2.220 -0.021 -43.014 1.00 0.00 C
+ATOM 1673 O PHE A 110 2.273 -0.307 -41.814 1.00 0.00 O
+ATOM 1674 CB PHE A 110 2.241 -1.719 -44.847 1.00 0.00 C
+ATOM 1675 CG PHE A 110 3.270 -2.536 -44.114 1.00 0.00 C
+ATOM 1676 CD1 PHE A 110 2.889 -3.634 -43.362 1.00 0.00 C
+ATOM 1677 CD2 PHE A 110 4.612 -2.210 -44.171 1.00 0.00 C
+ATOM 1678 CE1 PHE A 110 3.829 -4.396 -42.685 1.00 0.00 C
+ATOM 1679 CE2 PHE A 110 5.552 -2.977 -43.501 1.00 0.00 C
+ATOM 1680 CZ PHE A 110 5.161 -4.066 -42.757 1.00 0.00 C
+ATOM 1681 H PHE A 110 0.541 0.017 -45.718 1.00 0.00 H
+ATOM 1682 HA PHE A 110 0.752 -1.564 -43.320 1.00 0.00 H
+ATOM 1683 1HB PHE A 110 1.622 -2.398 -45.433 1.00 0.00 H
+ATOM 1684 2HB PHE A 110 2.761 -1.064 -45.545 1.00 0.00 H
+ATOM 1685 HD1 PHE A 110 1.832 -3.900 -43.306 1.00 0.00 H
+ATOM 1686 HD2 PHE A 110 4.931 -1.348 -44.758 1.00 0.00 H
+ATOM 1687 HE1 PHE A 110 3.511 -5.255 -42.094 1.00 0.00 H
+ATOM 1688 HE2 PHE A 110 6.608 -2.711 -43.562 1.00 0.00 H
+ATOM 1689 HZ PHE A 110 5.901 -4.664 -42.228 1.00 0.00 H
+ATOM 1690 N ASN A 111 2.879 0.994 -43.578 1.00 0.00 N
+ATOM 1691 CA ASN A 111 3.798 1.903 -42.846 1.00 0.00 C
+ATOM 1692 C ASN A 111 3.003 2.635 -41.767 1.00 0.00 C
+ATOM 1693 O ASN A 111 3.542 2.868 -40.678 1.00 0.00 O
+ATOM 1694 CB ASN A 111 4.478 2.887 -43.780 1.00 0.00 C
+ATOM 1695 CG ASN A 111 5.526 2.236 -44.642 1.00 0.00 C
+ATOM 1696 OD1 ASN A 111 6.038 1.162 -44.311 1.00 0.00 O
+ATOM 1697 ND2 ASN A 111 5.852 2.868 -45.741 1.00 0.00 N
+ATOM 1698 H ASN A 111 2.729 1.137 -44.567 1.00 0.00 H
+ATOM 1699 HA ASN A 111 4.564 1.299 -42.355 1.00 0.00 H
+ATOM 1700 1HB ASN A 111 3.732 3.352 -44.425 1.00 0.00 H
+ATOM 1701 2HB ASN A 111 4.946 3.679 -43.197 1.00 0.00 H
+ATOM 1702 1HD2 ASN A 111 6.542 2.482 -46.352 1.00 0.00 H
+ATOM 1703 2HD2 ASN A 111 5.411 3.735 -45.969 1.00 0.00 H
+ATOM 1704 N SER A 112 1.763 2.994 -42.080 1.00 0.00 N
+ATOM 1705 CA SER A 112 0.828 3.691 -41.161 1.00 0.00 C
+ATOM 1706 C SER A 112 0.514 2.752 -39.990 1.00 0.00 C
+ATOM 1707 O SER A 112 0.674 3.165 -38.824 1.00 0.00 O
+ATOM 1708 CB SER A 112 -0.450 4.087 -41.875 1.00 0.00 C
+ATOM 1709 OG SER A 112 -1.344 4.710 -40.995 1.00 0.00 O
+ATOM 1710 H SER A 112 1.453 2.764 -43.014 1.00 0.00 H
+ATOM 1711 HA SER A 112 1.332 4.571 -40.759 1.00 0.00 H
+ATOM 1712 1HB SER A 112 -0.213 4.763 -42.696 1.00 0.00 H
+ATOM 1713 2HB SER A 112 -0.916 3.202 -42.305 1.00 0.00 H
+ATOM 1714 HG SER A 112 -2.086 4.999 -41.533 1.00 0.00 H
+ATOM 1715 N ALA A 113 0.143 1.511 -40.306 1.00 0.00 N
+ATOM 1716 CA ALA A 113 -0.279 0.493 -39.325 1.00 0.00 C
+ATOM 1717 C ALA A 113 0.887 0.244 -38.370 1.00 0.00 C
+ATOM 1718 O ALA A 113 0.641 0.259 -37.149 1.00 0.00 O
+ATOM 1719 CB ALA A 113 -0.724 -0.760 -40.033 1.00 0.00 C
+ATOM 1720 H ALA A 113 0.158 1.272 -41.288 1.00 0.00 H
+ATOM 1721 HA ALA A 113 -1.117 0.896 -38.757 1.00 0.00 H
+ATOM 1722 1HB ALA A 113 -1.033 -1.503 -39.297 1.00 0.00 H
+ATOM 1723 2HB ALA A 113 -1.564 -0.529 -40.688 1.00 0.00 H
+ATOM 1724 3HB ALA A 113 0.099 -1.156 -40.625 1.00 0.00 H
+ATOM 1725 N ILE A 114 2.104 0.093 -38.911 1.00 0.00 N
+ATOM 1726 CA ILE A 114 3.334 -0.211 -38.117 1.00 0.00 C
+ATOM 1727 C ILE A 114 3.649 0.969 -37.198 1.00 0.00 C
+ATOM 1728 O ILE A 114 4.007 0.706 -36.037 1.00 0.00 O
+ATOM 1729 CB ILE A 114 4.547 -0.493 -39.024 1.00 0.00 C
+ATOM 1730 CG1 ILE A 114 4.315 -1.763 -39.846 1.00 0.00 C
+ATOM 1731 CG2 ILE A 114 5.815 -0.617 -38.193 1.00 0.00 C
+ATOM 1732 CD1 ILE A 114 4.203 -3.019 -39.012 1.00 0.00 C
+ATOM 1733 H ILE A 114 2.177 0.194 -39.914 1.00 0.00 H
+ATOM 1734 HA ILE A 114 3.136 -1.083 -37.494 1.00 0.00 H
+ATOM 1735 HB ILE A 114 4.667 0.324 -39.734 1.00 0.00 H
+ATOM 1736 1HG1 ILE A 114 3.400 -1.658 -40.428 1.00 0.00 H
+ATOM 1737 2HG1 ILE A 114 5.136 -1.896 -40.551 1.00 0.00 H
+ATOM 1738 1HG2 ILE A 114 6.661 -0.817 -38.849 1.00 0.00 H
+ATOM 1739 2HG2 ILE A 114 5.987 0.312 -37.651 1.00 0.00 H
+ATOM 1740 3HG2 ILE A 114 5.705 -1.436 -37.482 1.00 0.00 H
+ATOM 1741 1HD1 ILE A 114 4.040 -3.877 -39.665 1.00 0.00 H
+ATOM 1742 2HD1 ILE A 114 5.124 -3.163 -38.446 1.00 0.00 H
+ATOM 1743 3HD1 ILE A 114 3.365 -2.924 -38.322 1.00 0.00 H
+ATOM 1744 N GLY A 115 3.529 2.202 -37.701 1.00 0.00 N
+ATOM 1745 CA GLY A 115 3.719 3.430 -36.909 1.00 0.00 C
+ATOM 1746 C GLY A 115 2.851 3.421 -35.664 1.00 0.00 C
+ATOM 1747 O GLY A 115 3.393 3.613 -34.554 1.00 0.00 O
+ATOM 1748 H GLY A 115 3.297 2.280 -38.682 1.00 0.00 H
+ATOM 1749 1HA GLY A 115 4.767 3.521 -36.625 1.00 0.00 H
+ATOM 1750 2HA GLY A 115 3.474 4.299 -37.521 1.00 0.00 H
+ATOM 1751 N LYS A 116 1.553 3.162 -35.831 1.00 0.00 N
+ATOM 1752 CA LYS A 116 0.564 3.093 -34.721 1.00 0.00 C
+ATOM 1753 C LYS A 116 0.930 1.972 -33.740 1.00 0.00 C
+ATOM 1754 O LYS A 116 0.770 2.186 -32.526 1.00 0.00 O
+ATOM 1755 CB LYS A 116 -0.850 2.873 -35.261 1.00 0.00 C
+ATOM 1756 CG LYS A 116 -1.424 4.060 -36.022 1.00 0.00 C
+ATOM 1757 CD LYS A 116 -2.793 3.735 -36.601 1.00 0.00 C
+ATOM 1758 CE LYS A 116 -3.312 4.873 -37.467 1.00 0.00 C
+ATOM 1759 NZ LYS A 116 -4.614 4.536 -38.106 1.00 0.00 N
+ATOM 1760 H LYS A 116 1.241 3.005 -36.778 1.00 0.00 H
+ATOM 1761 HA LYS A 116 0.563 4.050 -34.198 1.00 0.00 H
+ATOM 1762 1HB LYS A 116 -0.854 2.013 -35.931 1.00 0.00 H
+ATOM 1763 2HB LYS A 116 -1.524 2.646 -34.435 1.00 0.00 H
+ATOM 1764 1HG LYS A 116 -1.517 4.913 -35.350 1.00 0.00 H
+ATOM 1765 2HG LYS A 116 -0.751 4.331 -36.834 1.00 0.00 H
+ATOM 1766 1HD LYS A 116 -2.727 2.829 -37.206 1.00 0.00 H
+ATOM 1767 2HD LYS A 116 -3.499 3.558 -35.791 1.00 0.00 H
+ATOM 1768 1HE LYS A 116 -3.442 5.765 -36.856 1.00 0.00 H
+ATOM 1769 2HE LYS A 116 -2.586 5.096 -38.249 1.00 0.00 H
+ATOM 1770 1HZ LYS A 116 -4.924 5.315 -38.672 1.00 0.00 H
+ATOM 1771 2HZ LYS A 116 -4.502 3.719 -38.691 1.00 0.00 H
+ATOM 1772 3HZ LYS A 116 -5.301 4.345 -37.392 1.00 0.00 H
+ATOM 1773 N ILE A 117 1.376 0.815 -34.250 1.00 0.00 N
+ATOM 1774 CA ILE A 117 1.751 -0.381 -33.431 1.00 0.00 C
+ATOM 1775 C ILE A 117 2.973 -0.030 -32.568 1.00 0.00 C
+ATOM 1776 O ILE A 117 2.945 -0.325 -31.354 1.00 0.00 O
+ATOM 1777 CB ILE A 117 2.071 -1.603 -34.311 1.00 0.00 C
+ATOM 1778 CG1 ILE A 117 0.801 -2.118 -34.992 1.00 0.00 C
+ATOM 1779 CG2 ILE A 117 2.717 -2.701 -33.482 1.00 0.00 C
+ATOM 1780 CD1 ILE A 117 1.064 -3.078 -36.130 1.00 0.00 C
+ATOM 1781 H ILE A 117 1.455 0.768 -35.255 1.00 0.00 H
+ATOM 1782 HA ILE A 117 0.934 -0.601 -32.745 1.00 0.00 H
+ATOM 1783 HB ILE A 117 2.757 -1.309 -35.105 1.00 0.00 H
+ATOM 1784 1HG1 ILE A 117 0.173 -2.622 -34.258 1.00 0.00 H
+ATOM 1785 2HG1 ILE A 117 0.230 -1.275 -35.384 1.00 0.00 H
+ATOM 1786 1HG2 ILE A 117 2.936 -3.558 -34.119 1.00 0.00 H
+ATOM 1787 2HG2 ILE A 117 3.642 -2.330 -33.043 1.00 0.00 H
+ATOM 1788 3HG2 ILE A 117 2.036 -3.006 -32.687 1.00 0.00 H
+ATOM 1789 1HD1 ILE A 117 0.116 -3.398 -36.562 1.00 0.00 H
+ATOM 1790 2HD1 ILE A 117 1.662 -2.581 -36.895 1.00 0.00 H
+ATOM 1791 3HD1 ILE A 117 1.603 -3.947 -35.755 1.00 0.00 H
+ATOM 1792 N GLN A 118 3.982 0.622 -33.150 1.00 0.00 N
+ATOM 1793 CA GLN A 118 5.207 1.043 -32.420 1.00 0.00 C
+ATOM 1794 C GLN A 118 4.802 1.871 -31.201 1.00 0.00 C
+ATOM 1795 O GLN A 118 5.357 1.621 -30.124 1.00 0.00 O
+ATOM 1796 CB GLN A 118 6.144 1.853 -33.320 1.00 0.00 C
+ATOM 1797 CG GLN A 118 6.874 1.026 -34.364 1.00 0.00 C
+ATOM 1798 CD GLN A 118 7.744 1.875 -35.271 1.00 0.00 C
+ATOM 1799 OE1 GLN A 118 8.224 2.940 -34.875 1.00 0.00 O
+ATOM 1800 NE2 GLN A 118 7.952 1.408 -36.497 1.00 0.00 N
+ATOM 1801 H GLN A 118 3.898 0.835 -34.133 1.00 0.00 H
+ATOM 1802 HA GLN A 118 5.739 0.150 -32.093 1.00 0.00 H
+ATOM 1803 1HB GLN A 118 5.574 2.623 -33.840 1.00 0.00 H
+ATOM 1804 2HB GLN A 118 6.891 2.357 -32.707 1.00 0.00 H
+ATOM 1805 1HG GLN A 118 7.513 0.302 -33.857 1.00 0.00 H
+ATOM 1806 2HG GLN A 118 6.140 0.508 -34.981 1.00 0.00 H
+ATOM 1807 1HE2 GLN A 118 8.518 1.925 -37.141 1.00 0.00 H
+ATOM 1808 2HE2 GLN A 118 7.543 0.539 -36.777 1.00 0.00 H
+ATOM 1809 N ASP A 119 3.863 2.804 -31.376 1.00 0.00 N
+ATOM 1810 CA ASP A 119 3.403 3.737 -30.313 1.00 0.00 C
+ATOM 1811 C ASP A 119 2.689 2.916 -29.227 1.00 0.00 C
+ATOM 1812 O ASP A 119 3.009 3.113 -28.035 1.00 0.00 O
+ATOM 1813 CB ASP A 119 2.549 4.865 -30.916 1.00 0.00 C
+ATOM 1814 CG ASP A 119 2.148 5.965 -29.942 1.00 0.00 C
+ATOM 1815 OD1 ASP A 119 3.039 6.490 -29.244 1.00 0.00 O
+ATOM 1816 OD2 ASP A 119 0.937 6.293 -29.891 1.00 0.00 O
+ATOM 1817 H ASP A 119 3.453 2.864 -32.296 1.00 0.00 H
+ATOM 1818 HA ASP A 119 4.278 4.181 -29.838 1.00 0.00 H
+ATOM 1819 1HB ASP A 119 3.093 5.336 -31.734 1.00 0.00 H
+ATOM 1820 2HB ASP A 119 1.632 4.445 -31.330 1.00 0.00 H
+ATOM 1821 N SER A 120 1.784 2.005 -29.614 1.00 0.00 N
+ATOM 1822 CA SER A 120 0.966 1.187 -28.682 1.00 0.00 C
+ATOM 1823 C SER A 120 1.887 0.239 -27.912 1.00 0.00 C
+ATOM 1824 O SER A 120 1.603 -0.026 -26.728 1.00 0.00 O
+ATOM 1825 CB SER A 120 -0.087 0.395 -29.432 1.00 0.00 C
+ATOM 1826 OG SER A 120 0.495 -0.650 -30.161 1.00 0.00 O
+ATOM 1827 H SER A 120 1.669 1.879 -30.610 1.00 0.00 H
+ATOM 1828 HA SER A 120 0.497 1.854 -27.957 1.00 0.00 H
+ATOM 1829 1HB SER A 120 -0.810 -0.011 -28.725 1.00 0.00 H
+ATOM 1830 2HB SER A 120 -0.627 1.056 -30.108 1.00 0.00 H
+ATOM 1831 HG SER A 120 -0.149 -0.899 -30.828 1.00 0.00 H
+ATOM 1832 N LEU A 121 2.969 -0.235 -28.541 1.00 0.00 N
+ATOM 1833 CA LEU A 121 3.948 -1.126 -27.860 1.00 0.00 C
+ATOM 1834 C LEU A 121 4.730 -0.316 -26.817 1.00 0.00 C
+ATOM 1835 O LEU A 121 4.944 -0.818 -25.705 1.00 0.00 O
+ATOM 1836 CB LEU A 121 4.918 -1.752 -28.869 1.00 0.00 C
+ATOM 1837 CG LEU A 121 4.309 -2.787 -29.824 1.00 0.00 C
+ATOM 1838 CD1 LEU A 121 5.332 -3.161 -30.889 1.00 0.00 C
+ATOM 1839 CD2 LEU A 121 3.872 -4.011 -29.033 1.00 0.00 C
+ATOM 1840 H LEU A 121 3.124 0.019 -29.507 1.00 0.00 H
+ATOM 1841 HA LEU A 121 3.400 -1.912 -27.342 1.00 0.00 H
+ATOM 1842 1HB LEU A 121 5.350 -0.957 -29.475 1.00 0.00 H
+ATOM 1843 2HB LEU A 121 5.724 -2.240 -28.321 1.00 0.00 H
+ATOM 1844 HG LEU A 121 3.446 -2.353 -30.328 1.00 0.00 H
+ATOM 1845 1HD1 LEU A 121 4.899 -3.896 -31.567 1.00 0.00 H
+ATOM 1846 2HD1 LEU A 121 5.612 -2.270 -31.451 1.00 0.00 H
+ATOM 1847 3HD1 LEU A 121 6.215 -3.583 -30.412 1.00 0.00 H
+ATOM 1848 1HD2 LEU A 121 3.438 -4.747 -29.711 1.00 0.00 H
+ATOM 1849 2HD2 LEU A 121 4.735 -4.447 -28.529 1.00 0.00 H
+ATOM 1850 3HD2 LEU A 121 3.128 -3.718 -28.291 1.00 0.00 H
+ATOM 1851 N SER A 122 5.115 0.913 -27.142 1.00 0.00 N
+ATOM 1852 CA SER A 122 5.868 1.796 -26.218 1.00 0.00 C
+ATOM 1853 C SER A 122 4.986 2.171 -25.016 1.00 0.00 C
+ATOM 1854 O SER A 122 5.498 2.118 -23.883 1.00 0.00 O
+ATOM 1855 CB SER A 122 6.329 3.051 -26.934 1.00 0.00 C
+ATOM 1856 OG SER A 122 7.260 2.745 -27.936 1.00 0.00 O
+ATOM 1857 H SER A 122 4.879 1.253 -28.063 1.00 0.00 H
+ATOM 1858 HA SER A 122 6.704 1.231 -25.802 1.00 0.00 H
+ATOM 1859 1HB SER A 122 5.469 3.555 -27.375 1.00 0.00 H
+ATOM 1860 2HB SER A 122 6.776 3.736 -26.215 1.00 0.00 H
+ATOM 1861 HG SER A 122 6.752 2.390 -28.669 1.00 0.00 H
+ATOM 1862 N SER A 123 3.704 2.486 -25.235 1.00 0.00 N
+ATOM 1863 CA SER A 123 2.726 2.815 -24.158 1.00 0.00 C
+ATOM 1864 C SER A 123 2.479 1.584 -23.276 1.00 0.00 C
+ATOM 1865 O SER A 123 2.371 1.758 -22.043 1.00 0.00 O
+ATOM 1866 CB SER A 123 1.414 3.293 -24.749 1.00 0.00 C
+ATOM 1867 OG SER A 123 1.574 4.528 -25.390 1.00 0.00 O
+ATOM 1868 H SER A 123 3.397 2.497 -26.198 1.00 0.00 H
+ATOM 1869 HA SER A 123 3.158 3.590 -23.524 1.00 0.00 H
+ATOM 1870 1HB SER A 123 1.045 2.556 -25.460 1.00 0.00 H
+ATOM 1871 2HB SER A 123 0.671 3.385 -23.957 1.00 0.00 H
+ATOM 1872 HG SER A 123 0.724 4.733 -25.785 1.00 0.00 H
+ATOM 1873 N THR A 124 2.376 0.394 -23.880 1.00 0.00 N
+ATOM 1874 CA THR A 124 2.186 -0.890 -23.151 1.00 0.00 C
+ATOM 1875 C THR A 124 3.390 -1.130 -22.227 1.00 0.00 C
+ATOM 1876 O THR A 124 3.189 -1.415 -21.028 1.00 0.00 O
+ATOM 1877 CB THR A 124 2.021 -2.079 -24.116 1.00 0.00 C
+ATOM 1878 OG1 THR A 124 0.838 -1.897 -24.905 1.00 0.00 O
+ATOM 1879 CG2 THR A 124 1.913 -3.384 -23.341 1.00 0.00 C
+ATOM 1880 H THR A 124 2.431 0.384 -24.888 1.00 0.00 H
+ATOM 1881 HA THR A 124 1.305 -0.799 -22.514 1.00 0.00 H
+ATOM 1882 HB THR A 124 2.882 -2.129 -24.782 1.00 0.00 H
+ATOM 1883 HG1 THR A 124 0.987 -1.199 -25.548 1.00 0.00 H
+ATOM 1884 1HG2 THR A 124 1.797 -4.213 -24.039 1.00 0.00 H
+ATOM 1885 2HG2 THR A 124 2.816 -3.530 -22.749 1.00 0.00 H
+ATOM 1886 3HG2 THR A 124 1.048 -3.343 -22.680 1.00 0.00 H
+ATOM 1887 N ALA A 125 4.604 -0.990 -22.755 1.00 0.00 N
+ATOM 1888 CA ALA A 125 5.859 -1.186 -21.999 1.00 0.00 C
+ATOM 1889 C ALA A 125 5.934 -0.172 -20.848 1.00 0.00 C
+ATOM 1890 O ALA A 125 6.389 -0.568 -19.774 1.00 0.00 O
+ATOM 1891 CB ALA A 125 7.052 -1.081 -22.919 1.00 0.00 C
+ATOM 1892 H ALA A 125 4.652 -0.733 -23.731 1.00 0.00 H
+ATOM 1893 HA ALA A 125 5.840 -2.184 -21.561 1.00 0.00 H
+ATOM 1894 1HB ALA A 125 7.968 -1.227 -22.346 1.00 0.00 H
+ATOM 1895 2HB ALA A 125 6.982 -1.845 -23.694 1.00 0.00 H
+ATOM 1896 3HB ALA A 125 7.069 -0.096 -23.382 1.00 0.00 H
+ATOM 1897 N SER A 126 5.508 1.081 -21.052 1.00 0.00 N
+ATOM 1898 CA SER A 126 5.524 2.162 -20.022 1.00 0.00 C
+ATOM 1899 C SER A 126 4.556 1.818 -18.888 1.00 0.00 C
+ATOM 1900 O SER A 126 4.945 1.982 -17.725 1.00 0.00 O
+ATOM 1901 CB SER A 126 5.143 3.496 -20.633 1.00 0.00 C
+ATOM 1902 OG SER A 126 5.152 4.512 -19.668 1.00 0.00 O
+ATOM 1903 H SER A 126 5.158 1.288 -21.977 1.00 0.00 H
+ATOM 1904 HA SER A 126 6.533 2.237 -19.616 1.00 0.00 H
+ATOM 1905 1HB SER A 126 5.841 3.743 -21.432 1.00 0.00 H
+ATOM 1906 2HB SER A 126 4.151 3.423 -21.077 1.00 0.00 H
+ATOM 1907 HG SER A 126 4.903 5.317 -20.128 1.00 0.00 H
+ATOM 1908 N ALA A 127 3.341 1.380 -19.244 1.00 0.00 N
+ATOM 1909 CA ALA A 127 2.251 0.989 -18.322 1.00 0.00 C
+ATOM 1910 C ALA A 127 2.695 -0.194 -17.460 1.00 0.00 C
+ATOM 1911 O ALA A 127 2.464 -0.152 -16.236 1.00 0.00 O
+ATOM 1912 CB ALA A 127 1.003 0.658 -19.102 1.00 0.00 C
+ATOM 1913 H ALA A 127 3.186 1.324 -20.241 1.00 0.00 H
+ATOM 1914 HA ALA A 127 2.044 1.835 -17.665 1.00 0.00 H
+ATOM 1915 1HB ALA A 127 0.208 0.372 -18.414 1.00 0.00 H
+ATOM 1916 2HB ALA A 127 0.690 1.531 -19.675 1.00 0.00 H
+ATOM 1917 3HB ALA A 127 1.208 -0.167 -19.781 1.00 0.00 H
+ATOM 1918 N LEU A 128 3.330 -1.200 -18.064 1.00 0.00 N
+ATOM 1919 CA LEU A 128 3.844 -2.392 -17.327 1.00 0.00 C
+ATOM 1920 C LEU A 128 4.908 -1.962 -16.301 1.00 0.00 C
+ATOM 1921 O LEU A 128 4.883 -2.492 -15.172 1.00 0.00 O
+ATOM 1922 CB LEU A 128 4.447 -3.415 -18.298 1.00 0.00 C
+ATOM 1923 CG LEU A 128 3.445 -4.146 -19.201 1.00 0.00 C
+ATOM 1924 CD1 LEU A 128 4.196 -4.874 -20.308 1.00 0.00 C
+ATOM 1925 CD2 LEU A 128 2.626 -5.119 -18.366 1.00 0.00 C
+ATOM 1926 H LEU A 128 3.466 -1.142 -19.063 1.00 0.00 H
+ATOM 1927 HA LEU A 128 3.018 -2.845 -16.780 1.00 0.00 H
+ATOM 1928 1HB LEU A 128 5.161 -2.904 -18.942 1.00 0.00 H
+ATOM 1929 2HB LEU A 128 4.984 -4.168 -17.721 1.00 0.00 H
+ATOM 1930 HG LEU A 128 2.781 -3.420 -19.669 1.00 0.00 H
+ATOM 1931 1HD1 LEU A 128 3.484 -5.393 -20.949 1.00 0.00 H
+ATOM 1932 2HD1 LEU A 128 4.758 -4.152 -20.901 1.00 0.00 H
+ATOM 1933 3HD1 LEU A 128 4.882 -5.596 -19.868 1.00 0.00 H
+ATOM 1934 1HD2 LEU A 128 1.913 -5.638 -19.007 1.00 0.00 H
+ATOM 1935 2HD2 LEU A 128 3.289 -5.846 -17.897 1.00 0.00 H
+ATOM 1936 3HD2 LEU A 128 2.086 -4.570 -17.593 1.00 0.00 H
+ATOM 1937 N GLY A 129 5.796 -1.030 -16.663 1.00 0.00 N
+ATOM 1938 CA GLY A 129 6.815 -0.459 -15.757 1.00 0.00 C
+ATOM 1939 C GLY A 129 6.183 0.262 -14.582 1.00 0.00 C
+ATOM 1940 O GLY A 129 6.564 -0.036 -13.446 1.00 0.00 O
+ATOM 1941 H GLY A 129 5.753 -0.707 -17.619 1.00 0.00 H
+ATOM 1942 1HA GLY A 129 7.461 -1.256 -15.387 1.00 0.00 H
+ATOM 1943 2HA GLY A 129 7.446 0.236 -16.311 1.00 0.00 H
+ATOM 1944 N LYS A 130 5.223 1.155 -14.845 1.00 0.00 N
+ATOM 1945 CA LYS A 130 4.517 1.954 -13.802 1.00 0.00 C
+ATOM 1946 C LYS A 130 3.772 1.018 -12.836 1.00 0.00 C
+ATOM 1947 O LYS A 130 3.874 1.255 -11.626 1.00 0.00 O
+ATOM 1948 CB LYS A 130 3.628 3.000 -14.471 1.00 0.00 C
+ATOM 1949 CG LYS A 130 4.416 4.116 -15.139 1.00 0.00 C
+ATOM 1950 CD LYS A 130 3.573 5.128 -15.876 1.00 0.00 C
+ATOM 1951 CE LYS A 130 4.417 6.160 -16.596 1.00 0.00 C
+ATOM 1952 NZ LYS A 130 3.576 7.128 -17.339 1.00 0.00 N
+ATOM 1953 H LYS A 130 4.973 1.281 -15.816 1.00 0.00 H
+ATOM 1954 HA LYS A 130 5.264 2.461 -13.191 1.00 0.00 H
+ATOM 1955 1HB LYS A 130 3.003 2.518 -15.225 1.00 0.00 H
+ATOM 1956 2HB LYS A 130 2.964 3.442 -13.729 1.00 0.00 H
+ATOM 1957 1HG LYS A 130 4.988 4.658 -14.386 1.00 0.00 H
+ATOM 1958 2HG LYS A 130 5.112 3.688 -15.861 1.00 0.00 H
+ATOM 1959 1HD LYS A 130 2.948 4.618 -16.611 1.00 0.00 H
+ATOM 1960 2HD LYS A 130 2.924 5.646 -15.168 1.00 0.00 H
+ATOM 1961 1HE LYS A 130 5.027 6.700 -15.873 1.00 0.00 H
+ATOM 1962 2HE LYS A 130 5.085 5.659 -17.298 1.00 0.00 H
+ATOM 1963 1HZ LYS A 130 4.168 7.800 -17.808 1.00 0.00 H
+ATOM 1964 2HZ LYS A 130 3.019 6.636 -18.023 1.00 0.00 H
+ATOM 1965 3HZ LYS A 130 2.967 7.609 -16.694 1.00 0.00 H
+ATOM 1966 N LEU A 131 3.089 -0.022 -13.328 1.00 0.00 N
+ATOM 1967 CA LEU A 131 2.390 -1.005 -12.457 1.00 0.00 C
+ATOM 1968 C LEU A 131 3.418 -1.756 -11.591 1.00 0.00 C
+ATOM 1969 O LEU A 131 3.204 -1.856 -10.354 1.00 0.00 O
+ATOM 1970 CB LEU A 131 1.586 -2.004 -13.298 1.00 0.00 C
+ATOM 1971 CG LEU A 131 0.285 -1.467 -13.909 1.00 0.00 C
+ATOM 1972 CD1 LEU A 131 -0.228 -2.445 -14.956 1.00 0.00 C
+ATOM 1973 CD2 LEU A 131 -0.743 -1.257 -12.806 1.00 0.00 C
+ATOM 1974 H LEU A 131 3.050 -0.138 -14.331 1.00 0.00 H
+ATOM 1975 HA LEU A 131 1.749 -0.459 -11.765 1.00 0.00 H
+ATOM 1976 1HB LEU A 131 2.214 -2.354 -14.116 1.00 0.00 H
+ATOM 1977 2HB LEU A 131 1.330 -2.859 -12.673 1.00 0.00 H
+ATOM 1978 HG LEU A 131 0.481 -0.517 -14.406 1.00 0.00 H
+ATOM 1979 1HD1 LEU A 131 -1.152 -2.062 -15.389 1.00 0.00 H
+ATOM 1980 2HD1 LEU A 131 0.519 -2.561 -15.742 1.00 0.00 H
+ATOM 1981 3HD1 LEU A 131 -0.419 -3.411 -14.490 1.00 0.00 H
+ATOM 1982 1HD2 LEU A 131 -1.667 -0.873 -13.239 1.00 0.00 H
+ATOM 1983 2HD2 LEU A 131 -0.942 -2.206 -12.308 1.00 0.00 H
+ATOM 1984 3HD2 LEU A 131 -0.358 -0.540 -12.081 1.00 0.00 H
+ATOM 1985 N GLN A 132 4.530 -2.206 -12.180 1.00 0.00 N
+ATOM 1986 CA GLN A 132 5.573 -2.961 -11.437 1.00 0.00 C
+ATOM 1987 C GLN A 132 6.174 -2.056 -10.360 1.00 0.00 C
+ATOM 1988 O GLN A 132 6.377 -2.556 -9.237 1.00 0.00 O
+ATOM 1989 CB GLN A 132 6.672 -3.467 -12.375 1.00 0.00 C
+ATOM 1990 CG GLN A 132 7.767 -4.259 -11.681 1.00 0.00 C
+ATOM 1991 CD GLN A 132 7.241 -5.523 -11.028 1.00 0.00 C
+ATOM 1992 OE1 GLN A 132 6.172 -6.025 -11.387 1.00 0.00 O
+ATOM 1993 NE2 GLN A 132 7.989 -6.046 -10.064 1.00 0.00 N
+ATOM 1994 H GLN A 132 4.662 -2.021 -13.164 1.00 0.00 H
+ATOM 1995 HA GLN A 132 5.101 -3.816 -10.952 1.00 0.00 H
+ATOM 1996 1HB GLN A 132 6.232 -4.103 -13.143 1.00 0.00 H
+ATOM 1997 2HB GLN A 132 7.138 -2.620 -12.879 1.00 0.00 H
+ATOM 1998 1HG GLN A 132 8.519 -4.543 -12.418 1.00 0.00 H
+ATOM 1999 2HG GLN A 132 8.217 -3.637 -10.908 1.00 0.00 H
+ATOM 2000 1HE2 GLN A 132 7.693 -6.880 -9.596 1.00 0.00 H
+ATOM 2001 2HE2 GLN A 132 8.849 -5.606 -9.804 1.00 0.00 H
+ATOM 2002 N ASP A 133 6.441 -0.785 -10.692 1.00 0.00 N
+ATOM 2003 CA ASP A 133 7.058 0.206 -9.764 1.00 0.00 C
+ATOM 2004 C ASP A 133 6.161 0.370 -8.529 1.00 0.00 C
+ATOM 2005 O ASP A 133 6.686 0.328 -7.400 1.00 0.00 O
+ATOM 2006 CB ASP A 133 7.258 1.562 -10.446 1.00 0.00 C
+ATOM 2007 CG ASP A 133 8.414 1.562 -11.437 1.00 0.00 C
+ATOM 2008 OD1 ASP A 133 9.187 0.633 -11.418 1.00 0.00 O
+ATOM 2009 OD2 ASP A 133 8.512 2.490 -12.203 1.00 0.00 O
+ATOM 2010 H ASP A 133 6.201 -0.499 -11.631 1.00 0.00 H
+ATOM 2011 HA ASP A 133 8.017 -0.187 -9.426 1.00 0.00 H
+ATOM 2012 1HB ASP A 133 6.346 1.841 -10.974 1.00 0.00 H
+ATOM 2013 2HB ASP A 133 7.446 2.325 -9.690 1.00 0.00 H
+ATOM 2014 N VAL A 134 4.851 0.526 -8.728 1.00 0.00 N
+ATOM 2015 CA VAL A 134 3.899 0.714 -7.600 1.00 0.00 C
+ATOM 2016 C VAL A 134 3.821 -0.580 -6.796 1.00 0.00 C
+ATOM 2017 O VAL A 134 3.843 -0.488 -5.546 1.00 0.00 O
+ATOM 2018 CB VAL A 134 2.495 1.090 -8.109 1.00 0.00 C
+ATOM 2019 CG1 VAL A 134 1.491 1.064 -6.966 1.00 0.00 C
+ATOM 2020 CG2 VAL A 134 2.532 2.461 -8.765 1.00 0.00 C
+ATOM 2021 H VAL A 134 4.494 0.515 -9.674 1.00 0.00 H
+ATOM 2022 HA VAL A 134 4.301 1.478 -6.933 1.00 0.00 H
+ATOM 2023 HB VAL A 134 2.172 0.345 -8.837 1.00 0.00 H
+ATOM 2024 1HG1 VAL A 134 0.503 1.332 -7.344 1.00 0.00 H
+ATOM 2025 2HG1 VAL A 134 1.454 0.064 -6.536 1.00 0.00 H
+ATOM 2026 3HG1 VAL A 134 1.791 1.780 -6.202 1.00 0.00 H
+ATOM 2027 1HG2 VAL A 134 1.536 2.720 -9.123 1.00 0.00 H
+ATOM 2028 2HG2 VAL A 134 2.861 3.203 -8.038 1.00 0.00 H
+ATOM 2029 3HG2 VAL A 134 3.225 2.444 -9.606 1.00 0.00 H
+ATOM 2030 N VAL A 135 3.739 -1.738 -7.460 1.00 0.00 N
+ATOM 2031 CA VAL A 135 3.600 -3.047 -6.750 1.00 0.00 C
+ATOM 2032 C VAL A 135 4.823 -3.223 -5.848 1.00 0.00 C
+ATOM 2033 O VAL A 135 4.620 -3.610 -4.683 1.00 0.00 O
+ATOM 2034 CB VAL A 135 3.512 -4.224 -7.740 1.00 0.00 C
+ATOM 2035 CG1 VAL A 135 3.683 -5.548 -7.010 1.00 0.00 C
+ATOM 2036 CG2 VAL A 135 2.181 -4.182 -8.477 1.00 0.00 C
+ATOM 2037 H VAL A 135 3.772 -1.726 -8.470 1.00 0.00 H
+ATOM 2038 HA VAL A 135 2.714 -3.006 -6.117 1.00 0.00 H
+ATOM 2039 HB VAL A 135 4.328 -4.145 -8.458 1.00 0.00 H
+ATOM 2040 1HG1 VAL A 135 3.617 -6.369 -7.725 1.00 0.00 H
+ATOM 2041 2HG1 VAL A 135 4.656 -5.570 -6.521 1.00 0.00 H
+ATOM 2042 3HG1 VAL A 135 2.897 -5.655 -6.263 1.00 0.00 H
+ATOM 2043 1HG2 VAL A 135 2.126 -5.016 -9.175 1.00 0.00 H
+ATOM 2044 2HG2 VAL A 135 1.365 -4.255 -7.758 1.00 0.00 H
+ATOM 2045 3HG2 VAL A 135 2.099 -3.243 -9.025 1.00 0.00 H
+ATOM 2046 N ASN A 136 6.020 -2.890 -6.356 1.00 0.00 N
+ATOM 2047 CA ASN A 136 7.302 -2.949 -5.596 1.00 0.00 C
+ATOM 2048 C ASN A 136 7.245 -1.979 -4.402 1.00 0.00 C
+ATOM 2049 O ASN A 136 7.663 -2.403 -3.305 1.00 0.00 O
+ATOM 2050 CB ASN A 136 8.487 -2.631 -6.489 1.00 0.00 C
+ATOM 2051 CG ASN A 136 8.850 -3.775 -7.395 1.00 0.00 C
+ATOM 2052 OD1 ASN A 136 8.391 -4.907 -7.201 1.00 0.00 O
+ATOM 2053 ND2 ASN A 136 9.666 -3.503 -8.381 1.00 0.00 N
+ATOM 2054 H ASN A 136 6.032 -2.583 -7.317 1.00 0.00 H
+ATOM 2055 HA ASN A 136 7.379 -3.930 -5.123 1.00 0.00 H
+ATOM 2056 1HB ASN A 136 8.258 -1.758 -7.100 1.00 0.00 H
+ATOM 2057 2HB ASN A 136 9.351 -2.383 -5.873 1.00 0.00 H
+ATOM 2058 1HD2 ASN A 136 9.943 -4.225 -9.015 1.00 0.00 H
+ATOM 2059 2HD2 ASN A 136 10.013 -2.573 -8.500 1.00 0.00 H
+ATOM 2060 N GLN A 137 6.722 -0.757 -4.577 1.00 0.00 N
+ATOM 2061 CA GLN A 137 6.587 0.240 -3.478 1.00 0.00 C
+ATOM 2062 C GLN A 137 5.600 -0.264 -2.434 1.00 0.00 C
+ATOM 2063 O GLN A 137 5.862 -0.056 -1.249 1.00 0.00 O
+ATOM 2064 CB GLN A 137 6.059 1.585 -3.957 1.00 0.00 C
+ATOM 2065 CG GLN A 137 7.077 2.361 -4.770 1.00 0.00 C
+ATOM 2066 CD GLN A 137 6.495 3.607 -5.393 1.00 0.00 C
+ATOM 2067 OE1 GLN A 137 5.506 4.164 -4.917 1.00 0.00 O
+ATOM 2068 NE2 GLN A 137 7.116 4.054 -6.476 1.00 0.00 N
+ATOM 2069 H GLN A 137 6.406 -0.512 -5.505 1.00 0.00 H
+ATOM 2070 HA GLN A 137 7.572 0.412 -3.043 1.00 0.00 H
+ATOM 2071 1HB GLN A 137 5.169 1.430 -4.568 1.00 0.00 H
+ATOM 2072 2HB GLN A 137 5.765 2.188 -3.098 1.00 0.00 H
+ATOM 2073 1HG GLN A 137 7.897 2.661 -4.117 1.00 0.00 H
+ATOM 2074 2HG GLN A 137 7.451 1.724 -5.570 1.00 0.00 H
+ATOM 2075 1HE2 GLN A 137 6.783 4.875 -6.940 1.00 0.00 H
+ATOM 2076 2HE2 GLN A 137 7.917 3.571 -6.828 1.00 0.00 H
+ATOM 2077 N ASN A 138 4.503 -0.875 -2.876 1.00 0.00 N
+ATOM 2078 CA ASN A 138 3.460 -1.416 -1.973 1.00 0.00 C
+ATOM 2079 C ASN A 138 4.048 -2.631 -1.245 1.00 0.00 C
+ATOM 2080 O ASN A 138 3.788 -2.780 -0.025 1.00 0.00 O
+ATOM 2081 CB ASN A 138 2.197 -1.787 -2.731 1.00 0.00 C
+ATOM 2082 CG ASN A 138 1.425 -0.583 -3.191 1.00 0.00 C
+ATOM 2083 OD1 ASN A 138 1.651 0.535 -2.714 1.00 0.00 O
+ATOM 2084 ND2 ASN A 138 0.516 -0.788 -4.110 1.00 0.00 N
+ATOM 2085 H ASN A 138 4.387 -0.969 -3.875 1.00 0.00 H
+ATOM 2086 HA ASN A 138 3.271 -0.686 -1.184 1.00 0.00 H
+ATOM 2087 1HB ASN A 138 2.458 -2.392 -3.601 1.00 0.00 H
+ATOM 2088 2HB ASN A 138 1.555 -2.394 -2.092 1.00 0.00 H
+ATOM 2089 1HD2 ASN A 138 -0.027 -0.022 -4.456 1.00 0.00 H
+ATOM 2090 2HD2 ASN A 138 0.366 -1.709 -4.469 1.00 0.00 H
+ATOM 2091 N ALA A 139 4.862 -3.434 -1.939 1.00 0.00 N
+ATOM 2092 CA ALA A 139 5.486 -4.653 -1.379 1.00 0.00 C
+ATOM 2093 C ALA A 139 6.420 -4.250 -0.237 1.00 0.00 C
+ATOM 2094 O ALA A 139 6.457 -4.957 0.769 1.00 0.00 O
+ATOM 2095 CB ALA A 139 6.213 -5.416 -2.449 1.00 0.00 C
+ATOM 2096 H ALA A 139 5.053 -3.179 -2.899 1.00 0.00 H
+ATOM 2097 HA ALA A 139 4.693 -5.285 -0.976 1.00 0.00 H
+ATOM 2098 1HB ALA A 139 6.665 -6.308 -2.017 1.00 0.00 H
+ATOM 2099 2HB ALA A 139 5.510 -5.706 -3.231 1.00 0.00 H
+ATOM 2100 3HB ALA A 139 6.991 -4.788 -2.878 1.00 0.00 H
+ATOM 2101 N GLN A 140 7.126 -3.129 -0.381 1.00 0.00 N
+ATOM 2102 CA GLN A 140 8.075 -2.618 0.647 1.00 0.00 C
+ATOM 2103 C GLN A 140 7.294 -1.946 1.786 1.00 0.00 C
+ATOM 2104 O GLN A 140 7.734 -2.041 2.953 1.00 0.00 O
+ATOM 2105 CB GLN A 140 9.086 -1.673 -0.000 1.00 0.00 C
+ATOM 2106 CG GLN A 140 10.058 -2.398 -0.923 1.00 0.00 C
+ATOM 2107 CD GLN A 140 11.084 -1.481 -1.545 1.00 0.00 C
+ATOM 2108 OE1 GLN A 140 11.476 -0.467 -0.965 1.00 0.00 O
+ATOM 2109 NE2 GLN A 140 11.543 -1.851 -2.732 1.00 0.00 N
+ATOM 2110 H GLN A 140 7.003 -2.609 -1.238 1.00 0.00 H
+ATOM 2111 HA GLN A 140 8.609 -3.464 1.078 1.00 0.00 H
+ATOM 2112 1HB GLN A 140 8.557 -0.912 -0.574 1.00 0.00 H
+ATOM 2113 2HB GLN A 140 9.654 -1.161 0.776 1.00 0.00 H
+ATOM 2114 1HG GLN A 140 10.591 -3.156 -0.350 1.00 0.00 H
+ATOM 2115 2HG GLN A 140 9.496 -2.866 -1.731 1.00 0.00 H
+ATOM 2116 1HE2 GLN A 140 12.225 -1.291 -3.203 1.00 0.00 H
+ATOM 2117 2HE2 GLN A 140 11.206 -2.691 -3.159 1.00 0.00 H
+ATOM 2118 N ALA A 141 6.175 -1.289 1.467 1.00 0.00 N
+ATOM 2119 CA ALA A 141 5.322 -0.612 2.465 1.00 0.00 C
+ATOM 2120 C ALA A 141 4.722 -1.663 3.391 1.00 0.00 C
+ATOM 2121 O ALA A 141 4.619 -1.371 4.581 1.00 0.00 O
+ATOM 2122 CB ALA A 141 4.251 0.200 1.803 1.00 0.00 C
+ATOM 2123 H ALA A 141 5.909 -1.260 0.493 1.00 0.00 H
+ATOM 2124 HA ALA A 141 5.953 0.059 3.049 1.00 0.00 H
+ATOM 2125 1HB ALA A 141 3.641 0.686 2.564 1.00 0.00 H
+ATOM 2126 2HB ALA A 141 4.709 0.957 1.167 1.00 0.00 H
+ATOM 2127 3HB ALA A 141 3.624 -0.451 1.197 1.00 0.00 H
+ATOM 2128 N LEU A 142 4.363 -2.841 2.868 1.00 0.00 N
+ATOM 2129 CA LEU A 142 3.749 -3.939 3.666 1.00 0.00 C
+ATOM 2130 C LEU A 142 4.813 -4.605 4.552 1.00 0.00 C
+ATOM 2131 O LEU A 142 4.548 -4.799 5.748 1.00 0.00 O
+ATOM 2132 OXT LEU A 142 5.871 -4.924 4.085 1.00 0.00 O
+ATOM 2133 CB LEU A 142 3.109 -4.989 2.748 1.00 0.00 C
+ATOM 2134 CG LEU A 142 2.490 -6.202 3.454 1.00 0.00 C
+ATOM 2135 CD1 LEU A 142 1.303 -5.750 4.293 1.00 0.00 C
+ATOM 2136 CD2 LEU A 142 2.068 -7.232 2.418 1.00 0.00 C
+ATOM 2137 H LEU A 142 4.521 -2.981 1.880 1.00 0.00 H
+ATOM 2138 HA LEU A 142 2.986 -3.509 4.314 1.00 0.00 H
+ATOM 2139 1HB LEU A 142 2.324 -4.508 2.166 1.00 0.00 H
+ATOM 2140 2HB LEU A 142 3.869 -5.357 2.059 1.00 0.00 H
+ATOM 2141 HG LEU A 142 3.225 -6.644 4.128 1.00 0.00 H
+ATOM 2142 1HD1 LEU A 142 0.864 -6.612 4.796 1.00 0.00 H
+ATOM 2143 2HD1 LEU A 142 1.637 -5.028 5.039 1.00 0.00 H
+ATOM 2144 3HD1 LEU A 142 0.557 -5.287 3.648 1.00 0.00 H
+ATOM 2145 1HD2 LEU A 142 1.629 -8.094 2.920 1.00 0.00 H
+ATOM 2146 2HD2 LEU A 142 1.332 -6.790 1.745 1.00 0.00 H
+ATOM 2147 3HD2 LEU A 142 2.939 -7.550 1.845 1.00 0.00 H
+TER
+ATOM 2149 N ASP B 143 28.362 -12.788 -40.316 1.00 0.00 N
+ATOM 2150 CA ASP B 143 29.054 -13.139 -39.082 1.00 0.00 C
+ATOM 2151 C ASP B 143 28.791 -12.108 -37.991 1.00 0.00 C
+ATOM 2152 O ASP B 143 28.286 -12.440 -36.919 1.00 0.00 O
+ATOM 2153 CB ASP B 143 30.560 -13.258 -39.327 1.00 0.00 C
+ATOM 2154 CG ASP B 143 31.139 -12.053 -40.057 1.00 0.00 C
+ATOM 2155 OD1 ASP B 143 30.375 -11.267 -40.564 1.00 0.00 O
+ATOM 2156 OD2 ASP B 143 32.340 -11.931 -40.099 1.00 0.00 O
+ATOM 2157 1H ASP B 143 28.552 -13.480 -41.013 1.00 0.00 H
+ATOM 2158 2H ASP B 143 27.377 -12.748 -40.146 1.00 0.00 H
+ATOM 2159 3H ASP B 143 28.682 -11.897 -40.637 1.00 0.00 H
+ATOM 2160 HA ASP B 143 28.682 -14.104 -38.738 1.00 0.00 H
+ATOM 2161 1HB ASP B 143 31.077 -13.369 -38.373 1.00 0.00 H
+ATOM 2162 2HB ASP B 143 30.764 -14.153 -39.916 1.00 0.00 H
+ATOM 2163 N GLU B 144 29.137 -10.857 -38.271 1.00 0.00 N
+ATOM 2164 CA GLU B 144 29.029 -9.791 -37.281 1.00 0.00 C
+ATOM 2165 C GLU B 144 27.580 -9.571 -36.866 1.00 0.00 C
+ATOM 2166 O GLU B 144 27.293 -9.299 -35.700 1.00 0.00 O
+ATOM 2167 CB GLU B 144 29.615 -8.489 -37.832 1.00 0.00 C
+ATOM 2168 CG GLU B 144 31.131 -8.492 -37.972 1.00 0.00 C
+ATOM 2169 CD GLU B 144 31.676 -7.180 -38.462 1.00 0.00 C
+ATOM 2170 OE1 GLU B 144 30.895 -6.330 -38.819 1.00 0.00 O
+ATOM 2171 OE2 GLU B 144 32.874 -7.026 -38.481 1.00 0.00 O
+ATOM 2172 H GLU B 144 29.485 -10.636 -39.194 1.00 0.00 H
+ATOM 2173 HA GLU B 144 29.595 -10.084 -36.396 1.00 0.00 H
+ATOM 2174 1HB GLU B 144 29.189 -8.285 -38.815 1.00 0.00 H
+ATOM 2175 2HB GLU B 144 29.341 -7.661 -37.178 1.00 0.00 H
+ATOM 2176 1HG GLU B 144 31.575 -8.717 -37.003 1.00 0.00 H
+ATOM 2177 2HG GLU B 144 31.420 -9.282 -38.665 1.00 0.00 H
+ATOM 2178 N GLU B 145 26.670 -9.688 -37.827 1.00 0.00 N
+ATOM 2179 CA GLU B 145 25.254 -9.456 -37.573 1.00 0.00 C
+ATOM 2180 C GLU B 145 24.678 -10.521 -36.648 1.00 0.00 C
+ATOM 2181 O GLU B 145 23.926 -10.214 -35.723 1.00 0.00 O
+ATOM 2182 CB GLU B 145 24.474 -9.435 -38.890 1.00 0.00 C
+ATOM 2183 CG GLU B 145 24.807 -8.260 -39.798 1.00 0.00 C
+ATOM 2184 CD GLU B 145 26.082 -8.459 -40.569 1.00 0.00 C
+ATOM 2185 OE1 GLU B 145 26.656 -9.517 -40.468 1.00 0.00 O
+ATOM 2186 OE2 GLU B 145 26.483 -7.552 -41.260 1.00 0.00 O
+ATOM 2187 H GLU B 145 26.968 -9.945 -38.757 1.00 0.00 H
+ATOM 2188 HA GLU B 145 25.143 -8.488 -37.085 1.00 0.00 H
+ATOM 2189 1HB GLU B 145 24.670 -10.352 -39.444 1.00 0.00 H
+ATOM 2190 2HB GLU B 145 23.405 -9.402 -38.679 1.00 0.00 H
+ATOM 2191 1HG GLU B 145 23.988 -8.116 -40.503 1.00 0.00 H
+ATOM 2192 2HG GLU B 145 24.891 -7.358 -39.193 1.00 0.00 H
+ATOM 2193 N GLU B 146 25.036 -11.775 -36.903 1.00 0.00 N
+ATOM 2194 CA GLU B 146 24.569 -12.887 -36.083 1.00 0.00 C
+ATOM 2195 C GLU B 146 25.093 -12.779 -34.656 1.00 0.00 C
+ATOM 2196 O GLU B 146 24.366 -13.035 -33.697 1.00 0.00 O
+ATOM 2197 CB GLU B 146 25.002 -14.221 -36.696 1.00 0.00 C
+ATOM 2198 CG GLU B 146 24.339 -14.545 -38.027 1.00 0.00 C
+ATOM 2199 CD GLU B 146 24.989 -13.849 -39.190 1.00 0.00 C
+ATOM 2200 OE1 GLU B 146 25.976 -13.186 -38.984 1.00 0.00 O
+ATOM 2201 OE2 GLU B 146 24.497 -13.981 -40.286 1.00 0.00 O
+ATOM 2202 H GLU B 146 25.648 -11.963 -37.684 1.00 0.00 H
+ATOM 2203 HA GLU B 146 23.480 -12.857 -36.048 1.00 0.00 H
+ATOM 2204 1HB GLU B 146 26.081 -14.216 -36.852 1.00 0.00 H
+ATOM 2205 2HB GLU B 146 24.776 -15.030 -36.002 1.00 0.00 H
+ATOM 2206 1HG GLU B 146 24.386 -15.623 -38.190 1.00 0.00 H
+ATOM 2207 2HG GLU B 146 23.289 -14.258 -37.977 1.00 0.00 H
+ATOM 2208 N GLU B 147 26.359 -12.398 -34.524 1.00 0.00 N
+ATOM 2209 CA GLU B 147 26.973 -12.219 -33.214 1.00 0.00 C
+ATOM 2210 C GLU B 147 26.286 -11.108 -32.431 1.00 0.00 C
+ATOM 2211 O GLU B 147 26.031 -11.246 -31.234 1.00 0.00 O
+ATOM 2212 CB GLU B 147 28.464 -11.906 -33.362 1.00 0.00 C
+ATOM 2213 CG GLU B 147 29.312 -13.086 -33.817 1.00 0.00 C
+ATOM 2214 CD GLU B 147 30.751 -12.717 -34.048 1.00 0.00 C
+ATOM 2215 OE1 GLU B 147 31.067 -11.554 -33.965 1.00 0.00 O
+ATOM 2216 OE2 GLU B 147 31.535 -13.599 -34.309 1.00 0.00 O
+ATOM 2217 H GLU B 147 26.911 -12.228 -35.353 1.00 0.00 H
+ATOM 2218 HA GLU B 147 26.865 -13.147 -32.652 1.00 0.00 H
+ATOM 2219 1HB GLU B 147 28.596 -11.100 -34.084 1.00 0.00 H
+ATOM 2220 2HB GLU B 147 28.859 -11.559 -32.407 1.00 0.00 H
+ATOM 2221 1HG GLU B 147 29.266 -13.867 -33.059 1.00 0.00 H
+ATOM 2222 2HG GLU B 147 28.892 -13.487 -34.739 1.00 0.00 H
+ATOM 2223 N CYS B 148 25.988 -10.008 -33.113 1.00 0.00 N
+ATOM 2224 CA CYS B 148 25.282 -8.892 -32.494 1.00 0.00 C
+ATOM 2225 C CYS B 148 23.952 -9.341 -31.903 1.00 0.00 C
+ATOM 2226 O CYS B 148 23.646 -9.050 -30.746 1.00 0.00 O
+ATOM 2227 CB CYS B 148 25.031 -7.782 -33.516 1.00 0.00 C
+ATOM 2228 SG CYS B 148 24.031 -6.412 -32.887 1.00 0.00 S
+ATOM 2229 H CYS B 148 26.257 -9.942 -34.084 1.00 0.00 H
+ATOM 2230 HA CYS B 148 25.902 -8.492 -31.692 1.00 0.00 H
+ATOM 2231 1HB CYS B 148 25.984 -7.376 -33.854 1.00 0.00 H
+ATOM 2232 2HB CYS B 148 24.524 -8.197 -34.387 1.00 0.00 H
+ATOM 2233 N GLU B 149 23.164 -10.051 -32.702 1.00 0.00 N
+ATOM 2234 CA GLU B 149 21.845 -10.504 -32.274 1.00 0.00 C
+ATOM 2235 C GLU B 149 21.944 -11.410 -31.053 1.00 0.00 C
+ATOM 2236 O GLU B 149 21.133 -11.317 -30.133 1.00 0.00 O
+ATOM 2237 CB GLU B 149 21.139 -11.242 -33.414 1.00 0.00 C
+ATOM 2238 CG GLU B 149 20.687 -10.346 -34.558 1.00 0.00 C
+ATOM 2239 CD GLU B 149 20.068 -11.114 -35.693 1.00 0.00 C
+ATOM 2240 OE1 GLU B 149 20.086 -12.321 -35.648 1.00 0.00 O
+ATOM 2241 OE2 GLU B 149 19.577 -10.493 -36.606 1.00 0.00 O
+ATOM 2242 H GLU B 149 23.486 -10.284 -33.631 1.00 0.00 H
+ATOM 2243 HA GLU B 149 21.254 -9.632 -31.994 1.00 0.00 H
+ATOM 2244 1HB GLU B 149 21.806 -12.000 -33.825 1.00 0.00 H
+ATOM 2245 2HB GLU B 149 20.260 -11.756 -33.025 1.00 0.00 H
+ATOM 2246 1HG GLU B 149 19.959 -9.630 -34.180 1.00 0.00 H
+ATOM 2247 2HG GLU B 149 21.546 -9.788 -34.929 1.00 0.00 H
+ATOM 2248 N LYS B 150 22.942 -12.287 -31.053 1.00 0.00 N
+ATOM 2249 CA LYS B 150 23.176 -13.182 -29.926 1.00 0.00 C
+ATOM 2250 C LYS B 150 23.550 -12.402 -28.673 1.00 0.00 C
+ATOM 2251 O LYS B 150 23.087 -12.713 -27.575 1.00 0.00 O
+ATOM 2252 CB LYS B 150 24.273 -14.194 -30.264 1.00 0.00 C
+ATOM 2253 CG LYS B 150 23.857 -15.262 -31.266 1.00 0.00 C
+ATOM 2254 CD LYS B 150 25.012 -16.199 -31.587 1.00 0.00 C
+ATOM 2255 CE LYS B 150 24.606 -17.250 -32.609 1.00 0.00 C
+ATOM 2256 NZ LYS B 150 25.735 -18.157 -32.953 1.00 0.00 N
+ATOM 2257 H LYS B 150 23.554 -12.336 -31.855 1.00 0.00 H
+ATOM 2258 HA LYS B 150 22.253 -13.726 -29.718 1.00 0.00 H
+ATOM 2259 1HB LYS B 150 25.138 -13.670 -30.672 1.00 0.00 H
+ATOM 2260 2HB LYS B 150 24.595 -14.698 -29.352 1.00 0.00 H
+ATOM 2261 1HG LYS B 150 23.031 -15.844 -30.856 1.00 0.00 H
+ATOM 2262 2HG LYS B 150 23.521 -14.785 -32.187 1.00 0.00 H
+ATOM 2263 1HD LYS B 150 25.849 -15.622 -31.983 1.00 0.00 H
+ATOM 2264 2HD LYS B 150 25.338 -16.699 -30.675 1.00 0.00 H
+ATOM 2265 1HE LYS B 150 23.786 -17.846 -32.211 1.00 0.00 H
+ATOM 2266 2HE LYS B 150 24.261 -16.759 -33.518 1.00 0.00 H
+ATOM 2267 1HZ LYS B 150 25.426 -18.838 -33.632 1.00 0.00 H
+ATOM 2268 2HZ LYS B 150 26.496 -17.616 -33.341 1.00 0.00 H
+ATOM 2269 3HZ LYS B 150 26.051 -18.632 -32.120 1.00 0.00 H
+ATOM 2270 N ILE B 151 24.389 -11.387 -28.842 1.00 0.00 N
+ATOM 2271 CA ILE B 151 24.829 -10.561 -27.723 1.00 0.00 C
+ATOM 2272 C ILE B 151 23.651 -9.868 -27.053 1.00 0.00 C
+ATOM 2273 O ILE B 151 23.571 -9.805 -25.826 1.00 0.00 O
+ATOM 2274 CB ILE B 151 25.849 -9.505 -28.187 1.00 0.00 C
+ATOM 2275 CG1 ILE B 151 27.178 -10.171 -28.553 1.00 0.00 C
+ATOM 2276 CG2 ILE B 151 26.056 -8.455 -27.107 1.00 0.00 C
+ATOM 2277 CD1 ILE B 151 28.109 -9.283 -29.346 1.00 0.00 C
+ATOM 2278 H ILE B 151 24.731 -11.181 -29.770 1.00 0.00 H
+ATOM 2279 HA ILE B 151 25.302 -11.207 -26.983 1.00 0.00 H
+ATOM 2280 HB ILE B 151 25.482 -9.017 -29.089 1.00 0.00 H
+ATOM 2281 1HG1 ILE B 151 27.693 -10.480 -27.644 1.00 0.00 H
+ATOM 2282 2HG1 ILE B 151 26.985 -11.070 -29.139 1.00 0.00 H
+ATOM 2283 1HG2 ILE B 151 26.781 -7.717 -27.451 1.00 0.00 H
+ATOM 2284 2HG2 ILE B 151 25.109 -7.961 -26.893 1.00 0.00 H
+ATOM 2285 3HG2 ILE B 151 26.429 -8.934 -26.201 1.00 0.00 H
+ATOM 2286 1HD1 ILE B 151 29.028 -9.825 -29.568 1.00 0.00 H
+ATOM 2287 2HD1 ILE B 151 27.626 -8.990 -30.279 1.00 0.00 H
+ATOM 2288 3HD1 ILE B 151 28.344 -8.392 -28.765 1.00 0.00 H
+ATOM 2289 N ILE B 152 22.736 -9.348 -27.865 1.00 0.00 N
+ATOM 2290 CA ILE B 152 21.560 -8.655 -27.351 1.00 0.00 C
+ATOM 2291 C ILE B 152 20.729 -9.569 -26.461 1.00 0.00 C
+ATOM 2292 O ILE B 152 20.322 -9.181 -25.366 1.00 0.00 O
+ATOM 2293 CB ILE B 152 20.687 -8.127 -28.504 1.00 0.00 C
+ATOM 2294 CG1 ILE B 152 21.413 -7.007 -29.254 1.00 0.00 C
+ATOM 2295 CG2 ILE B 152 19.348 -7.636 -27.975 1.00 0.00 C
+ATOM 2296 CD1 ILE B 152 20.767 -6.634 -30.569 1.00 0.00 C
+ATOM 2297 H ILE B 152 22.859 -9.435 -28.864 1.00 0.00 H
+ATOM 2298 HA ILE B 152 21.893 -7.807 -26.755 1.00 0.00 H
+ATOM 2299 HB ILE B 152 20.511 -8.926 -29.224 1.00 0.00 H
+ATOM 2300 1HG1 ILE B 152 21.452 -6.116 -28.628 1.00 0.00 H
+ATOM 2301 2HG1 ILE B 152 22.441 -7.310 -29.454 1.00 0.00 H
+ATOM 2302 1HG2 ILE B 152 18.743 -7.265 -28.803 1.00 0.00 H
+ATOM 2303 2HG2 ILE B 152 18.827 -8.458 -27.485 1.00 0.00 H
+ATOM 2304 3HG2 ILE B 152 19.513 -6.832 -27.258 1.00 0.00 H
+ATOM 2305 1HD1 ILE B 152 21.339 -5.835 -31.042 1.00 0.00 H
+ATOM 2306 2HD1 ILE B 152 20.749 -7.505 -31.226 1.00 0.00 H
+ATOM 2307 3HD1 ILE B 152 19.748 -6.294 -30.390 1.00 0.00 H
+ATOM 2308 N GLU B 153 20.478 -10.783 -26.937 1.00 0.00 N
+ATOM 2309 CA GLU B 153 19.690 -11.754 -26.186 1.00 0.00 C
+ATOM 2310 C GLU B 153 20.394 -12.152 -24.895 1.00 0.00 C
+ATOM 2311 O GLU B 153 19.756 -12.318 -23.854 1.00 0.00 O
+ATOM 2312 CB GLU B 153 19.423 -12.997 -27.038 1.00 0.00 C
+ATOM 2313 CG GLU B 153 18.491 -12.762 -28.218 1.00 0.00 C
+ATOM 2314 CD GLU B 153 17.134 -12.269 -27.803 1.00 0.00 C
+ATOM 2315 OE1 GLU B 153 16.523 -12.897 -26.972 1.00 0.00 O
+ATOM 2316 OE2 GLU B 153 16.707 -11.262 -28.317 1.00 0.00 O
+ATOM 2317 H GLU B 153 20.842 -11.041 -27.843 1.00 0.00 H
+ATOM 2318 HA GLU B 153 18.736 -11.296 -25.925 1.00 0.00 H
+ATOM 2319 1HB GLU B 153 20.366 -13.381 -27.427 1.00 0.00 H
+ATOM 2320 2HB GLU B 153 18.984 -13.777 -26.415 1.00 0.00 H
+ATOM 2321 1HG GLU B 153 18.944 -12.028 -28.884 1.00 0.00 H
+ATOM 2322 2HG GLU B 153 18.381 -13.694 -28.771 1.00 0.00 H
+ATOM 2323 N GLU B 154 21.712 -12.306 -24.968 1.00 0.00 N
+ATOM 2324 CA GLU B 154 22.509 -12.648 -23.796 1.00 0.00 C
+ATOM 2325 C GLU B 154 22.451 -11.543 -22.749 1.00 0.00 C
+ATOM 2326 O GLU B 154 22.352 -11.814 -21.553 1.00 0.00 O
+ATOM 2327 CB GLU B 154 23.963 -12.908 -24.197 1.00 0.00 C
+ATOM 2328 CG GLU B 154 24.186 -14.218 -24.940 1.00 0.00 C
+ATOM 2329 CD GLU B 154 25.604 -14.392 -25.406 1.00 0.00 C
+ATOM 2330 OE1 GLU B 154 26.395 -13.505 -25.188 1.00 0.00 O
+ATOM 2331 OE2 GLU B 154 25.898 -15.414 -25.981 1.00 0.00 O
+ATOM 2332 H GLU B 154 22.173 -12.183 -25.858 1.00 0.00 H
+ATOM 2333 HA GLU B 154 22.099 -13.555 -23.352 1.00 0.00 H
+ATOM 2334 1HB GLU B 154 24.315 -12.097 -24.836 1.00 0.00 H
+ATOM 2335 2HB GLU B 154 24.590 -12.918 -23.306 1.00 0.00 H
+ATOM 2336 1HG GLU B 154 23.928 -15.046 -24.280 1.00 0.00 H
+ATOM 2337 2HG GLU B 154 23.519 -14.253 -25.800 1.00 0.00 H
+ATOM 2338 N LEU B 155 22.516 -10.298 -23.207 1.00 0.00 N
+ATOM 2339 CA LEU B 155 22.447 -9.149 -22.311 1.00 0.00 C
+ATOM 2340 C LEU B 155 21.116 -9.107 -21.570 1.00 0.00 C
+ATOM 2341 O LEU B 155 21.070 -8.816 -20.375 1.00 0.00 O
+ATOM 2342 CB LEU B 155 22.639 -7.849 -23.103 1.00 0.00 C
+ATOM 2343 CG LEU B 155 24.064 -7.579 -23.603 1.00 0.00 C
+ATOM 2344 CD1 LEU B 155 24.039 -6.449 -24.623 1.00 0.00 C
+ATOM 2345 CD2 LEU B 155 24.959 -7.231 -22.423 1.00 0.00 C
+ATOM 2346 H LEU B 155 22.615 -10.143 -24.200 1.00 0.00 H
+ATOM 2347 HA LEU B 155 23.247 -9.234 -21.577 1.00 0.00 H
+ATOM 2348 1HB LEU B 155 21.982 -7.870 -23.970 1.00 0.00 H
+ATOM 2349 2HB LEU B 155 22.346 -7.010 -22.471 1.00 0.00 H
+ATOM 2350 HG LEU B 155 24.450 -8.469 -24.101 1.00 0.00 H
+ATOM 2351 1HD1 LEU B 155 25.052 -6.258 -24.979 1.00 0.00 H
+ATOM 2352 2HD1 LEU B 155 23.408 -6.733 -25.465 1.00 0.00 H
+ATOM 2353 3HD1 LEU B 155 23.642 -5.548 -24.158 1.00 0.00 H
+ATOM 2354 1HD2 LEU B 155 25.972 -7.040 -22.778 1.00 0.00 H
+ATOM 2355 2HD2 LEU B 155 24.576 -6.340 -21.925 1.00 0.00 H
+ATOM 2356 3HD2 LEU B 155 24.973 -8.063 -21.718 1.00 0.00 H
+ATOM 2357 N LEU B 156 20.036 -9.400 -22.286 1.00 0.00 N
+ATOM 2358 CA LEU B 156 18.701 -9.386 -21.701 1.00 0.00 C
+ATOM 2359 C LEU B 156 18.554 -10.466 -20.637 1.00 0.00 C
+ATOM 2360 O LEU B 156 17.945 -10.242 -19.591 1.00 0.00 O
+ATOM 2361 CB LEU B 156 17.642 -9.586 -22.792 1.00 0.00 C
+ATOM 2362 CG LEU B 156 17.505 -8.442 -23.805 1.00 0.00 C
+ATOM 2363 CD1 LEU B 156 16.640 -8.897 -24.972 1.00 0.00 C
+ATOM 2364 CD2 LEU B 156 16.903 -7.225 -23.119 1.00 0.00 C
+ATOM 2365 H LEU B 156 20.142 -9.640 -23.261 1.00 0.00 H
+ATOM 2366 HA LEU B 156 18.541 -8.416 -21.229 1.00 0.00 H
+ATOM 2367 1HB LEU B 156 17.881 -10.492 -23.346 1.00 0.00 H
+ATOM 2368 2HB LEU B 156 16.672 -9.723 -22.314 1.00 0.00 H
+ATOM 2369 HG LEU B 156 18.489 -8.186 -24.199 1.00 0.00 H
+ATOM 2370 1HD1 LEU B 156 16.543 -8.084 -25.692 1.00 0.00 H
+ATOM 2371 2HD1 LEU B 156 17.104 -9.756 -25.456 1.00 0.00 H
+ATOM 2372 3HD1 LEU B 156 15.652 -9.175 -24.605 1.00 0.00 H
+ATOM 2373 1HD2 LEU B 156 16.807 -6.411 -23.838 1.00 0.00 H
+ATOM 2374 2HD2 LEU B 156 15.919 -7.479 -22.725 1.00 0.00 H
+ATOM 2375 3HD2 LEU B 156 17.551 -6.911 -22.300 1.00 0.00 H
+ATOM 2376 N GLU B 157 19.114 -11.638 -20.911 1.00 0.00 N
+ATOM 2377 CA GLU B 157 19.116 -12.732 -19.946 1.00 0.00 C
+ATOM 2378 C GLU B 157 19.987 -12.401 -18.741 1.00 0.00 C
+ATOM 2379 O GLU B 157 19.608 -12.662 -17.599 1.00 0.00 O
+ATOM 2380 CB GLU B 157 19.607 -14.023 -20.604 1.00 0.00 C
+ATOM 2381 CG GLU B 157 18.638 -14.623 -21.613 1.00 0.00 C
+ATOM 2382 CD GLU B 157 19.182 -15.850 -22.290 1.00 0.00 C
+ATOM 2383 OE1 GLU B 157 20.327 -16.167 -22.071 1.00 0.00 O
+ATOM 2384 OE2 GLU B 157 18.453 -16.471 -23.026 1.00 0.00 O
+ATOM 2385 H GLU B 157 19.552 -11.777 -21.812 1.00 0.00 H
+ATOM 2386 HA GLU B 157 18.093 -12.891 -19.601 1.00 0.00 H
+ATOM 2387 1HB GLU B 157 20.550 -13.835 -21.117 1.00 0.00 H
+ATOM 2388 2HB GLU B 157 19.796 -14.774 -19.836 1.00 0.00 H
+ATOM 2389 1HG GLU B 157 17.712 -14.885 -21.101 1.00 0.00 H
+ATOM 2390 2HG GLU B 157 18.404 -13.872 -22.367 1.00 0.00 H
+ATOM 2391 N LYS B 158 21.156 -11.825 -19.001 1.00 0.00 N
+ATOM 2392 CA LYS B 158 22.063 -11.416 -17.937 1.00 0.00 C
+ATOM 2393 C LYS B 158 21.425 -10.357 -17.047 1.00 0.00 C
+ATOM 2394 O LYS B 158 21.640 -10.339 -15.835 1.00 0.00 O
+ATOM 2395 CB LYS B 158 23.374 -10.889 -18.524 1.00 0.00 C
+ATOM 2396 CG LYS B 158 24.290 -11.969 -19.086 1.00 0.00 C
+ATOM 2397 CD LYS B 158 25.505 -11.361 -19.769 1.00 0.00 C
+ATOM 2398 CE LYS B 158 26.421 -12.438 -20.332 1.00 0.00 C
+ATOM 2399 NZ LYS B 158 27.568 -11.857 -21.082 1.00 0.00 N
+ATOM 2400 H LYS B 158 21.423 -11.668 -19.963 1.00 0.00 H
+ATOM 2401 HA LYS B 158 22.289 -12.287 -17.320 1.00 0.00 H
+ATOM 2402 1HB LYS B 158 23.156 -10.184 -19.326 1.00 0.00 H
+ATOM 2403 2HB LYS B 158 23.926 -10.349 -17.754 1.00 0.00 H
+ATOM 2404 1HG LYS B 158 24.625 -12.619 -18.277 1.00 0.00 H
+ATOM 2405 2HG LYS B 158 23.741 -12.572 -19.808 1.00 0.00 H
+ATOM 2406 1HD LYS B 158 25.179 -10.712 -20.583 1.00 0.00 H
+ATOM 2407 2HD LYS B 158 26.065 -10.761 -19.051 1.00 0.00 H
+ATOM 2408 1HE LYS B 158 26.807 -13.049 -19.518 1.00 0.00 H
+ATOM 2409 2HE LYS B 158 25.854 -13.083 -21.004 1.00 0.00 H
+ATOM 2410 1HZ LYS B 158 28.150 -12.602 -21.438 1.00 0.00 H
+ATOM 2411 2HZ LYS B 158 27.222 -11.303 -21.852 1.00 0.00 H
+ATOM 2412 3HZ LYS B 158 28.113 -11.272 -20.464 1.00 0.00 H
+ATOM 2413 N ALA B 159 20.638 -9.475 -17.655 1.00 0.00 N
+ATOM 2414 CA ALA B 159 19.953 -8.422 -16.916 1.00 0.00 C
+ATOM 2415 C ALA B 159 19.232 -8.983 -15.698 1.00 0.00 C
+ATOM 2416 O ALA B 159 19.313 -8.424 -14.604 1.00 0.00 O
+ATOM 2417 CB ALA B 159 18.972 -7.692 -17.821 1.00 0.00 C
+ATOM 2418 H ALA B 159 20.513 -9.537 -18.655 1.00 0.00 H
+ATOM 2419 HA ALA B 159 20.696 -7.701 -16.572 1.00 0.00 H
+ATOM 2420 1HB ALA B 159 18.468 -6.908 -17.255 1.00 0.00 H
+ATOM 2421 2HB ALA B 159 19.511 -7.246 -18.657 1.00 0.00 H
+ATOM 2422 3HB ALA B 159 18.234 -8.396 -18.201 1.00 0.00 H
+ATOM 2423 N ARG B 160 18.527 -10.093 -15.893 1.00 0.00 N
+ATOM 2424 CA ARG B 160 17.786 -10.730 -14.811 1.00 0.00 C
+ATOM 2425 C ARG B 160 18.720 -11.204 -13.706 1.00 0.00 C
+ATOM 2426 O ARG B 160 18.415 -11.070 -12.522 1.00 0.00 O
+ATOM 2427 CB ARG B 160 16.985 -11.913 -15.335 1.00 0.00 C
+ATOM 2428 CG ARG B 160 15.805 -11.545 -16.221 1.00 0.00 C
+ATOM 2429 CD ARG B 160 14.972 -12.730 -16.548 1.00 0.00 C
+ATOM 2430 NE ARG B 160 14.283 -13.248 -15.377 1.00 0.00 N
+ATOM 2431 CZ ARG B 160 13.797 -14.500 -15.267 1.00 0.00 C
+ATOM 2432 NH1 ARG B 160 13.931 -15.347 -16.263 1.00 0.00 N
+ATOM 2433 NH2 ARG B 160 13.185 -14.876 -14.157 1.00 0.00 N
+ATOM 2434 H ARG B 160 18.504 -10.505 -16.815 1.00 0.00 H
+ATOM 2435 HA ARG B 160 17.104 -9.995 -14.379 1.00 0.00 H
+ATOM 2436 1HB ARG B 160 17.638 -12.567 -15.911 1.00 0.00 H
+ATOM 2437 2HB ARG B 160 16.599 -12.492 -14.496 1.00 0.00 H
+ATOM 2438 1HG ARG B 160 15.178 -10.816 -15.707 1.00 0.00 H
+ATOM 2439 2HG ARG B 160 16.171 -11.115 -17.154 1.00 0.00 H
+ATOM 2440 1HD ARG B 160 14.224 -12.456 -17.290 1.00 0.00 H
+ATOM 2441 2HD ARG B 160 15.606 -13.521 -16.948 1.00 0.00 H
+ATOM 2442 HE ARG B 160 14.161 -12.625 -14.590 1.00 0.00 H
+ATOM 2443 1HH1 ARG B 160 14.400 -15.060 -17.111 1.00 0.00 H
+ATOM 2444 2HH1 ARG B 160 13.567 -16.285 -16.180 1.00 0.00 H
+ATOM 2445 1HH2 ARG B 160 13.081 -14.224 -13.392 1.00 0.00 H
+ATOM 2446 2HH2 ARG B 160 12.820 -15.813 -14.075 1.00 0.00 H
+ATOM 2447 N LYS B 161 19.862 -11.757 -14.101 1.00 0.00 N
+ATOM 2448 CA LYS B 161 20.874 -12.191 -13.146 1.00 0.00 C
+ATOM 2449 C LYS B 161 21.483 -11.004 -12.411 1.00 0.00 C
+ATOM 2450 O LYS B 161 22.027 -11.152 -11.317 1.00 0.00 O
+ATOM 2451 CB LYS B 161 21.970 -12.991 -13.853 1.00 0.00 C
+ATOM 2452 CG LYS B 161 21.516 -14.341 -14.392 1.00 0.00 C
+ATOM 2453 CD LYS B 161 22.654 -15.068 -15.090 1.00 0.00 C
+ATOM 2454 CE LYS B 161 22.197 -16.408 -15.647 1.00 0.00 C
+ATOM 2455 NZ LYS B 161 23.295 -17.121 -16.355 1.00 0.00 N
+ATOM 2456 H LYS B 161 20.033 -11.880 -15.089 1.00 0.00 H
+ATOM 2457 HA LYS B 161 20.399 -12.839 -12.409 1.00 0.00 H
+ATOM 2458 1HB LYS B 161 22.361 -12.411 -14.689 1.00 0.00 H
+ATOM 2459 2HB LYS B 161 22.795 -13.167 -13.162 1.00 0.00 H
+ATOM 2460 1HG LYS B 161 21.152 -14.957 -13.569 1.00 0.00 H
+ATOM 2461 2HG LYS B 161 20.701 -14.194 -15.100 1.00 0.00 H
+ATOM 2462 1HD LYS B 161 23.032 -14.454 -15.908 1.00 0.00 H
+ATOM 2463 2HD LYS B 161 23.466 -15.238 -14.383 1.00 0.00 H
+ATOM 2464 1HE LYS B 161 21.838 -17.037 -14.834 1.00 0.00 H
+ATOM 2465 2HE LYS B 161 21.375 -16.250 -16.345 1.00 0.00 H
+ATOM 2466 1HZ LYS B 161 22.952 -18.002 -16.709 1.00 0.00 H
+ATOM 2467 2HZ LYS B 161 23.624 -16.554 -17.125 1.00 0.00 H
+ATOM 2468 3HZ LYS B 161 24.056 -17.290 -15.713 1.00 0.00 H
+ATOM 2469 N LEU B 162 21.386 -9.826 -13.018 1.00 0.00 N
+ATOM 2470 CA LEU B 162 21.974 -8.619 -12.448 1.00 0.00 C
+ATOM 2471 C LEU B 162 20.977 -7.891 -11.555 1.00 0.00 C
+ATOM 2472 O LEU B 162 21.259 -6.801 -11.057 1.00 0.00 O
+ATOM 2473 CB LEU B 162 22.450 -7.681 -13.565 1.00 0.00 C
+ATOM 2474 CG LEU B 162 23.591 -8.214 -14.440 1.00 0.00 C
+ATOM 2475 CD1 LEU B 162 23.775 -7.303 -15.646 1.00 0.00 C
+ATOM 2476 CD2 LEU B 162 24.868 -8.296 -13.616 1.00 0.00 C
+ATOM 2477 H LEU B 162 20.893 -9.764 -13.897 1.00 0.00 H
+ATOM 2478 HA LEU B 162 22.819 -8.909 -11.821 1.00 0.00 H
+ATOM 2479 1HB LEU B 162 21.606 -7.462 -14.217 1.00 0.00 H
+ATOM 2480 2HB LEU B 162 22.786 -6.747 -13.115 1.00 0.00 H
+ATOM 2481 HG LEU B 162 23.333 -9.207 -14.809 1.00 0.00 H
+ATOM 2482 1HD1 LEU B 162 24.586 -7.682 -16.268 1.00 0.00 H
+ATOM 2483 2HD1 LEU B 162 22.853 -7.279 -16.228 1.00 0.00 H
+ATOM 2484 3HD1 LEU B 162 24.018 -6.297 -15.308 1.00 0.00 H
+ATOM 2485 1HD2 LEU B 162 25.679 -8.675 -14.239 1.00 0.00 H
+ATOM 2486 2HD2 LEU B 162 25.127 -7.303 -13.248 1.00 0.00 H
+ATOM 2487 3HD2 LEU B 162 24.713 -8.967 -12.772 1.00 0.00 H
+ATOM 2488 N GLY B 163 19.814 -8.499 -11.357 1.00 0.00 N
+ATOM 2489 CA GLY B 163 18.852 -8.011 -10.375 1.00 0.00 C
+ATOM 2490 C GLY B 163 17.728 -7.231 -11.046 1.00 0.00 C
+ATOM 2491 O GLY B 163 16.932 -6.572 -10.378 1.00 0.00 O
+ATOM 2492 H GLY B 163 19.589 -9.320 -11.901 1.00 0.00 H
+ATOM 2493 1HA GLY B 163 18.435 -8.854 -9.824 1.00 0.00 H
+ATOM 2494 2HA GLY B 163 19.361 -7.374 -9.653 1.00 0.00 H
+ATOM 2495 N VAL B 164 17.669 -7.308 -12.371 1.00 0.00 N
+ATOM 2496 CA VAL B 164 16.592 -6.684 -13.128 1.00 0.00 C
+ATOM 2497 C VAL B 164 15.336 -7.547 -13.115 1.00 0.00 C
+ATOM 2498 O VAL B 164 15.401 -8.757 -13.333 1.00 0.00 O
+ATOM 2499 CB VAL B 164 17.032 -6.444 -14.585 1.00 0.00 C
+ATOM 2500 CG1 VAL B 164 15.883 -5.871 -15.401 1.00 0.00 C
+ATOM 2501 CG2 VAL B 164 18.233 -5.513 -14.616 1.00 0.00 C
+ATOM 2502 H VAL B 164 18.390 -7.813 -12.866 1.00 0.00 H
+ATOM 2503 HA VAL B 164 16.359 -5.722 -12.670 1.00 0.00 H
+ATOM 2504 HB VAL B 164 17.300 -7.400 -15.035 1.00 0.00 H
+ATOM 2505 1HG1 VAL B 164 16.211 -5.708 -16.428 1.00 0.00 H
+ATOM 2506 2HG1 VAL B 164 15.047 -6.570 -15.394 1.00 0.00 H
+ATOM 2507 3HG1 VAL B 164 15.567 -4.922 -14.967 1.00 0.00 H
+ATOM 2508 1HG2 VAL B 164 18.540 -5.349 -15.649 1.00 0.00 H
+ATOM 2509 2HG2 VAL B 164 17.967 -4.559 -14.160 1.00 0.00 H
+ATOM 2510 3HG2 VAL B 164 19.057 -5.962 -14.061 1.00 0.00 H
+ATOM 2511 N SER B 165 14.195 -6.918 -12.858 1.00 0.00 N
+ATOM 2512 CA SER B 165 12.952 -7.648 -12.635 1.00 0.00 C
+ATOM 2513 C SER B 165 12.465 -8.310 -13.917 1.00 0.00 C
+ATOM 2514 O SER B 165 12.899 -7.957 -15.013 1.00 0.00 O
+ATOM 2515 CB SER B 165 11.885 -6.712 -12.101 1.00 0.00 C
+ATOM 2516 OG SER B 165 11.496 -5.786 -13.078 1.00 0.00 O
+ATOM 2517 H SER B 165 14.187 -5.909 -12.816 1.00 0.00 H
+ATOM 2518 HA SER B 165 13.137 -8.429 -11.895 1.00 0.00 H
+ATOM 2519 1HB SER B 165 11.020 -7.292 -11.780 1.00 0.00 H
+ATOM 2520 2HB SER B 165 12.267 -6.185 -11.228 1.00 0.00 H
+ATOM 2521 HG SER B 165 12.167 -5.099 -13.074 1.00 0.00 H
+ATOM 2522 N GLU B 166 11.558 -9.271 -13.773 1.00 0.00 N
+ATOM 2523 CA GLU B 166 11.001 -9.977 -14.920 1.00 0.00 C
+ATOM 2524 C GLU B 166 10.245 -9.025 -15.839 1.00 0.00 C
+ATOM 2525 O GLU B 166 10.288 -9.161 -17.062 1.00 0.00 O
+ATOM 2526 CB GLU B 166 10.070 -11.099 -14.455 1.00 0.00 C
+ATOM 2527 CG GLU B 166 10.783 -12.289 -13.831 1.00 0.00 C
+ATOM 2528 CD GLU B 166 11.312 -11.998 -12.454 1.00 0.00 C
+ATOM 2529 OE1 GLU B 166 10.938 -10.996 -11.894 1.00 0.00 O
+ATOM 2530 OE2 GLU B 166 12.092 -12.779 -11.961 1.00 0.00 O
+ATOM 2531 H GLU B 166 11.247 -9.519 -12.844 1.00 0.00 H
+ATOM 2532 HA GLU B 166 11.822 -10.416 -15.488 1.00 0.00 H
+ATOM 2533 1HB GLU B 166 9.367 -10.707 -13.720 1.00 0.00 H
+ATOM 2534 2HB GLU B 166 9.488 -11.464 -15.302 1.00 0.00 H
+ATOM 2535 1HG GLU B 166 10.088 -13.126 -13.771 1.00 0.00 H
+ATOM 2536 2HG GLU B 166 11.609 -12.584 -14.477 1.00 0.00 H
+ATOM 2537 N ILE B 167 9.552 -8.061 -15.242 1.00 0.00 N
+ATOM 2538 CA ILE B 167 8.778 -7.089 -16.005 1.00 0.00 C
+ATOM 2539 C ILE B 167 9.687 -6.158 -16.796 1.00 0.00 C
+ATOM 2540 O ILE B 167 9.424 -5.860 -17.961 1.00 0.00 O
+ATOM 2541 CB ILE B 167 7.873 -6.258 -15.078 1.00 0.00 C
+ATOM 2542 CG1 ILE B 167 6.926 -7.172 -14.296 1.00 0.00 C
+ATOM 2543 CG2 ILE B 167 7.086 -5.233 -15.881 1.00 0.00 C
+ATOM 2544 CD1 ILE B 167 6.076 -8.065 -15.172 1.00 0.00 C
+ATOM 2545 H ILE B 167 9.563 -7.999 -14.234 1.00 0.00 H
+ATOM 2546 HA ILE B 167 8.146 -7.629 -16.712 1.00 0.00 H
+ATOM 2547 HB ILE B 167 8.485 -5.737 -14.343 1.00 0.00 H
+ATOM 2548 1HG1 ILE B 167 7.504 -7.805 -13.623 1.00 0.00 H
+ATOM 2549 2HG1 ILE B 167 6.260 -6.566 -13.681 1.00 0.00 H
+ATOM 2550 1HG2 ILE B 167 6.451 -4.655 -15.210 1.00 0.00 H
+ATOM 2551 2HG2 ILE B 167 7.777 -4.565 -16.393 1.00 0.00 H
+ATOM 2552 3HG2 ILE B 167 6.465 -5.746 -16.616 1.00 0.00 H
+ATOM 2553 1HD1 ILE B 167 5.432 -8.682 -14.546 1.00 0.00 H
+ATOM 2554 2HD1 ILE B 167 5.462 -7.450 -15.831 1.00 0.00 H
+ATOM 2555 3HD1 ILE B 167 6.721 -8.706 -15.771 1.00 0.00 H
+ATOM 2556 N GLU B 168 10.758 -5.701 -16.156 1.00 0.00 N
+ATOM 2557 CA GLU B 168 11.756 -4.874 -16.826 1.00 0.00 C
+ATOM 2558 C GLU B 168 12.429 -5.635 -17.960 1.00 0.00 C
+ATOM 2559 O GLU B 168 12.733 -5.066 -19.009 1.00 0.00 O
+ATOM 2560 CB GLU B 168 12.810 -4.393 -15.826 1.00 0.00 C
+ATOM 2561 CG GLU B 168 12.329 -3.298 -14.884 1.00 0.00 C
+ATOM 2562 CD GLU B 168 13.274 -3.054 -13.741 1.00 0.00 C
+ATOM 2563 OE1 GLU B 168 13.662 -4.003 -13.102 1.00 0.00 O
+ATOM 2564 OE2 GLU B 168 13.609 -1.917 -13.505 1.00 0.00 O
+ATOM 2565 H GLU B 168 10.883 -5.930 -15.181 1.00 0.00 H
+ATOM 2566 HA GLU B 168 11.247 -4.012 -17.258 1.00 0.00 H
+ATOM 2567 1HB GLU B 168 13.145 -5.234 -15.219 1.00 0.00 H
+ATOM 2568 2HB GLU B 168 13.677 -4.013 -16.366 1.00 0.00 H
+ATOM 2569 1HG GLU B 168 12.213 -2.373 -15.448 1.00 0.00 H
+ATOM 2570 2HG GLU B 168 11.353 -3.576 -14.489 1.00 0.00 H
+ATOM 2571 N TYR B 169 12.660 -6.927 -17.745 1.00 0.00 N
+ATOM 2572 CA TYR B 169 13.163 -7.801 -18.798 1.00 0.00 C
+ATOM 2573 C TYR B 169 12.251 -7.773 -20.017 1.00 0.00 C
+ATOM 2574 O TYR B 169 12.711 -7.591 -21.145 1.00 0.00 O
+ATOM 2575 CB TYR B 169 13.312 -9.233 -18.279 1.00 0.00 C
+ATOM 2576 CG TYR B 169 13.511 -10.260 -19.372 1.00 0.00 C
+ATOM 2577 CD1 TYR B 169 14.772 -10.459 -19.916 1.00 0.00 C
+ATOM 2578 CD2 TYR B 169 12.434 -11.004 -19.830 1.00 0.00 C
+ATOM 2579 CE1 TYR B 169 14.954 -11.397 -20.913 1.00 0.00 C
+ATOM 2580 CE2 TYR B 169 12.616 -11.942 -20.827 1.00 0.00 C
+ATOM 2581 CZ TYR B 169 13.870 -12.139 -21.368 1.00 0.00 C
+ATOM 2582 OH TYR B 169 14.052 -13.073 -22.362 1.00 0.00 O
+ATOM 2583 H TYR B 169 12.484 -7.311 -16.828 1.00 0.00 H
+ATOM 2584 HA TYR B 169 14.149 -7.449 -19.098 1.00 0.00 H
+ATOM 2585 1HB TYR B 169 14.164 -9.288 -17.601 1.00 0.00 H
+ATOM 2586 2HB TYR B 169 12.424 -9.509 -17.712 1.00 0.00 H
+ATOM 2587 HD1 TYR B 169 15.619 -9.874 -19.556 1.00 0.00 H
+ATOM 2588 HD2 TYR B 169 11.443 -10.847 -19.403 1.00 0.00 H
+ATOM 2589 HE1 TYR B 169 15.945 -11.552 -21.340 1.00 0.00 H
+ATOM 2590 HE2 TYR B 169 11.769 -12.526 -21.188 1.00 0.00 H
+ATOM 2591 HH TYR B 169 13.212 -13.495 -22.560 1.00 0.00 H
+ATOM 2592 N TYR B 170 10.955 -7.955 -19.786 1.00 0.00 N
+ATOM 2593 CA TYR B 170 9.974 -7.939 -20.865 1.00 0.00 C
+ATOM 2594 C TYR B 170 9.859 -6.553 -21.484 1.00 0.00 C
+ATOM 2595 O TYR B 170 9.703 -6.416 -22.698 1.00 0.00 O
+ATOM 2596 CB TYR B 170 8.610 -8.408 -20.354 1.00 0.00 C
+ATOM 2597 CG TYR B 170 8.565 -9.875 -19.988 1.00 0.00 C
+ATOM 2598 CD1 TYR B 170 8.219 -10.258 -18.701 1.00 0.00 C
+ATOM 2599 CD2 TYR B 170 8.871 -10.836 -20.940 1.00 0.00 C
+ATOM 2600 CE1 TYR B 170 8.178 -11.598 -18.366 1.00 0.00 C
+ATOM 2601 CE2 TYR B 170 8.831 -12.176 -20.605 1.00 0.00 C
+ATOM 2602 CZ TYR B 170 8.486 -12.558 -19.325 1.00 0.00 C
+ATOM 2603 OH TYR B 170 8.446 -13.892 -18.992 1.00 0.00 O
+ATOM 2604 H TYR B 170 10.642 -8.107 -18.838 1.00 0.00 H
+ATOM 2605 HA TYR B 170 10.307 -8.626 -21.643 1.00 0.00 H
+ATOM 2606 1HB TYR B 170 8.332 -7.828 -19.472 1.00 0.00 H
+ATOM 2607 2HB TYR B 170 7.853 -8.224 -21.117 1.00 0.00 H
+ATOM 2608 HD1 TYR B 170 7.978 -9.502 -17.953 1.00 0.00 H
+ATOM 2609 HD2 TYR B 170 9.144 -10.535 -21.951 1.00 0.00 H
+ATOM 2610 HE1 TYR B 170 7.906 -11.899 -17.355 1.00 0.00 H
+ATOM 2611 HE2 TYR B 170 9.072 -12.932 -21.353 1.00 0.00 H
+ATOM 2612 HH TYR B 170 8.609 -14.421 -19.776 1.00 0.00 H
+ATOM 2613 N ILE B 171 9.935 -5.526 -20.644 1.00 0.00 N
+ATOM 2614 CA ILE B 171 9.867 -4.147 -21.111 1.00 0.00 C
+ATOM 2615 C ILE B 171 10.995 -3.840 -22.088 1.00 0.00 C
+ATOM 2616 O ILE B 171 10.781 -3.200 -23.118 1.00 0.00 O
+ATOM 2617 CB ILE B 171 9.928 -3.163 -19.929 1.00 0.00 C
+ATOM 2618 CG1 ILE B 171 8.605 -3.169 -19.160 1.00 0.00 C
+ATOM 2619 CG2 ILE B 171 10.256 -1.761 -20.420 1.00 0.00 C
+ATOM 2620 CD1 ILE B 171 8.675 -2.475 -17.819 1.00 0.00 C
+ATOM 2621 H ILE B 171 10.043 -5.706 -19.656 1.00 0.00 H
+ATOM 2622 HA ILE B 171 8.920 -4.004 -21.630 1.00 0.00 H
+ATOM 2623 HB ILE B 171 10.701 -3.482 -19.230 1.00 0.00 H
+ATOM 2624 1HG1 ILE B 171 7.835 -2.682 -19.757 1.00 0.00 H
+ATOM 2625 2HG1 ILE B 171 8.286 -4.198 -18.993 1.00 0.00 H
+ATOM 2626 1HG2 ILE B 171 10.295 -1.078 -19.572 1.00 0.00 H
+ATOM 2627 2HG2 ILE B 171 11.221 -1.769 -20.924 1.00 0.00 H
+ATOM 2628 3HG2 ILE B 171 9.485 -1.430 -21.117 1.00 0.00 H
+ATOM 2629 1HD1 ILE B 171 7.699 -2.521 -17.334 1.00 0.00 H
+ATOM 2630 2HD1 ILE B 171 9.416 -2.970 -17.191 1.00 0.00 H
+ATOM 2631 3HD1 ILE B 171 8.958 -1.433 -17.963 1.00 0.00 H
+ATOM 2632 N ALA B 172 12.197 -4.300 -21.759 1.00 0.00 N
+ATOM 2633 CA ALA B 172 13.338 -4.177 -22.659 1.00 0.00 C
+ATOM 2634 C ALA B 172 13.029 -4.777 -24.025 1.00 0.00 C
+ATOM 2635 O ALA B 172 13.316 -4.173 -25.058 1.00 0.00 O
+ATOM 2636 CB ALA B 172 14.565 -4.843 -22.053 1.00 0.00 C
+ATOM 2637 H ALA B 172 12.324 -4.748 -20.862 1.00 0.00 H
+ATOM 2638 HA ALA B 172 13.551 -3.118 -22.804 1.00 0.00 H
+ATOM 2639 1HB ALA B 172 15.408 -4.742 -22.737 1.00 0.00 H
+ATOM 2640 2HB ALA B 172 14.808 -4.364 -21.105 1.00 0.00 H
+ATOM 2641 3HB ALA B 172 14.359 -5.899 -21.884 1.00 0.00 H
+ATOM 2642 N ARG B 173 12.444 -5.970 -24.022 1.00 0.00 N
+ATOM 2643 CA ARG B 173 12.085 -6.651 -25.261 1.00 0.00 C
+ATOM 2644 C ARG B 173 11.019 -5.876 -26.025 1.00 0.00 C
+ATOM 2645 O ARG B 173 11.109 -5.715 -27.242 1.00 0.00 O
+ATOM 2646 CB ARG B 173 11.578 -8.056 -24.972 1.00 0.00 C
+ATOM 2647 CG ARG B 173 12.623 -9.012 -24.420 1.00 0.00 C
+ATOM 2648 CD ARG B 173 12.065 -10.372 -24.206 1.00 0.00 C
+ATOM 2649 NE ARG B 173 11.855 -11.075 -25.462 1.00 0.00 N
+ATOM 2650 CZ ARG B 173 12.806 -11.767 -26.119 1.00 0.00 C
+ATOM 2651 NH1 ARG B 173 14.024 -11.840 -25.628 1.00 0.00 N
+ATOM 2652 NH2 ARG B 173 12.515 -12.374 -27.257 1.00 0.00 N
+ATOM 2653 H ARG B 173 12.242 -6.417 -23.139 1.00 0.00 H
+ATOM 2654 HA ARG B 173 12.973 -6.715 -25.890 1.00 0.00 H
+ATOM 2655 1HB ARG B 173 10.762 -8.007 -24.252 1.00 0.00 H
+ATOM 2656 2HB ARG B 173 11.181 -8.495 -25.887 1.00 0.00 H
+ATOM 2657 1HG ARG B 173 13.454 -9.088 -25.122 1.00 0.00 H
+ATOM 2658 2HG ARG B 173 12.989 -8.638 -23.463 1.00 0.00 H
+ATOM 2659 1HD ARG B 173 12.755 -10.957 -23.599 1.00 0.00 H
+ATOM 2660 2HD ARG B 173 11.107 -10.296 -23.694 1.00 0.00 H
+ATOM 2661 HE ARG B 173 10.931 -11.042 -25.870 1.00 0.00 H
+ATOM 2662 1HH1 ARG B 173 14.247 -11.377 -24.759 1.00 0.00 H
+ATOM 2663 2HH1 ARG B 173 14.736 -12.359 -26.121 1.00 0.00 H
+ATOM 2664 1HH2 ARG B 173 11.579 -12.318 -27.634 1.00 0.00 H
+ATOM 2665 2HH2 ARG B 173 13.227 -12.892 -27.749 1.00 0.00 H
+ATOM 2666 N LEU B 174 10.009 -5.399 -25.304 1.00 0.00 N
+ATOM 2667 CA LEU B 174 8.903 -4.676 -25.920 1.00 0.00 C
+ATOM 2668 C LEU B 174 9.389 -3.405 -26.603 1.00 0.00 C
+ATOM 2669 O LEU B 174 8.963 -3.084 -27.713 1.00 0.00 O
+ATOM 2670 CB LEU B 174 7.846 -4.326 -24.865 1.00 0.00 C
+ATOM 2671 CG LEU B 174 7.092 -5.516 -24.258 1.00 0.00 C
+ATOM 2672 CD1 LEU B 174 6.282 -5.046 -23.058 1.00 0.00 C
+ATOM 2673 CD2 LEU B 174 6.192 -6.139 -25.315 1.00 0.00 C
+ATOM 2674 H LEU B 174 10.010 -5.542 -24.305 1.00 0.00 H
+ATOM 2675 HA LEU B 174 8.447 -5.318 -26.673 1.00 0.00 H
+ATOM 2676 1HB LEU B 174 8.333 -3.792 -24.050 1.00 0.00 H
+ATOM 2677 2HB LEU B 174 7.109 -3.663 -25.318 1.00 0.00 H
+ATOM 2678 HG LEU B 174 7.808 -6.260 -23.907 1.00 0.00 H
+ATOM 2679 1HD1 LEU B 174 5.746 -5.892 -22.626 1.00 0.00 H
+ATOM 2680 2HD1 LEU B 174 6.952 -4.623 -22.309 1.00 0.00 H
+ATOM 2681 3HD1 LEU B 174 5.567 -4.288 -23.376 1.00 0.00 H
+ATOM 2682 1HD2 LEU B 174 5.657 -6.986 -24.884 1.00 0.00 H
+ATOM 2683 2HD2 LEU B 174 5.475 -5.397 -25.666 1.00 0.00 H
+ATOM 2684 3HD2 LEU B 174 6.799 -6.483 -26.153 1.00 0.00 H
+ATOM 2685 N LEU B 175 10.279 -2.682 -25.932 1.00 0.00 N
+ATOM 2686 CA LEU B 175 10.825 -1.443 -26.474 1.00 0.00 C
+ATOM 2687 C LEU B 175 11.726 -1.715 -27.673 1.00 0.00 C
+ATOM 2688 O LEU B 175 11.727 -0.960 -28.644 1.00 0.00 O
+ATOM 2689 CB LEU B 175 11.615 -0.695 -25.393 1.00 0.00 C
+ATOM 2690 CG LEU B 175 10.789 -0.157 -24.217 1.00 0.00 C
+ATOM 2691 CD1 LEU B 175 11.722 0.268 -23.092 1.00 0.00 C
+ATOM 2692 CD2 LEU B 175 9.934 1.010 -24.689 1.00 0.00 C
+ATOM 2693 H LEU B 175 10.587 -3.000 -25.024 1.00 0.00 H
+ATOM 2694 HA LEU B 175 9.997 -0.817 -26.805 1.00 0.00 H
+ATOM 2695 1HB LEU B 175 12.370 -1.366 -24.987 1.00 0.00 H
+ATOM 2696 2HB LEU B 175 12.122 0.152 -25.856 1.00 0.00 H
+ATOM 2697 HG LEU B 175 10.143 -0.948 -23.834 1.00 0.00 H
+ATOM 2698 1HD1 LEU B 175 11.135 0.649 -22.256 1.00 0.00 H
+ATOM 2699 2HD1 LEU B 175 12.307 -0.591 -22.761 1.00 0.00 H
+ATOM 2700 3HD1 LEU B 175 12.392 1.048 -23.450 1.00 0.00 H
+ATOM 2701 1HD2 LEU B 175 9.346 1.391 -23.853 1.00 0.00 H
+ATOM 2702 2HD2 LEU B 175 10.578 1.802 -25.071 1.00 0.00 H
+ATOM 2703 3HD2 LEU B 175 9.264 0.674 -25.481 1.00 0.00 H
+ATOM 2704 N LEU B 176 12.490 -2.799 -27.597 1.00 0.00 N
+ATOM 2705 CA LEU B 176 13.393 -3.176 -28.678 1.00 0.00 C
+ATOM 2706 C LEU B 176 12.623 -3.515 -29.947 1.00 0.00 C
+ATOM 2707 O LEU B 176 13.049 -3.181 -31.053 1.00 0.00 O
+ATOM 2708 CB LEU B 176 14.251 -4.377 -28.258 1.00 0.00 C
+ATOM 2709 CG LEU B 176 15.387 -4.071 -27.274 1.00 0.00 C
+ATOM 2710 CD1 LEU B 176 15.928 -5.374 -26.701 1.00 0.00 C
+ATOM 2711 CD2 LEU B 176 16.482 -3.292 -27.989 1.00 0.00 C
+ATOM 2712 H LEU B 176 12.445 -3.377 -26.769 1.00 0.00 H
+ATOM 2713 HA LEU B 176 14.050 -2.333 -28.890 1.00 0.00 H
+ATOM 2714 1HB LEU B 176 13.604 -5.121 -27.796 1.00 0.00 H
+ATOM 2715 2HB LEU B 176 14.695 -4.816 -29.151 1.00 0.00 H
+ATOM 2716 HG LEU B 176 15.001 -3.477 -26.445 1.00 0.00 H
+ATOM 2717 1HD1 LEU B 176 16.736 -5.156 -26.002 1.00 0.00 H
+ATOM 2718 2HD1 LEU B 176 15.129 -5.901 -26.179 1.00 0.00 H
+ATOM 2719 3HD1 LEU B 176 16.307 -5.997 -27.510 1.00 0.00 H
+ATOM 2720 1HD2 LEU B 176 17.289 -3.074 -27.289 1.00 0.00 H
+ATOM 2721 2HD2 LEU B 176 16.869 -3.886 -28.817 1.00 0.00 H
+ATOM 2722 3HD2 LEU B 176 16.072 -2.358 -28.373 1.00 0.00 H
+ATOM 2723 N VAL B 177 11.484 -4.180 -29.782 1.00 0.00 N
+ATOM 2724 CA VAL B 177 10.623 -4.517 -30.910 1.00 0.00 C
+ATOM 2725 C VAL B 177 10.114 -3.262 -31.608 1.00 0.00 C
+ATOM 2726 O VAL B 177 10.122 -3.178 -32.836 1.00 0.00 O
+ATOM 2727 CB VAL B 177 9.424 -5.358 -30.434 1.00 0.00 C
+ATOM 2728 CG1 VAL B 177 8.368 -5.446 -31.525 1.00 0.00 C
+ATOM 2729 CG2 VAL B 177 9.895 -6.746 -30.026 1.00 0.00 C
+ATOM 2730 H VAL B 177 11.208 -4.459 -28.851 1.00 0.00 H
+ATOM 2731 HA VAL B 177 11.203 -5.104 -31.624 1.00 0.00 H
+ATOM 2732 HB VAL B 177 8.962 -4.865 -29.579 1.00 0.00 H
+ATOM 2733 1HG1 VAL B 177 7.528 -6.044 -31.172 1.00 0.00 H
+ATOM 2734 2HG1 VAL B 177 8.020 -4.444 -31.776 1.00 0.00 H
+ATOM 2735 3HG1 VAL B 177 8.798 -5.914 -32.411 1.00 0.00 H
+ATOM 2736 1HG2 VAL B 177 9.042 -7.335 -29.690 1.00 0.00 H
+ATOM 2737 2HG2 VAL B 177 10.362 -7.237 -30.880 1.00 0.00 H
+ATOM 2738 3HG2 VAL B 177 10.619 -6.661 -29.215 1.00 0.00 H
+ATOM 2739 N ALA B 178 9.672 -2.290 -30.819 1.00 0.00 N
+ATOM 2740 CA ALA B 178 9.223 -1.011 -31.356 1.00 0.00 C
+ATOM 2741 C ALA B 178 10.312 -0.352 -32.193 1.00 0.00 C
+ATOM 2742 O ALA B 178 10.029 0.290 -33.204 1.00 0.00 O
+ATOM 2743 CB ALA B 178 8.789 -0.086 -30.228 1.00 0.00 C
+ATOM 2744 H ALA B 178 9.646 -2.441 -29.820 1.00 0.00 H
+ATOM 2745 HA ALA B 178 8.369 -1.199 -32.007 1.00 0.00 H
+ATOM 2746 1HB ALA B 178 8.457 0.865 -30.646 1.00 0.00 H
+ATOM 2747 2HB ALA B 178 7.970 -0.545 -29.676 1.00 0.00 H
+ATOM 2748 3HB ALA B 178 9.628 0.087 -29.557 1.00 0.00 H
+ATOM 2749 N LEU B 179 11.559 -0.516 -31.766 1.00 0.00 N
+ATOM 2750 CA LEU B 179 12.700 -0.014 -32.522 1.00 0.00 C
+ATOM 2751 C LEU B 179 12.970 -0.877 -33.748 1.00 0.00 C
+ATOM 2752 O LEU B 179 13.265 -0.363 -34.827 1.00 0.00 O
+ATOM 2753 CB LEU B 179 13.950 0.026 -31.633 1.00 0.00 C
+ATOM 2754 CG LEU B 179 13.903 1.018 -30.464 1.00 0.00 C
+ATOM 2755 CD1 LEU B 179 15.091 0.775 -29.543 1.00 0.00 C
+ATOM 2756 CD2 LEU B 179 13.911 2.440 -31.004 1.00 0.00 C
+ATOM 2757 H LEU B 179 11.721 -1.000 -30.894 1.00 0.00 H
+ATOM 2758 HA LEU B 179 12.462 0.992 -32.866 1.00 0.00 H
+ATOM 2759 1HB LEU B 179 14.112 -0.968 -31.218 1.00 0.00 H
+ATOM 2760 2HB LEU B 179 14.809 0.283 -32.252 1.00 0.00 H
+ATOM 2761 HG LEU B 179 12.993 0.855 -29.884 1.00 0.00 H
+ATOM 2762 1HD1 LEU B 179 15.058 1.480 -28.712 1.00 0.00 H
+ATOM 2763 2HD1 LEU B 179 15.049 -0.243 -29.156 1.00 0.00 H
+ATOM 2764 3HD1 LEU B 179 16.017 0.915 -30.100 1.00 0.00 H
+ATOM 2765 1HD2 LEU B 179 13.877 3.145 -30.173 1.00 0.00 H
+ATOM 2766 2HD2 LEU B 179 14.821 2.604 -31.582 1.00 0.00 H
+ATOM 2767 3HD2 LEU B 179 13.042 2.591 -31.644 1.00 0.00 H
+ATOM 2768 N LYS B 180 12.865 -2.189 -33.577 1.00 0.00 N
+ATOM 2769 CA LYS B 180 13.065 -3.124 -34.678 1.00 0.00 C
+ATOM 2770 C LYS B 180 12.086 -2.856 -35.815 1.00 0.00 C
+ATOM 2771 O LYS B 180 12.439 -2.962 -36.989 1.00 0.00 O
+ATOM 2772 CB LYS B 180 12.922 -4.566 -34.190 1.00 0.00 C
+ATOM 2773 CG LYS B 180 14.107 -5.078 -33.383 1.00 0.00 C
+ATOM 2774 CD LYS B 180 13.841 -6.472 -32.833 1.00 0.00 C
+ATOM 2775 CE LYS B 180 15.037 -6.998 -32.053 1.00 0.00 C
+ATOM 2776 NZ LYS B 180 14.791 -8.360 -31.508 1.00 0.00 N
+ATOM 2777 H LYS B 180 12.640 -2.550 -32.662 1.00 0.00 H
+ATOM 2778 HA LYS B 180 14.080 -2.999 -35.059 1.00 0.00 H
+ATOM 2779 1HB LYS B 180 12.031 -4.652 -33.567 1.00 0.00 H
+ATOM 2780 2HB LYS B 180 12.788 -5.229 -35.045 1.00 0.00 H
+ATOM 2781 1HG LYS B 180 14.993 -5.111 -34.018 1.00 0.00 H
+ATOM 2782 2HG LYS B 180 14.302 -4.401 -32.552 1.00 0.00 H
+ATOM 2783 1HD LYS B 180 12.972 -6.444 -32.174 1.00 0.00 H
+ATOM 2784 2HD LYS B 180 13.629 -7.153 -33.657 1.00 0.00 H
+ATOM 2785 1HE LYS B 180 15.909 -7.033 -32.705 1.00 0.00 H
+ATOM 2786 2HE LYS B 180 15.257 -6.324 -31.226 1.00 0.00 H
+ATOM 2787 1HZ LYS B 180 15.606 -8.672 -30.999 1.00 0.00 H
+ATOM 2788 2HZ LYS B 180 13.994 -8.336 -30.887 1.00 0.00 H
+ATOM 2789 3HZ LYS B 180 14.605 -8.999 -32.268 1.00 0.00 H
+ATOM 2790 N LEU B 181 10.855 -2.507 -35.457 1.00 0.00 N
+ATOM 2791 CA LEU B 181 9.828 -2.201 -36.446 1.00 0.00 C
+ATOM 2792 C LEU B 181 10.125 -0.890 -37.162 1.00 0.00 C
+ATOM 2793 O LEU B 181 9.522 -0.582 -38.189 1.00 0.00 O
+ATOM 2794 CB LEU B 181 8.451 -2.124 -35.774 1.00 0.00 C
+ATOM 2795 CG LEU B 181 7.884 -3.455 -35.265 1.00 0.00 C
+ATOM 2796 CD1 LEU B 181 6.684 -3.186 -34.368 1.00 0.00 C
+ATOM 2797 CD2 LEU B 181 7.495 -4.327 -36.450 1.00 0.00 C
+ATOM 2798 H LEU B 181 10.624 -2.452 -34.475 1.00 0.00 H
+ATOM 2799 HA LEU B 181 9.813 -3.001 -37.186 1.00 0.00 H
+ATOM 2800 1HB LEU B 181 8.517 -1.446 -34.924 1.00 0.00 H
+ATOM 2801 2HB LEU B 181 7.739 -1.710 -36.488 1.00 0.00 H
+ATOM 2802 HG LEU B 181 8.638 -3.969 -34.669 1.00 0.00 H
+ATOM 2803 1HD1 LEU B 181 6.280 -4.132 -34.006 1.00 0.00 H
+ATOM 2804 2HD1 LEU B 181 6.994 -2.577 -33.518 1.00 0.00 H
+ATOM 2805 3HD1 LEU B 181 5.917 -2.658 -34.933 1.00 0.00 H
+ATOM 2806 1HD2 LEU B 181 7.092 -5.274 -36.089 1.00 0.00 H
+ATOM 2807 2HD2 LEU B 181 6.740 -3.815 -37.047 1.00 0.00 H
+ATOM 2808 3HD2 LEU B 181 8.375 -4.518 -37.065 1.00 0.00 H
+ATOM 2809 N ARG B 182 11.057 -0.120 -36.611 1.00 0.00 N
+ATOM 2810 CA ARG B 182 11.369 1.203 -37.140 1.00 0.00 C
+ATOM 2811 C ARG B 182 12.600 1.161 -38.036 1.00 0.00 C
+ATOM 2812 O ARG B 182 13.039 2.190 -38.553 1.00 0.00 O
+ATOM 2813 CB ARG B 182 11.603 2.191 -36.007 1.00 0.00 C
+ATOM 2814 CG ARG B 182 11.600 3.653 -36.424 1.00 0.00 C
+ATOM 2815 CD ARG B 182 11.693 4.559 -35.250 1.00 0.00 C
+ATOM 2816 NE ARG B 182 10.579 4.374 -34.334 1.00 0.00 N
+ATOM 2817 CZ ARG B 182 10.579 4.758 -33.043 1.00 0.00 C
+ATOM 2818 NH1 ARG B 182 11.638 5.345 -32.531 1.00 0.00 N
+ATOM 2819 NH2 ARG B 182 9.514 4.545 -32.290 1.00 0.00 N
+ATOM 2820 H ARG B 182 11.563 -0.459 -35.806 1.00 0.00 H
+ATOM 2821 HA ARG B 182 10.532 1.535 -37.756 1.00 0.00 H
+ATOM 2822 1HB ARG B 182 10.833 2.063 -35.248 1.00 0.00 H
+ATOM 2823 2HB ARG B 182 12.565 1.984 -35.537 1.00 0.00 H
+ATOM 2824 1HG ARG B 182 12.453 3.848 -37.075 1.00 0.00 H
+ATOM 2825 2HG ARG B 182 10.676 3.878 -36.959 1.00 0.00 H
+ATOM 2826 1HD ARG B 182 12.616 4.359 -34.708 1.00 0.00 H
+ATOM 2827 2HD ARG B 182 11.687 5.595 -35.589 1.00 0.00 H
+ATOM 2828 HE ARG B 182 9.745 3.926 -34.691 1.00 0.00 H
+ATOM 2829 1HH1 ARG B 182 12.452 5.508 -33.107 1.00 0.00 H
+ATOM 2830 2HH1 ARG B 182 11.638 5.633 -31.564 1.00 0.00 H
+ATOM 2831 1HH2 ARG B 182 8.699 4.094 -32.683 1.00 0.00 H
+ATOM 2832 2HH2 ARG B 182 9.514 4.833 -31.323 1.00 0.00 H
+ATOM 2833 N GLY B 183 13.154 -0.033 -38.217 1.00 0.00 N
+ATOM 2834 CA GLY B 183 14.302 -0.219 -39.097 1.00 0.00 C
+ATOM 2835 C GLY B 183 15.601 0.151 -38.392 1.00 0.00 C
+ATOM 2836 O GLY B 183 16.583 0.525 -39.035 1.00 0.00 O
+ATOM 2837 H GLY B 183 12.770 -0.832 -37.734 1.00 0.00 H
+ATOM 2838 1HA GLY B 183 14.344 -1.258 -39.424 1.00 0.00 H
+ATOM 2839 2HA GLY B 183 14.180 0.394 -39.989 1.00 0.00 H
+ATOM 2840 N VAL B 184 15.601 0.045 -37.068 1.00 0.00 N
+ATOM 2841 CA VAL B 184 16.790 0.335 -36.276 1.00 0.00 C
+ATOM 2842 C VAL B 184 17.796 -0.807 -36.353 1.00 0.00 C
+ATOM 2843 O VAL B 184 17.430 -1.977 -36.241 1.00 0.00 O
+ATOM 2844 CB VAL B 184 16.405 0.579 -34.805 1.00 0.00 C
+ATOM 2845 CG1 VAL B 184 17.652 0.763 -33.952 1.00 0.00 C
+ATOM 2846 CG2 VAL B 184 15.497 1.795 -34.702 1.00 0.00 C
+ATOM 2847 H VAL B 184 14.756 -0.244 -36.597 1.00 0.00 H
+ATOM 2848 HA VAL B 184 17.257 1.239 -36.670 1.00 0.00 H
+ATOM 2849 HB VAL B 184 15.883 -0.299 -34.425 1.00 0.00 H
+ATOM 2850 1HG1 VAL B 184 17.362 0.934 -32.915 1.00 0.00 H
+ATOM 2851 2HG1 VAL B 184 18.269 -0.133 -34.012 1.00 0.00 H
+ATOM 2852 3HG1 VAL B 184 18.218 1.620 -34.316 1.00 0.00 H
+ATOM 2853 1HG2 VAL B 184 15.229 1.961 -33.659 1.00 0.00 H
+ATOM 2854 2HG2 VAL B 184 16.018 2.672 -35.087 1.00 0.00 H
+ATOM 2855 3HG2 VAL B 184 14.593 1.624 -35.286 1.00 0.00 H
+ATOM 2856 N SER B 185 19.064 -0.460 -36.544 1.00 0.00 N
+ATOM 2857 CA SER B 185 20.105 -1.454 -36.774 1.00 0.00 C
+ATOM 2858 C SER B 185 20.384 -2.261 -35.511 1.00 0.00 C
+ATOM 2859 O SER B 185 20.028 -1.847 -34.408 1.00 0.00 O
+ATOM 2860 CB SER B 185 21.378 -0.779 -37.245 1.00 0.00 C
+ATOM 2861 OG SER B 185 21.960 -0.030 -36.214 1.00 0.00 O
+ATOM 2862 H SER B 185 19.314 0.519 -36.530 1.00 0.00 H
+ATOM 2863 HA SER B 185 19.761 -2.141 -37.550 1.00 0.00 H
+ATOM 2864 1HB SER B 185 22.083 -1.533 -37.593 1.00 0.00 H
+ATOM 2865 2HB SER B 185 21.153 -0.127 -38.088 1.00 0.00 H
+ATOM 2866 HG SER B 185 21.462 0.790 -36.168 1.00 0.00 H
+ATOM 2867 N CYS B 186 21.023 -3.413 -35.681 1.00 0.00 N
+ATOM 2868 CA CYS B 186 21.319 -4.297 -34.560 1.00 0.00 C
+ATOM 2869 C CYS B 186 22.193 -3.600 -33.525 1.00 0.00 C
+ATOM 2870 O CYS B 186 21.947 -3.698 -32.322 1.00 0.00 O
+ATOM 2871 CB CYS B 186 22.025 -5.564 -35.045 1.00 0.00 C
+ATOM 2872 SG CYS B 186 22.245 -6.823 -33.765 1.00 0.00 S
+ATOM 2873 H CYS B 186 21.311 -3.683 -36.611 1.00 0.00 H
+ATOM 2874 HA CYS B 186 20.379 -4.582 -34.087 1.00 0.00 H
+ATOM 2875 1HB CYS B 186 21.454 -6.009 -35.860 1.00 0.00 H
+ATOM 2876 2HB CYS B 186 23.008 -5.305 -35.437 1.00 0.00 H
+ATOM 2877 N GLU B 187 23.214 -2.895 -33.998 1.00 0.00 N
+ATOM 2878 CA GLU B 187 24.160 -2.227 -33.113 1.00 0.00 C
+ATOM 2879 C GLU B 187 23.472 -1.150 -32.284 1.00 0.00 C
+ATOM 2880 O GLU B 187 23.772 -0.977 -31.102 1.00 0.00 O
+ATOM 2881 CB GLU B 187 25.303 -1.609 -33.922 1.00 0.00 C
+ATOM 2882 CG GLU B 187 26.190 -2.623 -34.632 1.00 0.00 C
+ATOM 2883 CD GLU B 187 25.577 -3.147 -35.901 1.00 0.00 C
+ATOM 2884 OE1 GLU B 187 24.519 -2.690 -36.261 1.00 0.00 O
+ATOM 2885 OE2 GLU B 187 26.168 -4.007 -36.510 1.00 0.00 O
+ATOM 2886 H GLU B 187 23.339 -2.820 -34.998 1.00 0.00 H
+ATOM 2887 HA GLU B 187 24.577 -2.967 -32.429 1.00 0.00 H
+ATOM 2888 1HB GLU B 187 24.894 -0.936 -34.676 1.00 0.00 H
+ATOM 2889 2HB GLU B 187 25.937 -1.016 -33.263 1.00 0.00 H
+ATOM 2890 1HG GLU B 187 27.143 -2.152 -34.871 1.00 0.00 H
+ATOM 2891 2HG GLU B 187 26.386 -3.454 -33.957 1.00 0.00 H
+ATOM 2892 N GLU B 188 22.550 -0.428 -32.910 1.00 0.00 N
+ATOM 2893 CA GLU B 188 21.757 0.576 -32.210 1.00 0.00 C
+ATOM 2894 C GLU B 188 20.848 -0.066 -31.171 1.00 0.00 C
+ATOM 2895 O GLU B 188 20.666 0.467 -30.077 1.00 0.00 O
+ATOM 2896 CB GLU B 188 20.920 1.383 -33.205 1.00 0.00 C
+ATOM 2897 CG GLU B 188 21.722 2.351 -34.063 1.00 0.00 C
+ATOM 2898 CD GLU B 188 20.916 2.947 -35.183 1.00 0.00 C
+ATOM 2899 OE1 GLU B 188 20.350 2.200 -35.945 1.00 0.00 O
+ATOM 2900 OE2 GLU B 188 20.866 4.151 -35.277 1.00 0.00 O
+ATOM 2901 H GLU B 188 22.393 -0.577 -33.897 1.00 0.00 H
+ATOM 2902 HA GLU B 188 22.436 1.255 -31.694 1.00 0.00 H
+ATOM 2903 1HB GLU B 188 20.392 0.702 -33.873 1.00 0.00 H
+ATOM 2904 2HB GLU B 188 20.168 1.959 -32.665 1.00 0.00 H
+ATOM 2905 1HG GLU B 188 22.096 3.157 -33.431 1.00 0.00 H
+ATOM 2906 2HG GLU B 188 22.581 1.825 -34.479 1.00 0.00 H
+ATOM 2907 N LEU B 189 20.279 -1.215 -31.520 1.00 0.00 N
+ATOM 2908 CA LEU B 189 19.418 -1.953 -30.604 1.00 0.00 C
+ATOM 2909 C LEU B 189 20.199 -2.453 -29.395 1.00 0.00 C
+ATOM 2910 O LEU B 189 19.712 -2.405 -28.265 1.00 0.00 O
+ATOM 2911 CB LEU B 189 18.768 -3.139 -31.327 1.00 0.00 C
+ATOM 2912 CG LEU B 189 17.733 -2.778 -32.400 1.00 0.00 C
+ATOM 2913 CD1 LEU B 189 17.422 -4.009 -33.241 1.00 0.00 C
+ATOM 2914 CD2 LEU B 189 16.476 -2.239 -31.733 1.00 0.00 C
+ATOM 2915 H LEU B 189 20.447 -1.587 -32.443 1.00 0.00 H
+ATOM 2916 HA LEU B 189 18.635 -1.283 -30.249 1.00 0.00 H
+ATOM 2917 1HB LEU B 189 19.551 -3.725 -31.805 1.00 0.00 H
+ATOM 2918 2HB LEU B 189 18.272 -3.768 -30.587 1.00 0.00 H
+ATOM 2919 HG LEU B 189 18.147 -2.017 -33.063 1.00 0.00 H
+ATOM 2920 1HD1 LEU B 189 16.687 -3.752 -34.004 1.00 0.00 H
+ATOM 2921 2HD1 LEU B 189 18.335 -4.361 -33.722 1.00 0.00 H
+ATOM 2922 3HD1 LEU B 189 17.021 -4.794 -32.601 1.00 0.00 H
+ATOM 2923 1HD2 LEU B 189 15.741 -1.982 -32.497 1.00 0.00 H
+ATOM 2924 2HD2 LEU B 189 16.061 -2.999 -31.072 1.00 0.00 H
+ATOM 2925 3HD2 LEU B 189 16.724 -1.350 -31.154 1.00 0.00 H
+ATOM 2926 N GLN B 190 21.414 -2.932 -29.640 1.00 0.00 N
+ATOM 2927 CA GLN B 190 22.284 -3.396 -28.566 1.00 0.00 C
+ATOM 2928 C GLN B 190 22.615 -2.268 -27.598 1.00 0.00 C
+ATOM 2929 O GLN B 190 22.551 -2.443 -26.381 1.00 0.00 O
+ATOM 2930 CB GLN B 190 23.575 -3.986 -29.141 1.00 0.00 C
+ATOM 2931 CG GLN B 190 24.510 -4.573 -28.097 1.00 0.00 C
+ATOM 2932 CD GLN B 190 25.808 -5.075 -28.699 1.00 0.00 C
+ATOM 2933 OE1 GLN B 190 25.830 -5.595 -29.818 1.00 0.00 O
+ATOM 2934 NE2 GLN B 190 26.900 -4.922 -27.959 1.00 0.00 N
+ATOM 2935 H GLN B 190 21.743 -2.976 -30.594 1.00 0.00 H
+ATOM 2936 HA GLN B 190 21.767 -4.181 -28.016 1.00 0.00 H
+ATOM 2937 1HB GLN B 190 23.330 -4.773 -29.853 1.00 0.00 H
+ATOM 2938 2HB GLN B 190 24.120 -3.212 -29.682 1.00 0.00 H
+ATOM 2939 1HG GLN B 190 24.748 -3.803 -27.363 1.00 0.00 H
+ATOM 2940 2HG GLN B 190 24.012 -5.412 -27.610 1.00 0.00 H
+ATOM 2941 1HE2 GLN B 190 27.787 -5.234 -28.304 1.00 0.00 H
+ATOM 2942 2HE2 GLN B 190 26.838 -4.495 -27.057 1.00 0.00 H
+ATOM 2943 N LYS B 191 22.966 -1.109 -28.144 1.00 0.00 N
+ATOM 2944 CA LYS B 191 23.252 0.067 -27.331 1.00 0.00 C
+ATOM 2945 C LYS B 191 22.057 0.443 -26.465 1.00 0.00 C
+ATOM 2946 O LYS B 191 22.204 0.731 -25.277 1.00 0.00 O
+ATOM 2947 CB LYS B 191 23.651 1.248 -28.218 1.00 0.00 C
+ATOM 2948 CG LYS B 191 24.031 2.509 -27.453 1.00 0.00 C
+ATOM 2949 CD LYS B 191 24.507 3.604 -28.396 1.00 0.00 C
+ATOM 2950 CE LYS B 191 25.054 4.798 -27.627 1.00 0.00 C
+ATOM 2951 NZ LYS B 191 23.980 5.536 -26.909 1.00 0.00 N
+ATOM 2952 H LYS B 191 23.036 -1.040 -29.149 1.00 0.00 H
+ATOM 2953 HA LYS B 191 24.086 -0.167 -26.666 1.00 0.00 H
+ATOM 2954 1HB LYS B 191 24.500 0.965 -28.841 1.00 0.00 H
+ATOM 2955 2HB LYS B 191 22.825 1.497 -28.884 1.00 0.00 H
+ATOM 2956 1HG LYS B 191 23.167 2.871 -26.896 1.00 0.00 H
+ATOM 2957 2HG LYS B 191 24.827 2.279 -26.746 1.00 0.00 H
+ATOM 2958 1HD LYS B 191 25.290 3.211 -29.046 1.00 0.00 H
+ATOM 2959 2HD LYS B 191 23.675 3.935 -29.018 1.00 0.00 H
+ATOM 2960 1HE LYS B 191 25.791 4.456 -26.902 1.00 0.00 H
+ATOM 2961 2HE LYS B 191 25.546 5.481 -28.319 1.00 0.00 H
+ATOM 2962 1HZ LYS B 191 24.383 6.319 -26.413 1.00 0.00 H
+ATOM 2963 2HZ LYS B 191 23.299 5.874 -27.575 1.00 0.00 H
+ATOM 2964 3HZ LYS B 191 23.528 4.918 -26.250 1.00 0.00 H
+ATOM 2965 N PHE B 192 20.872 0.436 -27.066 1.00 0.00 N
+ATOM 2966 CA PHE B 192 19.642 0.721 -26.338 1.00 0.00 C
+ATOM 2967 C PHE B 192 19.440 -0.261 -25.191 1.00 0.00 C
+ATOM 2968 O PHE B 192 19.153 0.138 -24.063 1.00 0.00 O
+ATOM 2969 CB PHE B 192 18.439 0.666 -27.281 1.00 0.00 C
+ATOM 2970 CG PHE B 192 17.130 0.978 -26.613 1.00 0.00 C
+ATOM 2971 CD1 PHE B 192 16.716 2.291 -26.446 1.00 0.00 C
+ATOM 2972 CD2 PHE B 192 16.311 -0.040 -26.149 1.00 0.00 C
+ATOM 2973 CE1 PHE B 192 15.512 2.580 -25.831 1.00 0.00 C
+ATOM 2974 CE2 PHE B 192 15.107 0.245 -25.535 1.00 0.00 C
+ATOM 2975 CZ PHE B 192 14.708 1.557 -25.376 1.00 0.00 C
+ATOM 2976 H PHE B 192 20.823 0.228 -28.054 1.00 0.00 H
+ATOM 2977 HA PHE B 192 19.713 1.725 -25.919 1.00 0.00 H
+ATOM 2978 1HB PHE B 192 18.582 1.374 -28.096 1.00 0.00 H
+ATOM 2979 2HB PHE B 192 18.367 -0.328 -27.721 1.00 0.00 H
+ATOM 2980 HD1 PHE B 192 17.352 3.100 -26.807 1.00 0.00 H
+ATOM 2981 HD2 PHE B 192 16.626 -1.076 -26.274 1.00 0.00 H
+ATOM 2982 HE1 PHE B 192 15.199 3.616 -25.707 1.00 0.00 H
+ATOM 2983 HE2 PHE B 192 14.472 -0.564 -25.176 1.00 0.00 H
+ATOM 2984 HZ PHE B 192 13.759 1.784 -24.891 1.00 0.00 H
+ATOM 2985 N ALA B 193 19.593 -1.547 -25.487 1.00 0.00 N
+ATOM 2986 CA ALA B 193 19.414 -2.590 -24.485 1.00 0.00 C
+ATOM 2987 C ALA B 193 20.390 -2.415 -23.327 1.00 0.00 C
+ATOM 2988 O ALA B 193 20.020 -2.567 -22.163 1.00 0.00 O
+ATOM 2989 CB ALA B 193 19.582 -3.965 -25.115 1.00 0.00 C
+ATOM 2990 H ALA B 193 19.840 -1.809 -26.431 1.00 0.00 H
+ATOM 2991 HA ALA B 193 18.400 -2.522 -24.092 1.00 0.00 H
+ATOM 2992 1HB ALA B 193 19.444 -4.733 -24.354 1.00 0.00 H
+ATOM 2993 2HB ALA B 193 18.839 -4.097 -25.902 1.00 0.00 H
+ATOM 2994 3HB ALA B 193 20.580 -4.050 -25.540 1.00 0.00 H
+ATOM 2995 N GLU B 194 21.637 -2.097 -23.656 1.00 0.00 N
+ATOM 2996 CA GLU B 194 22.672 -1.913 -22.644 1.00 0.00 C
+ATOM 2997 C GLU B 194 22.335 -0.753 -21.716 1.00 0.00 C
+ATOM 2998 O GLU B 194 22.510 -0.847 -20.501 1.00 0.00 O
+ATOM 2999 CB GLU B 194 24.029 -1.670 -23.307 1.00 0.00 C
+ATOM 3000 CG GLU B 194 24.633 -2.899 -23.972 1.00 0.00 C
+ATOM 3001 CD GLU B 194 25.873 -2.586 -24.762 1.00 0.00 C
+ATOM 3002 OE1 GLU B 194 26.239 -1.438 -24.828 1.00 0.00 O
+ATOM 3003 OE2 GLU B 194 26.456 -3.498 -25.301 1.00 0.00 O
+ATOM 3004 H GLU B 194 21.874 -1.977 -24.630 1.00 0.00 H
+ATOM 3005 HA GLU B 194 22.734 -2.821 -22.044 1.00 0.00 H
+ATOM 3006 1HB GLU B 194 23.930 -0.894 -24.066 1.00 0.00 H
+ATOM 3007 2HB GLU B 194 24.739 -1.310 -22.562 1.00 0.00 H
+ATOM 3008 1HG GLU B 194 24.880 -3.631 -23.204 1.00 0.00 H
+ATOM 3009 2HG GLU B 194 23.890 -3.343 -24.633 1.00 0.00 H
+ATOM 3010 N GLU B 195 21.853 0.341 -22.295 1.00 0.00 N
+ATOM 3011 CA GLU B 195 21.480 1.518 -21.519 1.00 0.00 C
+ATOM 3012 C GLU B 195 20.297 1.224 -20.607 1.00 0.00 C
+ATOM 3013 O GLU B 195 20.288 1.616 -19.440 1.00 0.00 O
+ATOM 3014 CB GLU B 195 21.142 2.686 -22.448 1.00 0.00 C
+ATOM 3015 CG GLU B 195 22.343 3.285 -23.167 1.00 0.00 C
+ATOM 3016 CD GLU B 195 21.957 4.324 -24.183 1.00 0.00 C
+ATOM 3017 OE1 GLU B 195 20.786 4.480 -24.430 1.00 0.00 O
+ATOM 3018 OE2 GLU B 195 22.836 4.963 -24.712 1.00 0.00 O
+ATOM 3019 H GLU B 195 21.741 0.358 -23.299 1.00 0.00 H
+ATOM 3020 HA GLU B 195 22.325 1.799 -20.890 1.00 0.00 H
+ATOM 3021 1HB GLU B 195 20.431 2.354 -23.205 1.00 0.00 H
+ATOM 3022 2HB GLU B 195 20.665 3.480 -21.875 1.00 0.00 H
+ATOM 3023 1HG GLU B 195 23.004 3.741 -22.430 1.00 0.00 H
+ATOM 3024 2HG GLU B 195 22.893 2.486 -23.662 1.00 0.00 H
+ATOM 3025 N PHE B 196 19.300 0.532 -21.145 1.00 0.00 N
+ATOM 3026 CA PHE B 196 18.113 0.173 -20.375 1.00 0.00 C
+ATOM 3027 C PHE B 196 18.479 -0.672 -19.162 1.00 0.00 C
+ATOM 3028 O PHE B 196 18.022 -0.408 -18.049 1.00 0.00 O
+ATOM 3029 CB PHE B 196 17.117 -0.589 -21.251 1.00 0.00 C
+ATOM 3030 CG PHE B 196 15.866 -1.002 -20.529 1.00 0.00 C
+ATOM 3031 CD1 PHE B 196 14.738 -0.195 -20.550 1.00 0.00 C
+ATOM 3032 CD2 PHE B 196 15.815 -2.196 -19.827 1.00 0.00 C
+ATOM 3033 CE1 PHE B 196 13.587 -0.573 -19.886 1.00 0.00 C
+ATOM 3034 CE2 PHE B 196 14.665 -2.577 -19.163 1.00 0.00 C
+ATOM 3035 CZ PHE B 196 13.550 -1.764 -19.193 1.00 0.00 C
+ATOM 3036 H PHE B 196 19.363 0.247 -22.111 1.00 0.00 H
+ATOM 3037 HA PHE B 196 17.637 1.089 -20.027 1.00 0.00 H
+ATOM 3038 1HB PHE B 196 16.831 0.031 -22.100 1.00 0.00 H
+ATOM 3039 2HB PHE B 196 17.593 -1.486 -21.647 1.00 0.00 H
+ATOM 3040 HD1 PHE B 196 14.767 0.746 -21.099 1.00 0.00 H
+ATOM 3041 HD2 PHE B 196 16.696 -2.838 -19.803 1.00 0.00 H
+ATOM 3042 HE1 PHE B 196 12.708 0.070 -19.910 1.00 0.00 H
+ATOM 3043 HE2 PHE B 196 14.638 -3.519 -18.615 1.00 0.00 H
+ATOM 3044 HZ PHE B 196 12.644 -2.063 -18.668 1.00 0.00 H
+ATOM 3045 N ILE B 197 19.307 -1.687 -19.381 1.00 0.00 N
+ATOM 3046 CA ILE B 197 19.676 -2.617 -18.320 1.00 0.00 C
+ATOM 3047 C ILE B 197 20.408 -1.903 -17.192 1.00 0.00 C
+ATOM 3048 O ILE B 197 20.125 -2.127 -16.016 1.00 0.00 O
+ATOM 3049 CB ILE B 197 20.558 -3.753 -18.868 1.00 0.00 C
+ATOM 3050 CG1 ILE B 197 19.757 -4.636 -19.828 1.00 0.00 C
+ATOM 3051 CG2 ILE B 197 21.127 -4.582 -17.727 1.00 0.00 C
+ATOM 3052 CD1 ILE B 197 20.612 -5.553 -20.672 1.00 0.00 C
+ATOM 3053 H ILE B 197 19.690 -1.819 -20.306 1.00 0.00 H
+ATOM 3054 HA ILE B 197 18.766 -3.055 -17.913 1.00 0.00 H
+ATOM 3055 HB ILE B 197 21.381 -3.329 -19.443 1.00 0.00 H
+ATOM 3056 1HG1 ILE B 197 19.057 -5.249 -19.260 1.00 0.00 H
+ATOM 3057 2HG1 ILE B 197 19.170 -4.007 -20.498 1.00 0.00 H
+ATOM 3058 1HG2 ILE B 197 21.748 -5.381 -18.132 1.00 0.00 H
+ATOM 3059 2HG2 ILE B 197 21.731 -3.945 -17.081 1.00 0.00 H
+ATOM 3060 3HG2 ILE B 197 20.311 -5.014 -17.149 1.00 0.00 H
+ATOM 3061 1HD1 ILE B 197 19.973 -6.147 -21.327 1.00 0.00 H
+ATOM 3062 2HD1 ILE B 197 21.298 -4.958 -21.276 1.00 0.00 H
+ATOM 3063 3HD1 ILE B 197 21.182 -6.217 -20.024 1.00 0.00 H
+ATOM 3064 N GLU B 198 21.352 -1.042 -17.558 1.00 0.00 N
+ATOM 3065 CA GLU B 198 22.107 -0.271 -16.577 1.00 0.00 C
+ATOM 3066 C GLU B 198 21.185 0.602 -15.735 1.00 0.00 C
+ATOM 3067 O GLU B 198 21.317 0.661 -14.513 1.00 0.00 O
+ATOM 3068 CB GLU B 198 23.154 0.601 -17.275 1.00 0.00 C
+ATOM 3069 CG GLU B 198 24.002 1.441 -16.331 1.00 0.00 C
+ATOM 3070 CD GLU B 198 25.059 2.236 -17.046 1.00 0.00 C
+ATOM 3071 OE1 GLU B 198 25.192 2.078 -18.236 1.00 0.00 O
+ATOM 3072 OE2 GLU B 198 25.735 3.003 -16.401 1.00 0.00 O
+ATOM 3073 H GLU B 198 21.552 -0.919 -18.541 1.00 0.00 H
+ATOM 3074 HA GLU B 198 22.620 -0.964 -15.911 1.00 0.00 H
+ATOM 3075 1HB GLU B 198 23.826 -0.032 -17.855 1.00 0.00 H
+ATOM 3076 2HB GLU B 198 22.658 1.277 -17.971 1.00 0.00 H
+ATOM 3077 1HG GLU B 198 23.352 2.128 -15.789 1.00 0.00 H
+ATOM 3078 2HG GLU B 198 24.478 0.784 -15.604 1.00 0.00 H
+ATOM 3079 N GLU B 199 20.251 1.278 -16.395 1.00 0.00 N
+ATOM 3080 CA GLU B 199 19.288 2.129 -15.706 1.00 0.00 C
+ATOM 3081 C GLU B 199 18.408 1.315 -14.766 1.00 0.00 C
+ATOM 3082 O GLU B 199 18.103 1.750 -13.656 1.00 0.00 O
+ATOM 3083 CB GLU B 199 18.417 2.876 -16.718 1.00 0.00 C
+ATOM 3084 CG GLU B 199 19.141 3.977 -17.479 1.00 0.00 C
+ATOM 3085 CD GLU B 199 18.292 4.603 -18.550 1.00 0.00 C
+ATOM 3086 OE1 GLU B 199 17.207 4.125 -18.778 1.00 0.00 O
+ATOM 3087 OE2 GLU B 199 18.730 5.562 -19.143 1.00 0.00 O
+ATOM 3088 H GLU B 199 20.205 1.199 -17.402 1.00 0.00 H
+ATOM 3089 HA GLU B 199 19.837 2.854 -15.105 1.00 0.00 H
+ATOM 3090 1HB GLU B 199 18.019 2.170 -17.447 1.00 0.00 H
+ATOM 3091 2HB GLU B 199 17.568 3.328 -16.203 1.00 0.00 H
+ATOM 3092 1HG GLU B 199 19.446 4.751 -16.775 1.00 0.00 H
+ATOM 3093 2HG GLU B 199 20.040 3.561 -17.931 1.00 0.00 H
+ATOM 3094 N ALA B 200 18.003 0.134 -15.217 1.00 0.00 N
+ATOM 3095 CA ALA B 200 17.182 -0.757 -14.406 1.00 0.00 C
+ATOM 3096 C ALA B 200 17.920 -1.191 -13.145 1.00 0.00 C
+ATOM 3097 O ALA B 200 17.316 -1.348 -12.084 1.00 0.00 O
+ATOM 3098 CB ALA B 200 16.759 -1.973 -15.217 1.00 0.00 C
+ATOM 3099 H ALA B 200 18.270 -0.156 -16.147 1.00 0.00 H
+ATOM 3100 HA ALA B 200 16.281 -0.221 -14.109 1.00 0.00 H
+ATOM 3101 1HB ALA B 200 16.146 -2.628 -14.597 1.00 0.00 H
+ATOM 3102 2HB ALA B 200 16.182 -1.650 -16.084 1.00 0.00 H
+ATOM 3103 3HB ALA B 200 17.643 -2.513 -15.550 1.00 0.00 H
+ATOM 3104 N ARG B 201 19.229 -1.381 -13.269 1.00 0.00 N
+ATOM 3105 CA ARG B 201 20.054 -1.787 -12.137 1.00 0.00 C
+ATOM 3106 C ARG B 201 20.272 -0.631 -11.171 1.00 0.00 C
+ATOM 3107 O ARG B 201 20.299 -0.821 -9.956 1.00 0.00 O
+ATOM 3108 CB ARG B 201 21.403 -2.304 -12.616 1.00 0.00 C
+ATOM 3109 CG ARG B 201 21.353 -3.634 -13.352 1.00 0.00 C
+ATOM 3110 CD ARG B 201 22.633 -3.925 -14.048 1.00 0.00 C
+ATOM 3111 NE ARG B 201 23.714 -4.179 -13.109 1.00 0.00 N
+ATOM 3112 CZ ARG B 201 25.024 -4.153 -13.426 1.00 0.00 C
+ATOM 3113 NH1 ARG B 201 25.397 -3.885 -14.657 1.00 0.00 N
+ATOM 3114 NH2 ARG B 201 25.933 -4.399 -12.498 1.00 0.00 N
+ATOM 3115 H ARG B 201 19.663 -1.241 -14.170 1.00 0.00 H
+ATOM 3116 HA ARG B 201 19.538 -2.585 -11.602 1.00 0.00 H
+ATOM 3117 1HB ARG B 201 21.855 -1.574 -13.285 1.00 0.00 H
+ATOM 3118 2HB ARG B 201 22.070 -2.424 -11.763 1.00 0.00 H
+ATOM 3119 1HG ARG B 201 21.159 -4.437 -12.641 1.00 0.00 H
+ATOM 3120 2HG ARG B 201 20.556 -3.608 -14.097 1.00 0.00 H
+ATOM 3121 1HD ARG B 201 22.513 -4.806 -14.676 1.00 0.00 H
+ATOM 3122 2HD ARG B 201 22.912 -3.073 -14.667 1.00 0.00 H
+ATOM 3123 HE ARG B 201 23.466 -4.389 -12.152 1.00 0.00 H
+ATOM 3124 1HH1 ARG B 201 24.702 -3.697 -15.366 1.00 0.00 H
+ATOM 3125 2HH1 ARG B 201 26.378 -3.866 -14.895 1.00 0.00 H
+ATOM 3126 1HH2 ARG B 201 25.645 -4.606 -11.551 1.00 0.00 H
+ATOM 3127 2HH2 ARG B 201 26.913 -4.380 -12.735 1.00 0.00 H
+ATOM 3128 N ARG B 202 20.426 0.570 -11.718 1.00 0.00 N
+ATOM 3129 CA ARG B 202 20.640 1.761 -10.905 1.00 0.00 C
+ATOM 3130 C ARG B 202 19.350 2.204 -10.227 1.00 0.00 C
+ATOM 3131 O ARG B 202 19.370 2.729 -9.115 1.00 0.00 O
+ATOM 3132 CB ARG B 202 21.179 2.901 -11.757 1.00 0.00 C
+ATOM 3133 CG ARG B 202 22.613 2.723 -12.229 1.00 0.00 C
+ATOM 3134 CD ARG B 202 23.084 3.896 -13.010 1.00 0.00 C
+ATOM 3135 NE ARG B 202 24.413 3.684 -13.560 1.00 0.00 N
+ATOM 3136 CZ ARG B 202 25.560 3.837 -12.870 1.00 0.00 C
+ATOM 3137 NH1 ARG B 202 25.524 4.203 -11.608 1.00 0.00 N
+ATOM 3138 NH2 ARG B 202 26.721 3.619 -13.462 1.00 0.00 N
+ATOM 3139 H ARG B 202 20.394 0.660 -12.724 1.00 0.00 H
+ATOM 3140 HA ARG B 202 21.374 1.526 -10.134 1.00 0.00 H
+ATOM 3141 1HB ARG B 202 20.554 3.022 -12.640 1.00 0.00 H
+ATOM 3142 2HB ARG B 202 21.131 3.832 -11.192 1.00 0.00 H
+ATOM 3143 1HG ARG B 202 23.268 2.601 -11.366 1.00 0.00 H
+ATOM 3144 2HG ARG B 202 22.680 1.839 -12.865 1.00 0.00 H
+ATOM 3145 1HD ARG B 202 22.398 4.082 -13.836 1.00 0.00 H
+ATOM 3146 2HD ARG B 202 23.118 4.773 -12.363 1.00 0.00 H
+ATOM 3147 HE ARG B 202 24.481 3.401 -14.529 1.00 0.00 H
+ATOM 3148 1HH1 ARG B 202 24.636 4.369 -11.155 1.00 0.00 H
+ATOM 3149 2HH1 ARG B 202 26.383 4.317 -11.091 1.00 0.00 H
+ATOM 3150 1HH2 ARG B 202 26.749 3.338 -14.433 1.00 0.00 H
+ATOM 3151 2HH2 ARG B 202 27.580 3.734 -12.945 1.00 0.00 H
+ATOM 3152 N LYS B 203 18.227 1.989 -10.905 1.00 0.00 N
+ATOM 3153 CA LYS B 203 16.926 2.373 -10.373 1.00 0.00 C
+ATOM 3154 C LYS B 203 16.515 1.470 -9.217 1.00 0.00 C
+ATOM 3155 O LYS B 203 16.965 1.659 -8.119 1.00 0.00 O
+ATOM 3156 OXT LYS B 203 15.743 0.571 -9.402 1.00 0.00 O
+ATOM 3157 CB LYS B 203 15.865 2.332 -11.474 1.00 0.00 C
+ATOM 3158 CG LYS B 203 14.476 2.768 -11.026 1.00 0.00 C
+ATOM 3159 CD LYS B 203 13.495 2.772 -12.189 1.00 0.00 C
+ATOM 3160 CE LYS B 203 12.069 3.001 -11.711 1.00 0.00 C
+ATOM 3161 NZ LYS B 203 11.089 2.924 -12.828 1.00 0.00 N
+ATOM 3162 H LYS B 203 18.277 1.548 -11.813 1.00 0.00 H
+ATOM 3163 HA LYS B 203 16.993 3.393 -9.992 1.00 0.00 H
+ATOM 3164 1HB LYS B 203 16.169 2.980 -12.297 1.00 0.00 H
+ATOM 3165 2HB LYS B 203 15.786 1.319 -11.868 1.00 0.00 H
+ATOM 3166 1HG LYS B 203 14.111 2.086 -10.257 1.00 0.00 H
+ATOM 3167 2HG LYS B 203 14.528 3.771 -10.603 1.00 0.00 H
+ATOM 3168 1HD LYS B 203 13.766 3.561 -12.891 1.00 0.00 H
+ATOM 3169 2HD LYS B 203 13.544 1.815 -12.709 1.00 0.00 H
+ATOM 3170 1HE LYS B 203 11.811 2.251 -10.965 1.00 0.00 H
+ATOM 3171 2HE LYS B 203 11.995 3.984 -11.247 1.00 0.00 H
+ATOM 3172 1HZ LYS B 203 10.157 3.082 -12.471 1.00 0.00 H
+ATOM 3173 2HZ LYS B 203 11.308 3.629 -13.518 1.00 0.00 H
+ATOM 3174 3HZ LYS B 203 11.135 2.010 -13.255 1.00 0.00 H
+TER
+REMARK PDBinfo-LABEL: 1 CONTEXT
+REMARK PDBinfo-LABEL: 2 CONTEXT
+REMARK PDBinfo-LABEL: 3 CONTEXT
+REMARK PDBinfo-LABEL: 4 CONTEXT
+REMARK PDBinfo-LABEL: 5 CONTEXT
+REMARK PDBinfo-LABEL: 6 CONTEXT
+REMARK PDBinfo-LABEL: 7 CONTEXT
+REMARK PDBinfo-LABEL: 8 CONTEXT
+REMARK PDBinfo-LABEL: 9 CONTEXT
+REMARK PDBinfo-LABEL: 10 CONTEXT
+REMARK PDBinfo-LABEL: 11 CONTEXT
+REMARK PDBinfo-LABEL: 12 CONTEXT
+REMARK PDBinfo-LABEL: 13 CONTEXT
+REMARK PDBinfo-LABEL: 14 CONTEXT
+REMARK PDBinfo-LABEL: 15 CONTEXT
+REMARK PDBinfo-LABEL: 16 CONTEXT
+REMARK PDBinfo-LABEL: 17 CONTEXT
+REMARK PDBinfo-LABEL: 18 CONTEXT
+REMARK PDBinfo-LABEL: 19 CONTEXT
+REMARK PDBinfo-LABEL: 20 CONTEXT
+REMARK PDBinfo-LABEL: 21 CONTEXT
+REMARK PDBinfo-LABEL: 22 CONTEXT
+REMARK PDBinfo-LABEL: 23 CONTEXT
+REMARK PDBinfo-LABEL: 24 CONTEXT
+REMARK PDBinfo-LABEL: 25 CONTEXT
+REMARK PDBinfo-LABEL: 26 CONTEXT
+REMARK PDBinfo-LABEL: 27 CONTEXT
+REMARK PDBinfo-LABEL: 28 CONTEXT
+REMARK PDBinfo-LABEL: 29 CONTEXT
+REMARK PDBinfo-LABEL: 30 CONTEXT
+REMARK PDBinfo-LABEL: 31 CONTEXT
+REMARK PDBinfo-LABEL: 32 CONTEXT
+REMARK PDBinfo-LABEL: 33 CONTEXT
+REMARK PDBinfo-LABEL: 34 CONTEXT
+REMARK PDBinfo-LABEL: 35 CONTEXT
+REMARK PDBinfo-LABEL: 36 CONTEXT
+REMARK PDBinfo-LABEL: 37 CONTEXT
+REMARK PDBinfo-LABEL: 38 CONTEXT
+REMARK PDBinfo-LABEL: 39 CONTEXT
+REMARK PDBinfo-LABEL: 40 CONTEXT
+REMARK PDBinfo-LABEL: 41 CONTEXT
+REMARK PDBinfo-LABEL: 42 CONTEXT
+REMARK PDBinfo-LABEL: 43 CONTEXT
+REMARK PDBinfo-LABEL: 44 CONTEXT
+REMARK PDBinfo-LABEL: 45 CONTEXT
+REMARK PDBinfo-LABEL: 46 CONTEXT
+REMARK PDBinfo-LABEL: 47 CONTEXT
+REMARK PDBinfo-LABEL: 48 CONTEXT
+REMARK PDBinfo-LABEL: 49 CONTEXT
+REMARK PDBinfo-LABEL: 50 CONTEXT
+REMARK PDBinfo-LABEL: 51 CONTEXT
+REMARK PDBinfo-LABEL: 52 CONTEXT
+REMARK PDBinfo-LABEL: 53 CONTEXT
+REMARK PDBinfo-LABEL: 54 CONTEXT
+REMARK PDBinfo-LABEL: 55 CONTEXT
+REMARK PDBinfo-LABEL: 56 CONTEXT
+REMARK PDBinfo-LABEL: 57 CONTEXT
+REMARK PDBinfo-LABEL: 58 CONTEXT
+REMARK PDBinfo-LABEL: 59 CONTEXT
+REMARK PDBinfo-LABEL: 60 CONTEXT
+REMARK PDBinfo-LABEL: 61 CONTEXT
+REMARK PDBinfo-LABEL: 62 CONTEXT
+REMARK PDBinfo-LABEL: 63 CONTEXT
+REMARK PDBinfo-LABEL: 64 CONTEXT
+REMARK PDBinfo-LABEL: 65 CONTEXT
+REMARK PDBinfo-LABEL: 66 CONTEXT
+REMARK PDBinfo-LABEL: 67 CONTEXT
+REMARK PDBinfo-LABEL: 68 CONTEXT
+REMARK PDBinfo-LABEL: 69 CONTEXT
+REMARK PDBinfo-LABEL: 70 CONTEXT
+REMARK PDBinfo-LABEL: 71 CONTEXT
+REMARK PDBinfo-LABEL: 72 CONTEXT
+REMARK PDBinfo-LABEL: 73 CONTEXT
+REMARK PDBinfo-LABEL: 74 CONTEXT
+REMARK PDBinfo-LABEL: 75 CONTEXT
+REMARK PDBinfo-LABEL: 76 CONTEXT
+REMARK PDBinfo-LABEL: 77 CONTEXT
+REMARK PDBinfo-LABEL: 78 CONTEXT
+REMARK PDBinfo-LABEL: 79 CONTEXT
+REMARK PDBinfo-LABEL: 80 CONTEXT
+REMARK PDBinfo-LABEL: 81 CONTEXT
+REMARK PDBinfo-LABEL: 82 CONTEXT
+REMARK PDBinfo-LABEL: 83 CONTEXT
+REMARK PDBinfo-LABEL: 84 CONTEXT
+REMARK PDBinfo-LABEL: 85 CONTEXT
+REMARK PDBinfo-LABEL: 86 CONTEXT
+REMARK PDBinfo-LABEL: 87 CONTEXT
+REMARK PDBinfo-LABEL: 88 CONTEXT
+REMARK PDBinfo-LABEL: 89 CONTEXT
+REMARK PDBinfo-LABEL: 90 CONTEXT
+REMARK PDBinfo-LABEL: 91 CONTEXT
+REMARK PDBinfo-LABEL: 92 CONTEXT
+REMARK PDBinfo-LABEL: 93 CONTEXT
+REMARK PDBinfo-LABEL: 94 CONTEXT
+REMARK PDBinfo-LABEL: 95 CONTEXT
+REMARK PDBinfo-LABEL: 96 CONTEXT
+REMARK PDBinfo-LABEL: 97 CONTEXT
+REMARK PDBinfo-LABEL: 98 CONTEXT
+REMARK PDBinfo-LABEL: 99 CONTEXT
+REMARK PDBinfo-LABEL: 100 CONTEXT
+REMARK PDBinfo-LABEL: 101 CONTEXT
+REMARK PDBinfo-LABEL: 102 CONTEXT
+REMARK PDBinfo-LABEL: 103 CONTEXT
+REMARK PDBinfo-LABEL: 104 CONTEXT
+REMARK PDBinfo-LABEL: 105 CONTEXT
+REMARK PDBinfo-LABEL: 106 CONTEXT
+REMARK PDBinfo-LABEL: 107 CONTEXT
+REMARK PDBinfo-LABEL: 108 CONTEXT
+REMARK PDBinfo-LABEL: 109 CONTEXT
+REMARK PDBinfo-LABEL: 110 CONTEXT
+REMARK PDBinfo-LABEL: 111 CONTEXT
+REMARK PDBinfo-LABEL: 112 CONTEXT
+REMARK PDBinfo-LABEL: 113 CONTEXT
+REMARK PDBinfo-LABEL: 114 CONTEXT
+REMARK PDBinfo-LABEL: 115 CONTEXT
+REMARK PDBinfo-LABEL: 116 CONTEXT
+REMARK PDBinfo-LABEL: 117 CONTEXT
+REMARK PDBinfo-LABEL: 118 CONTEXT
+REMARK PDBinfo-LABEL: 119 CONTEXT
+REMARK PDBinfo-LABEL: 120 CONTEXT
+REMARK PDBinfo-LABEL: 121 CONTEXT
+REMARK PDBinfo-LABEL: 122 CONTEXT
+REMARK PDBinfo-LABEL: 123 CONTEXT
+REMARK PDBinfo-LABEL: 124 CONTEXT
+REMARK PDBinfo-LABEL: 125 CONTEXT
+REMARK PDBinfo-LABEL: 126 CONTEXT
+REMARK PDBinfo-LABEL: 127 CONTEXT
+REMARK PDBinfo-LABEL: 128 CONTEXT
+REMARK PDBinfo-LABEL: 129 CONTEXT
+REMARK PDBinfo-LABEL: 130 CONTEXT
+REMARK PDBinfo-LABEL: 131 CONTEXT
+REMARK PDBinfo-LABEL: 132 CONTEXT
+REMARK PDBinfo-LABEL: 133 CONTEXT
+REMARK PDBinfo-LABEL: 134 CONTEXT
+REMARK PDBinfo-LABEL: 135 CONTEXT
+REMARK PDBinfo-LABEL: 136 CONTEXT
+REMARK PDBinfo-LABEL: 137 CONTEXT
+REMARK PDBinfo-LABEL: 138 CONTEXT
+REMARK PDBinfo-LABEL: 139 CONTEXT
+REMARK PDBinfo-LABEL: 140 CONTEXT
+REMARK PDBinfo-LABEL: 141 CONTEXT
+REMARK PDBinfo-LABEL: 142 CONTEXT
+REMARK PDBinfo-LABEL: 143 TEMPLATE
+REMARK PDBinfo-LABEL: 144 TEMPLATE
+REMARK PDBinfo-LABEL: 145 TEMPLATE
+REMARK PDBinfo-LABEL: 146 TEMPLATE
+REMARK PDBinfo-LABEL: 147 TEMPLATE
+REMARK PDBinfo-LABEL: 148 TEMPLATE
+REMARK PDBinfo-LABEL: 149 TEMPLATE
+REMARK PDBinfo-LABEL: 150 TEMPLATE
+REMARK PDBinfo-LABEL: 151 TEMPLATE
+REMARK PDBinfo-LABEL: 152 TEMPLATE
+REMARK PDBinfo-LABEL: 153 TEMPLATE
+REMARK PDBinfo-LABEL: 154 TEMPLATE
+REMARK PDBinfo-LABEL: 155 TEMPLATE
+REMARK PDBinfo-LABEL: 156 TEMPLATE
+REMARK PDBinfo-LABEL: 157 TEMPLATE
+REMARK PDBinfo-LABEL: 158 TEMPLATE
+REMARK PDBinfo-LABEL: 159 TEMPLATE
+REMARK PDBinfo-LABEL: 160 TEMPLATE
+REMARK PDBinfo-LABEL: 161 TEMPLATE
+REMARK PDBinfo-LABEL: 162 TEMPLATE
+REMARK PDBinfo-LABEL: 163 TEMPLATE
+REMARK PDBinfo-LABEL: 164 TEMPLATE
+REMARK PDBinfo-LABEL: 165 TEMPLATE
+REMARK PDBinfo-LABEL: 166 TEMPLATE
+REMARK PDBinfo-LABEL: 167 TEMPLATE
+REMARK PDBinfo-LABEL: 168 TEMPLATE
+REMARK PDBinfo-LABEL: 169 TEMPLATE
+REMARK PDBinfo-LABEL: 170 TEMPLATE
+REMARK PDBinfo-LABEL: 171 MOTIF HOTSPOT HOTIN:1 CONNECTION FLEXIBLE
+REMARK PDBinfo-LABEL: 172 MOTIF
+REMARK PDBinfo-LABEL: 173 MOTIF
+REMARK PDBinfo-LABEL: 174 MOTIF HOTSPOT HOTIN:2
+REMARK PDBinfo-LABEL: 175 MOTIF
+REMARK PDBinfo-LABEL: 176 MOTIF
+REMARK PDBinfo-LABEL: 177 MOTIF HOTSPOT HOTIN:3
+REMARK PDBinfo-LABEL: 178 MOTIF HOTSPOT HOTIN:4
+REMARK PDBinfo-LABEL: 179 MOTIF
+REMARK PDBinfo-LABEL: 180 MOTIF
+REMARK PDBinfo-LABEL: 181 MOTIF HOTSPOT HOTIN:5 CONNECTION FLEXIBLE
+REMARK PDBinfo-LABEL: 182 TEMPLATE
+REMARK PDBinfo-LABEL: 183 TEMPLATE
+REMARK PDBinfo-LABEL: 184 TEMPLATE
+REMARK PDBinfo-LABEL: 185 TEMPLATE
+REMARK PDBinfo-LABEL: 186 TEMPLATE
+REMARK PDBinfo-LABEL: 187 TEMPLATE
+REMARK PDBinfo-LABEL: 188 TEMPLATE
+REMARK PDBinfo-LABEL: 189 TEMPLATE
+REMARK PDBinfo-LABEL: 190 TEMPLATE
+REMARK PDBinfo-LABEL: 191 TEMPLATE
+REMARK PDBinfo-LABEL: 192 TEMPLATE
+REMARK PDBinfo-LABEL: 193 TEMPLATE
+REMARK PDBinfo-LABEL: 194 TEMPLATE
+REMARK PDBinfo-LABEL: 195 TEMPLATE
+REMARK PDBinfo-LABEL: 196 TEMPLATE
+REMARK PDBinfo-LABEL: 197 TEMPLATE
+REMARK PDBinfo-LABEL: 198 TEMPLATE
+REMARK PDBinfo-LABEL: 199 TEMPLATE
+REMARK PDBinfo-LABEL: 200 TEMPLATE
+REMARK PDBinfo-LABEL: 201 TEMPLATE
+REMARK PDBinfo-LABEL: 202 TEMPLATE
+REMARK PDBinfo-LABEL: 203 TEMPLATE
+
+DisulfideBondEnergys -0.479110417852734
+PHI 0.0,-63.066409072014544,-67.04856736545167,-64.30724728068277,-63.03006479982118,-56.51727495440879,-60.33770135763949,-64.34140173847284,-60.741308835939606,-59.229010125575925,-64.4654800229189,-63.8616878350536,-61.856582968565895,-65.30454709002329,-67.51714647551802,-62.01458219538424,-48.989000932285144,-62.76526733873899,-66.63635664910333,-90.99050070261548,101.35511917212877,-80.59069830653486,-69.09526233955586,-62.254168388474376,-68.48914002980108,-62.65969673708785,-56.19338984347786,-66.87788656733198,-59.9346623841219,-54.65192873113608,-64.67742491866514,-61.76092218042777,-68.71182546677973,-64.03455235271528,-61.973369724524275,-56.474048339287584,-74.4349895789672,-58.91752577715759,-70.02554820790336,-98.50776364351817,81.58229221286395,-76.86592903046368,-69.8747826070579,-59.93411164537693,-63.29987274363059,-65.66887179236247,-65.07163176275441,-61.68239827299507,-58.29914205060763,-58.855361118850475,-60.03450439676962,-62.613924088022415,-65.59177161152263,-59.36468021783808,-62.13655879771187,-59.70863500384118,-62.83266079024613,-62.56284760219102,-74.1231684690325,-74.74002282564724,-71.30273528513163
+PSI -58.21294095781351,-37.472080068719954,-43.71622504273529,-41.3710149117031,-42.78913103334154,-50.03775176793713,-40.790618643616256,-41.56707125170894,-42.687605565250784,-47.2315077776677,-39.41520958266988,-41.17294671246276,-41.567545474970714,-40.31274872116958,-42.81987219579195,-36.12702002293901,-45.32763339607271,-40.584434729102114,-22.411826529299802,5.068007796397768,10.909423756673725,133.6952608352768,163.0335827753448,-37.3693995026885,-43.101526452722396,-37.321815476654365,-49.84835563568728,-38.138922069815045,-43.296059492353294,-46.01495615003198,-44.06709710549002,-42.99728858888025,-38.10858701731234,-38.694822477791604,-44.954191189088476,-36.16599115644938,-41.305659048200944,-38.08801452705831,-13.545010358276407,1.707575634562634,26.223746945246308,135.11122735611983,162.02114901672533,-44.25273776993221,-39.33839397849147,-39.23997170494911,-40.84099231231892,-45.85670728924942,-45.05571278443428,-48.251756137998726,-42.52260600125149,-42.59578481676662,-43.77295991531138,-47.467181900442746,-44.782523543973966,-45.20720483229782,-40.249813416963704,-35.78999485422671,-37.27686800083043,-33.18232111952684,0.0
+SSE LHHHHHHHHHHHHHHHHHHLLLLHHHHHHHHHHHHHHHHHLLLHHHHHHHHHHHHHHHHHL
+denovo_sequence DEEEECEKIIEELLEKARKLGVSEIEYYIARLLLVALKLRGVSCEELQKFAEEFIEEARRK
+ss4pred_ss LLHHHHHHHHHHHHHHHHHLLLLHHHHHHHHHHHHHHHHLLLLHHHHHHHHHHHHHHHHLL
+AlaCount 5
+AverageDegree 14.2459
+Buried_non_polar_SASA_per_res 54.7297
+CavityVolume 463.676
+CoreAverageDegree 19.4667
+CoreResidueCount 15
+DisulfideBondSpanHotspot 5
+ExposeCoreHydrophobicsPerCoreResidue 16.872
+ExposeCoreHydrophobicsSASA 253.081
+ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent 9.691
+ExposedHydrophobics_on_TotalSASAPercent 5.559
+GeometryScore 0
+InterfaceAverageDegree 9
+InterfaceDAlphaBallBuriedUnsatHbondFilter 0
+InterfaceHoles -0.570796
+PackStat 0.526351
+Rg 11.674
+SBUNS 1
+SSShapeComplementarity 0.653824
+ScorePerResFilter -1.91565
+VBUNS 0
+aploar_cms_ 351.087
+cms_ 404.698
+complex_normalized -1.82289
+dG_cross -54.8306
+dG_cross/dSASAx100 -3.42379
+dG_separated -40.885
+dG_separated/dSASAx100 -2.55298
+dSASA_hphobic 1144.9
+dSASA_int 1601.46
+dSASA_polar 456.562
+delta_sap 35.8135
+delta_unsatHbonds 3
+denovo_interface_sap 37.3512
+frac_helix 85.2459
+frac_loop 14.7541
+frac_sheet 0
+hbond_E_fraction 0.109892
+hbonds_int 5
+n_hydrophobic 26
+netcharge -6
+nres_all 203
+nres_helix 52
+nres_int 62
+nres_loop 9
+nres_sheet 0
+nres_total 61
+packstat 0
+per_residue_energy_int -2.59753
+sc_value 0.74767
+side1_normalized -3.32334
+side1_score -66.4669
+side2_normalized -2.2519
+side2_score -94.5799
+ss4pred_mismatch_rate 0.0491803
+ss_mismatch_probability 0.255008
+target_interface_sap 29.8932
+total_score -139.919
+
diff --git a/8_Filter/data/denovo_hee.pdb b/8_Filter/data/denovo_hee.pdb
new file mode 100644
index 0000000..63fe283
--- /dev/null
+++ b/8_Filter/data/denovo_hee.pdb
@@ -0,0 +1,653 @@
+HEADER 25-JUL-20 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 25-JUL-20
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2019.50+release.91b7a94
+SSBOND CYS A 18 CYS A 20 2.25
+ATOM 1 N ASP A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA ASP A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C ASP A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O ASP A 1 3.143 1.656 -0.416 1.00 0.00 O
+ATOM 5 CB ASP A 1 1.995 -0.762 -1.214 1.00 0.00 C
+ATOM 6 CG ASP A 1 1.474 -0.212 -2.536 1.00 0.00 C
+ATOM 7 OD1 ASP A 1 0.566 0.585 -2.509 1.00 0.00 O
+ATOM 8 OD2 ASP A 1 1.989 -0.595 -3.559 1.00 0.00 O
+ATOM 9 1H ASP A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 10 2H ASP A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 11 3H ASP A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 12 HA ASP A 1 1.804 -0.509 0.900 1.00 0.00 H
+ATOM 13 1HB ASP A 1 3.084 -0.714 -1.222 1.00 0.00 H
+ATOM 14 2HB ASP A 1 1.713 -1.813 -1.138 1.00 0.00 H
+ATOM 15 N SER A 2 1.199 2.364 0.469 1.00 0.00 N
+ATOM 16 CA SER A 2 1.604 3.763 0.524 1.00 0.00 C
+ATOM 17 C SER A 2 0.937 4.484 1.687 1.00 0.00 C
+ATOM 18 O SER A 2 -0.095 4.043 2.194 1.00 0.00 O
+ATOM 19 CB SER A 2 1.258 4.458 -0.779 1.00 0.00 C
+ATOM 20 OG SER A 2 -0.130 4.519 -0.962 1.00 0.00 O
+ATOM 21 H SER A 2 0.279 2.104 0.795 1.00 0.00 H
+ATOM 22 HA SER A 2 2.685 3.805 0.660 1.00 0.00 H
+ATOM 23 1HB SER A 2 1.672 5.466 -0.775 1.00 0.00 H
+ATOM 24 2HB SER A 2 1.714 3.921 -1.610 1.00 0.00 H
+ATOM 25 HG SER A 2 -0.269 5.038 -1.758 1.00 0.00 H
+ATOM 26 N LEU A 3 1.531 5.596 2.107 1.00 0.00 N
+ATOM 27 CA LEU A 3 0.946 6.431 3.150 1.00 0.00 C
+ATOM 28 C LEU A 3 1.249 7.905 2.909 1.00 0.00 C
+ATOM 29 O LEU A 3 2.401 8.287 2.706 1.00 0.00 O
+ATOM 30 CB LEU A 3 1.478 6.011 4.526 1.00 0.00 C
+ATOM 31 CG LEU A 3 1.048 6.895 5.703 1.00 0.00 C
+ATOM 32 CD1 LEU A 3 -0.453 6.761 5.918 1.00 0.00 C
+ATOM 33 CD2 LEU A 3 1.817 6.489 6.951 1.00 0.00 C
+ATOM 34 H LEU A 3 2.411 5.870 1.694 1.00 0.00 H
+ATOM 35 HA LEU A 3 -0.135 6.290 3.140 1.00 0.00 H
+ATOM 36 1HB LEU A 3 1.142 4.997 4.733 1.00 0.00 H
+ATOM 37 2HB LEU A 3 2.568 6.012 4.492 1.00 0.00 H
+ATOM 38 HG LEU A 3 1.259 7.940 5.471 1.00 0.00 H
+ATOM 39 1HD1 LEU A 3 -0.759 7.389 6.754 1.00 0.00 H
+ATOM 40 2HD1 LEU A 3 -0.980 7.076 5.016 1.00 0.00 H
+ATOM 41 3HD1 LEU A 3 -0.698 5.722 6.136 1.00 0.00 H
+ATOM 42 1HD2 LEU A 3 1.512 7.118 7.788 1.00 0.00 H
+ATOM 43 2HD2 LEU A 3 1.606 5.445 7.185 1.00 0.00 H
+ATOM 44 3HD2 LEU A 3 2.886 6.612 6.776 1.00 0.00 H
+ATOM 45 N HIS A 4 0.207 8.729 2.934 1.00 0.00 N
+ATOM 46 CA HIS A 4 0.370 10.174 2.831 1.00 0.00 C
+ATOM 47 C HIS A 4 0.503 10.812 4.208 1.00 0.00 C
+ATOM 48 O HIS A 4 -0.339 10.608 5.081 1.00 0.00 O
+ATOM 49 CB HIS A 4 -0.811 10.800 2.083 1.00 0.00 C
+ATOM 50 CG HIS A 4 -0.726 12.290 1.965 1.00 0.00 C
+ATOM 51 ND1 HIS A 4 -1.083 13.140 2.991 1.00 0.00 N
+ATOM 52 CD2 HIS A 4 -0.326 13.083 0.942 1.00 0.00 C
+ATOM 53 CE1 HIS A 4 -0.905 14.391 2.604 1.00 0.00 C
+ATOM 54 NE2 HIS A 4 -0.447 14.383 1.366 1.00 0.00 N
+ATOM 55 H HIS A 4 -0.723 8.344 3.026 1.00 0.00 H
+ATOM 56 HA HIS A 4 1.277 10.380 2.261 1.00 0.00 H
+ATOM 57 1HB HIS A 4 -0.869 10.381 1.078 1.00 0.00 H
+ATOM 58 2HB HIS A 4 -1.740 10.551 2.596 1.00 0.00 H
+ATOM 59 HD1 HIS A 4 -1.353 12.869 3.915 1.00 0.00 H
+ATOM 60 HD2 HIS A 4 0.040 12.867 -0.062 1.00 0.00 H
+ATOM 61 HE1 HIS A 4 -1.131 15.217 3.278 1.00 0.00 H
+ATOM 62 N ILE A 5 1.566 11.587 4.395 1.00 0.00 N
+ATOM 63 CA ILE A 5 1.844 12.209 5.684 1.00 0.00 C
+ATOM 64 C ILE A 5 1.579 13.708 5.642 1.00 0.00 C
+ATOM 65 O ILE A 5 2.139 14.424 4.812 1.00 0.00 O
+ATOM 66 CB ILE A 5 3.301 11.957 6.113 1.00 0.00 C
+ATOM 67 CG1 ILE A 5 3.593 10.454 6.156 1.00 0.00 C
+ATOM 68 CG2 ILE A 5 3.576 12.595 7.466 1.00 0.00 C
+ATOM 69 CD1 ILE A 5 5.066 10.117 6.127 1.00 0.00 C
+ATOM 70 H ILE A 5 2.198 11.750 3.624 1.00 0.00 H
+ATOM 71 HA ILE A 5 1.191 11.759 6.433 1.00 0.00 H
+ATOM 72 HB ILE A 5 3.977 12.387 5.375 1.00 0.00 H
+ATOM 73 1HG1 ILE A 5 3.162 10.026 7.061 1.00 0.00 H
+ATOM 74 2HG1 ILE A 5 3.116 9.966 5.306 1.00 0.00 H
+ATOM 75 1HG2 ILE A 5 4.610 12.406 7.754 1.00 0.00 H
+ATOM 76 2HG2 ILE A 5 3.407 13.669 7.402 1.00 0.00 H
+ATOM 77 3HG2 ILE A 5 2.907 12.166 8.212 1.00 0.00 H
+ATOM 78 1HD1 ILE A 5 5.192 9.035 6.160 1.00 0.00 H
+ATOM 79 2HD1 ILE A 5 5.511 10.506 5.210 1.00 0.00 H
+ATOM 80 3HD1 ILE A 5 5.559 10.566 6.988 1.00 0.00 H
+ATOM 81 N ASN A 6 0.720 14.177 6.541 1.00 0.00 N
+ATOM 82 CA ASN A 6 0.466 15.606 6.684 1.00 0.00 C
+ATOM 83 C ASN A 6 1.105 16.155 7.953 1.00 0.00 C
+ATOM 84 O ASN A 6 0.624 15.907 9.059 1.00 0.00 O
+ATOM 85 CB ASN A 6 -1.026 15.886 6.673 1.00 0.00 C
+ATOM 86 CG ASN A 6 -1.338 17.356 6.734 1.00 0.00 C
+ATOM 87 OD1 ASN A 6 -0.534 18.154 7.230 1.00 0.00 O
+ATOM 88 ND2 ASN A 6 -2.490 17.729 6.239 1.00 0.00 N
+ATOM 89 H ASN A 6 0.232 13.528 7.140 1.00 0.00 H
+ATOM 90 HA ASN A 6 0.896 16.122 5.825 1.00 0.00 H
+ATOM 91 1HB ASN A 6 -1.468 15.470 5.767 1.00 0.00 H
+ATOM 92 2HB ASN A 6 -1.495 15.392 7.524 1.00 0.00 H
+ATOM 93 1HD2 ASN A 6 -2.751 18.695 6.253 1.00 0.00 H
+ATOM 94 2HD2 ASN A 6 -3.109 17.049 5.848 1.00 0.00 H
+ATOM 95 N LEU A 7 2.192 16.901 7.787 1.00 0.00 N
+ATOM 96 CA LEU A 7 2.859 17.544 8.913 1.00 0.00 C
+ATOM 97 C LEU A 7 2.644 19.052 8.891 1.00 0.00 C
+ATOM 98 O LEU A 7 3.399 19.787 8.254 1.00 0.00 O
+ATOM 99 CB LEU A 7 4.361 17.235 8.886 1.00 0.00 C
+ATOM 100 CG LEU A 7 5.193 17.881 10.002 1.00 0.00 C
+ATOM 101 CD1 LEU A 7 4.801 17.277 11.343 1.00 0.00 C
+ATOM 102 CD2 LEU A 7 6.673 17.671 9.719 1.00 0.00 C
+ATOM 103 H LEU A 7 2.566 17.025 6.857 1.00 0.00 H
+ATOM 104 HA LEU A 7 2.440 17.145 9.837 1.00 0.00 H
+ATOM 105 1HB LEU A 7 4.495 16.157 8.956 1.00 0.00 H
+ATOM 106 2HB LEU A 7 4.768 17.570 7.933 1.00 0.00 H
+ATOM 107 HG LEU A 7 4.979 18.950 10.043 1.00 0.00 H
+ATOM 108 1HD1 LEU A 7 5.392 17.736 12.136 1.00 0.00 H
+ATOM 109 2HD1 LEU A 7 3.742 17.459 11.529 1.00 0.00 H
+ATOM 110 3HD1 LEU A 7 4.988 16.204 11.327 1.00 0.00 H
+ATOM 111 1HD2 LEU A 7 7.264 18.131 10.511 1.00 0.00 H
+ATOM 112 2HD2 LEU A 7 6.887 16.602 9.679 1.00 0.00 H
+ATOM 113 3HD2 LEU A 7 6.929 18.128 8.763 1.00 0.00 H
+ATOM 114 N ASP A 8 1.610 19.508 9.589 1.00 0.00 N
+ATOM 115 CA ASP A 8 1.304 20.931 9.665 1.00 0.00 C
+ATOM 116 C ASP A 8 1.244 21.556 8.277 1.00 0.00 C
+ATOM 117 O ASP A 8 1.767 22.648 8.054 1.00 0.00 O
+ATOM 118 CB ASP A 8 2.348 21.661 10.514 1.00 0.00 C
+ATOM 119 CG ASP A 8 2.409 21.148 11.947 1.00 0.00 C
+ATOM 120 OD1 ASP A 8 1.399 20.705 12.442 1.00 0.00 O
+ATOM 121 OD2 ASP A 8 3.463 21.205 12.532 1.00 0.00 O
+ATOM 122 H ASP A 8 1.021 18.851 10.081 1.00 0.00 H
+ATOM 123 HA ASP A 8 0.332 21.051 10.145 1.00 0.00 H
+ATOM 124 1HB ASP A 8 3.332 21.544 10.060 1.00 0.00 H
+ATOM 125 2HB ASP A 8 2.120 22.727 10.535 1.00 0.00 H
+ATOM 126 N GLY A 9 0.602 20.858 7.346 1.00 0.00 N
+ATOM 127 CA GLY A 9 0.371 21.393 6.010 1.00 0.00 C
+ATOM 128 C GLY A 9 1.395 20.857 5.017 1.00 0.00 C
+ATOM 129 O GLY A 9 1.231 20.997 3.805 1.00 0.00 O
+ATOM 130 H GLY A 9 0.266 19.932 7.571 1.00 0.00 H
+ATOM 131 1HA GLY A 9 -0.634 21.127 5.680 1.00 0.00 H
+ATOM 132 2HA GLY A 9 0.423 22.480 6.040 1.00 0.00 H
+ATOM 133 N ILE A 10 2.452 20.243 5.539 1.00 0.00 N
+ATOM 134 CA ILE A 10 3.492 19.663 4.698 1.00 0.00 C
+ATOM 135 C ILE A 10 3.081 18.290 4.181 1.00 0.00 C
+ATOM 136 O ILE A 10 2.774 17.389 4.961 1.00 0.00 O
+ATOM 137 CB ILE A 10 4.819 19.544 5.470 1.00 0.00 C
+ATOM 138 CG1 ILE A 10 5.313 20.928 5.900 1.00 0.00 C
+ATOM 139 CG2 ILE A 10 5.867 18.841 4.622 1.00 0.00 C
+ATOM 140 CD1 ILE A 10 6.417 20.889 6.931 1.00 0.00 C
+ATOM 141 H ILE A 10 2.537 20.177 6.543 1.00 0.00 H
+ATOM 142 HA ILE A 10 3.658 20.323 3.846 1.00 0.00 H
+ATOM 143 HB ILE A 10 4.659 18.969 6.382 1.00 0.00 H
+ATOM 144 1HG1 ILE A 10 5.678 21.470 5.028 1.00 0.00 H
+ATOM 145 2HG1 ILE A 10 4.481 21.499 6.314 1.00 0.00 H
+ATOM 146 1HG2 ILE A 10 6.799 18.766 5.182 1.00 0.00 H
+ATOM 147 2HG2 ILE A 10 5.517 17.842 4.365 1.00 0.00 H
+ATOM 148 3HG2 ILE A 10 6.038 19.411 3.708 1.00 0.00 H
+ATOM 149 1HD1 ILE A 10 6.714 21.907 7.185 1.00 0.00 H
+ATOM 150 2HD1 ILE A 10 6.061 20.381 7.828 1.00 0.00 H
+ATOM 151 3HD1 ILE A 10 7.275 20.353 6.526 1.00 0.00 H
+ATOM 152 N ARG A 11 3.076 18.138 2.861 1.00 0.00 N
+ATOM 153 CA ARG A 11 2.633 16.899 2.234 1.00 0.00 C
+ATOM 154 C ARG A 11 3.820 16.047 1.801 1.00 0.00 C
+ATOM 155 O ARG A 11 4.593 16.441 0.928 1.00 0.00 O
+ATOM 156 CB ARG A 11 1.756 17.193 1.026 1.00 0.00 C
+ATOM 157 CG ARG A 11 0.449 17.901 1.343 1.00 0.00 C
+ATOM 158 CD ARG A 11 -0.377 18.101 0.124 1.00 0.00 C
+ATOM 159 NE ARG A 11 -0.868 16.842 -0.410 1.00 0.00 N
+ATOM 160 CZ ARG A 11 -1.498 16.707 -1.594 1.00 0.00 C
+ATOM 161 NH1 ARG A 11 -1.704 17.760 -2.353 1.00 0.00 N
+ATOM 162 NH2 ARG A 11 -1.908 15.515 -1.992 1.00 0.00 N
+ATOM 163 H ARG A 11 3.387 18.902 2.277 1.00 0.00 H
+ATOM 164 HA ARG A 11 2.045 16.335 2.959 1.00 0.00 H
+ATOM 165 1HB ARG A 11 2.305 17.814 0.321 1.00 0.00 H
+ATOM 166 2HB ARG A 11 1.511 16.260 0.519 1.00 0.00 H
+ATOM 167 1HG ARG A 11 -0.126 17.305 2.052 1.00 0.00 H
+ATOM 168 2HG ARG A 11 0.660 18.879 1.778 1.00 0.00 H
+ATOM 169 1HD ARG A 11 -1.235 18.728 0.365 1.00 0.00 H
+ATOM 170 2HD ARG A 11 0.222 18.588 -0.645 1.00 0.00 H
+ATOM 171 HE ARG A 11 -0.728 16.009 0.145 1.00 0.00 H
+ATOM 172 1HH1 ARG A 11 -1.390 18.671 -2.048 1.00 0.00 H
+ATOM 173 2HH1 ARG A 11 -2.175 17.659 -3.240 1.00 0.00 H
+ATOM 174 1HH2 ARG A 11 -1.749 14.705 -1.409 1.00 0.00 H
+ATOM 175 2HH2 ARG A 11 -2.379 15.414 -2.879 1.00 0.00 H
+ATOM 176 N PHE A 12 3.958 14.877 2.416 1.00 0.00 N
+ATOM 177 CA PHE A 12 5.055 13.970 2.100 1.00 0.00 C
+ATOM 178 C PHE A 12 4.587 12.521 2.096 1.00 0.00 C
+ATOM 179 O PHE A 12 3.916 12.072 3.026 1.00 0.00 O
+ATOM 180 CB PHE A 12 6.196 14.141 3.105 1.00 0.00 C
+ATOM 181 CG PHE A 12 7.349 13.205 2.878 1.00 0.00 C
+ATOM 182 CD1 PHE A 12 8.187 13.367 1.785 1.00 0.00 C
+ATOM 183 CD2 PHE A 12 7.597 12.161 3.756 1.00 0.00 C
+ATOM 184 CE1 PHE A 12 9.248 12.507 1.575 1.00 0.00 C
+ATOM 185 CE2 PHE A 12 8.657 11.300 3.549 1.00 0.00 C
+ATOM 186 CZ PHE A 12 9.483 11.474 2.457 1.00 0.00 C
+ATOM 187 H PHE A 12 3.286 14.610 3.121 1.00 0.00 H
+ATOM 188 HA PHE A 12 5.434 14.218 1.108 1.00 0.00 H
+ATOM 189 1HB PHE A 12 6.572 15.162 3.058 1.00 0.00 H
+ATOM 190 2HB PHE A 12 5.819 13.978 4.114 1.00 0.00 H
+ATOM 191 HD1 PHE A 12 8.002 14.185 1.089 1.00 0.00 H
+ATOM 192 HD2 PHE A 12 6.944 12.024 4.618 1.00 0.00 H
+ATOM 193 HE1 PHE A 12 9.899 12.646 0.712 1.00 0.00 H
+ATOM 194 HE2 PHE A 12 8.842 10.484 4.247 1.00 0.00 H
+ATOM 195 HZ PHE A 12 10.319 10.794 2.292 1.00 0.00 H
+ATOM 196 N GLU A 13 4.946 11.792 1.045 1.00 0.00 N
+ATOM 197 CA GLU A 13 4.486 10.419 0.872 1.00 0.00 C
+ATOM 198 C GLU A 13 5.606 9.424 1.147 1.00 0.00 C
+ATOM 199 O GLU A 13 6.763 9.665 0.802 1.00 0.00 O
+ATOM 200 CB GLU A 13 3.944 10.212 -0.544 1.00 0.00 C
+ATOM 201 CG GLU A 13 2.694 11.020 -0.862 1.00 0.00 C
+ATOM 202 CD GLU A 13 2.202 10.807 -2.267 1.00 0.00 C
+ATOM 203 OE1 GLU A 13 2.913 10.213 -3.042 1.00 0.00 O
+ATOM 204 OE2 GLU A 13 1.114 11.239 -2.566 1.00 0.00 O
+ATOM 205 H GLU A 13 5.553 12.199 0.348 1.00 0.00 H
+ATOM 206 HA GLU A 13 3.674 10.235 1.576 1.00 0.00 H
+ATOM 207 1HB GLU A 13 4.711 10.483 -1.270 1.00 0.00 H
+ATOM 208 2HB GLU A 13 3.709 9.158 -0.694 1.00 0.00 H
+ATOM 209 1HG GLU A 13 1.904 10.737 -0.167 1.00 0.00 H
+ATOM 210 2HG GLU A 13 2.909 12.077 -0.714 1.00 0.00 H
+ATOM 211 N VAL A 14 5.256 8.304 1.771 1.00 0.00 N
+ATOM 212 CA VAL A 14 6.182 7.187 1.918 1.00 0.00 C
+ATOM 213 C VAL A 14 5.574 5.894 1.390 1.00 0.00 C
+ATOM 214 O VAL A 14 4.358 5.787 1.234 1.00 0.00 O
+ATOM 215 CB VAL A 14 6.566 7.003 3.399 1.00 0.00 C
+ATOM 216 CG1 VAL A 14 7.270 8.246 3.925 1.00 0.00 C
+ATOM 217 CG2 VAL A 14 5.324 6.698 4.222 1.00 0.00 C
+ATOM 218 H VAL A 14 4.325 8.224 2.153 1.00 0.00 H
+ATOM 219 HA VAL A 14 7.085 7.409 1.347 1.00 0.00 H
+ATOM 220 HB VAL A 14 7.271 6.176 3.481 1.00 0.00 H
+ATOM 221 1HG1 VAL A 14 7.534 8.098 4.972 1.00 0.00 H
+ATOM 222 2HG1 VAL A 14 8.175 8.424 3.344 1.00 0.00 H
+ATOM 223 3HG1 VAL A 14 6.605 9.105 3.837 1.00 0.00 H
+ATOM 224 1HG2 VAL A 14 5.603 6.568 5.267 1.00 0.00 H
+ATOM 225 2HG2 VAL A 14 4.617 7.523 4.134 1.00 0.00 H
+ATOM 226 3HG2 VAL A 14 4.860 5.782 3.854 1.00 0.00 H
+ATOM 227 N HIS A 15 6.428 4.914 1.116 1.00 0.00 N
+ATOM 228 CA HIS A 15 5.983 3.647 0.548 1.00 0.00 C
+ATOM 229 C HIS A 15 6.641 2.467 1.253 1.00 0.00 C
+ATOM 230 O HIS A 15 7.731 2.593 1.809 1.00 0.00 O
+ATOM 231 CB HIS A 15 6.289 3.588 -0.952 1.00 0.00 C
+ATOM 232 CG HIS A 15 5.526 4.591 -1.761 1.00 0.00 C
+ATOM 233 ND1 HIS A 15 5.899 5.916 -1.847 1.00 0.00 N
+ATOM 234 CD2 HIS A 15 4.412 4.463 -2.519 1.00 0.00 C
+ATOM 235 CE1 HIS A 15 5.046 6.560 -2.625 1.00 0.00 C
+ATOM 236 NE2 HIS A 15 4.135 5.701 -3.045 1.00 0.00 N
+ATOM 237 H HIS A 15 7.411 5.050 1.305 1.00 0.00 H
+ATOM 238 HA HIS A 15 4.903 3.572 0.675 1.00 0.00 H
+ATOM 239 1HB HIS A 15 7.354 3.759 -1.113 1.00 0.00 H
+ATOM 240 2HB HIS A 15 6.056 2.594 -1.332 1.00 0.00 H
+ATOM 241 HD1 HIS A 15 6.726 6.324 -1.460 1.00 0.00 H
+ATOM 242 HD2 HIS A 15 3.768 3.614 -2.752 1.00 0.00 H
+ATOM 243 HE1 HIS A 15 5.169 7.625 -2.821 1.00 0.00 H
+ATOM 244 N GLY A 16 5.971 1.320 1.225 1.00 0.00 N
+ATOM 245 CA GLY A 16 6.509 0.103 1.821 1.00 0.00 C
+ATOM 246 C GLY A 16 5.592 -1.086 1.570 1.00 0.00 C
+ATOM 247 O GLY A 16 4.551 -0.955 0.926 1.00 0.00 O
+ATOM 248 H GLY A 16 5.065 1.290 0.779 1.00 0.00 H
+ATOM 249 1HA GLY A 16 7.497 -0.099 1.406 1.00 0.00 H
+ATOM 250 2HA GLY A 16 6.636 0.249 2.893 1.00 0.00 H
+ATOM 251 N ASP A 17 5.985 -2.248 2.080 1.00 0.00 N
+ATOM 252 CA ASP A 17 5.249 -3.482 1.833 1.00 0.00 C
+ATOM 253 C ASP A 17 4.453 -3.905 3.061 1.00 0.00 C
+ATOM 254 O ASP A 17 3.946 -5.025 3.129 1.00 0.00 O
+ATOM 255 CB ASP A 17 6.206 -4.606 1.426 1.00 0.00 C
+ATOM 256 CG ASP A 17 6.888 -4.348 0.090 1.00 0.00 C
+ATOM 257 OD1 ASP A 17 6.239 -3.852 -0.801 1.00 0.00 O
+ATOM 258 OD2 ASP A 17 8.052 -4.649 -0.028 1.00 0.00 O
+ATOM 259 H ASP A 17 6.815 -2.278 2.655 1.00 0.00 H
+ATOM 260 HA ASP A 17 4.555 -3.312 1.008 1.00 0.00 H
+ATOM 261 1HB ASP A 17 6.972 -4.725 2.192 1.00 0.00 H
+ATOM 262 2HB ASP A 17 5.657 -5.546 1.362 1.00 0.00 H
+ATOM 263 N CYS A 18 4.346 -3.002 4.030 1.00 0.00 N
+ATOM 264 CA CYS A 18 3.685 -3.308 5.293 1.00 0.00 C
+ATOM 265 C CYS A 18 3.176 -2.042 5.969 1.00 0.00 C
+ATOM 266 O CYS A 18 3.847 -1.010 5.961 1.00 0.00 O
+ATOM 267 CB CYS A 18 4.642 -4.036 6.238 1.00 0.00 C
+ATOM 268 SG CYS A 18 3.908 -4.488 7.828 1.00 0.00 S
+ATOM 269 H CYS A 18 4.732 -2.080 3.888 1.00 0.00 H
+ATOM 270 HA CYS A 18 2.835 -3.960 5.089 1.00 0.00 H
+ATOM 271 1HB CYS A 18 5.001 -4.948 5.760 1.00 0.00 H
+ATOM 272 2HB CYS A 18 5.509 -3.405 6.434 1.00 0.00 H
+ATOM 273 N GLU A 19 1.987 -2.127 6.556 1.00 0.00 N
+ATOM 274 CA GLU A 19 1.448 -1.036 7.358 1.00 0.00 C
+ATOM 275 C GLU A 19 2.379 -0.690 8.513 1.00 0.00 C
+ATOM 276 O GLU A 19 2.505 0.474 8.895 1.00 0.00 O
+ATOM 277 CB GLU A 19 0.065 -1.404 7.899 1.00 0.00 C
+ATOM 278 CG GLU A 19 -1.008 -1.557 6.830 1.00 0.00 C
+ATOM 279 CD GLU A 19 -0.970 -2.898 6.151 1.00 0.00 C
+ATOM 280 OE1 GLU A 19 -0.132 -3.696 6.499 1.00 0.00 O
+ATOM 281 OE2 GLU A 19 -1.780 -3.126 5.284 1.00 0.00 O
+ATOM 282 H GLU A 19 1.442 -2.970 6.442 1.00 0.00 H
+ATOM 283 HA GLU A 19 1.340 -0.158 6.721 1.00 0.00 H
+ATOM 284 1HB GLU A 19 0.127 -2.344 8.448 1.00 0.00 H
+ATOM 285 2HB GLU A 19 -0.268 -0.638 8.599 1.00 0.00 H
+ATOM 286 1HG GLU A 19 -1.987 -1.423 7.290 1.00 0.00 H
+ATOM 287 2HG GLU A 19 -0.877 -0.774 6.084 1.00 0.00 H
+ATOM 288 N CYS A 20 3.032 -1.707 9.066 1.00 0.00 N
+ATOM 289 CA CYS A 20 4.000 -1.505 10.137 1.00 0.00 C
+ATOM 290 C CYS A 20 5.172 -0.653 9.667 1.00 0.00 C
+ATOM 291 O CYS A 20 5.707 0.155 10.425 1.00 0.00 O
+ATOM 292 CB CYS A 20 4.524 -2.847 10.649 1.00 0.00 C
+ATOM 293 SG CYS A 20 5.379 -3.831 9.395 1.00 0.00 S
+ATOM 294 H CYS A 20 2.852 -2.644 8.736 1.00 0.00 H
+ATOM 295 HA CYS A 20 3.503 -0.990 10.960 1.00 0.00 H
+ATOM 296 1HB CYS A 20 5.216 -2.677 11.474 1.00 0.00 H
+ATOM 297 2HB CYS A 20 3.695 -3.439 11.034 1.00 0.00 H
+ATOM 298 N GLU A 21 5.566 -0.839 8.412 1.00 0.00 N
+ATOM 299 CA GLU A 21 6.659 -0.069 7.830 1.00 0.00 C
+ATOM 300 C GLU A 21 6.244 1.374 7.579 1.00 0.00 C
+ATOM 301 O GLU A 21 7.005 2.305 7.845 1.00 0.00 O
+ATOM 302 CB GLU A 21 7.126 -0.712 6.522 1.00 0.00 C
+ATOM 303 CG GLU A 21 7.892 -2.015 6.700 1.00 0.00 C
+ATOM 304 CD GLU A 21 8.142 -2.728 5.400 1.00 0.00 C
+ATOM 305 OE1 GLU A 21 7.668 -2.267 4.390 1.00 0.00 O
+ATOM 306 OE2 GLU A 21 8.808 -3.737 5.418 1.00 0.00 O
+ATOM 307 H GLU A 21 5.095 -1.531 7.846 1.00 0.00 H
+ATOM 308 HA GLU A 21 7.497 -0.076 8.529 1.00 0.00 H
+ATOM 309 1HB GLU A 21 6.263 -0.914 5.888 1.00 0.00 H
+ATOM 310 2HB GLU A 21 7.771 -0.016 5.985 1.00 0.00 H
+ATOM 311 1HG GLU A 21 8.849 -1.801 7.174 1.00 0.00 H
+ATOM 312 2HG GLU A 21 7.327 -2.668 7.364 1.00 0.00 H
+ATOM 313 N LEU A 22 5.033 1.555 7.064 1.00 0.00 N
+ATOM 314 CA LEU A 22 4.525 2.885 6.749 1.00 0.00 C
+ATOM 315 C LEU A 22 4.398 3.738 8.005 1.00 0.00 C
+ATOM 316 O LEU A 22 4.666 4.939 7.982 1.00 0.00 O
+ATOM 317 CB LEU A 22 3.161 2.781 6.055 1.00 0.00 C
+ATOM 318 CG LEU A 22 3.169 2.128 4.667 1.00 0.00 C
+ATOM 319 CD1 LEU A 22 1.737 1.871 4.218 1.00 0.00 C
+ATOM 320 CD2 LEU A 22 3.897 3.032 3.684 1.00 0.00 C
+ATOM 321 H LEU A 22 4.449 0.751 6.885 1.00 0.00 H
+ATOM 322 HA LEU A 22 5.223 3.370 6.066 1.00 0.00 H
+ATOM 323 1HB LEU A 22 2.492 2.203 6.690 1.00 0.00 H
+ATOM 324 2HB LEU A 22 2.749 3.784 5.947 1.00 0.00 H
+ATOM 325 HG LEU A 22 3.679 1.165 4.721 1.00 0.00 H
+ATOM 326 1HD1 LEU A 22 1.743 1.407 3.232 1.00 0.00 H
+ATOM 327 2HD1 LEU A 22 1.246 1.206 4.929 1.00 0.00 H
+ATOM 328 3HD1 LEU A 22 1.196 2.816 4.171 1.00 0.00 H
+ATOM 329 1HD2 LEU A 22 3.903 2.567 2.698 1.00 0.00 H
+ATOM 330 2HD2 LEU A 22 3.387 3.994 3.629 1.00 0.00 H
+ATOM 331 3HD2 LEU A 22 4.923 3.184 4.020 1.00 0.00 H
+ATOM 332 N LYS A 23 3.989 3.109 9.102 1.00 0.00 N
+ATOM 333 CA LYS A 23 3.853 3.803 10.377 1.00 0.00 C
+ATOM 334 C LYS A 23 5.208 4.260 10.902 1.00 0.00 C
+ATOM 335 O LYS A 23 5.356 5.393 11.362 1.00 0.00 O
+ATOM 336 CB LYS A 23 3.166 2.903 11.406 1.00 0.00 C
+ATOM 337 CG LYS A 23 1.677 2.694 11.164 1.00 0.00 C
+ATOM 338 CD LYS A 23 1.077 1.752 12.197 1.00 0.00 C
+ATOM 339 CE LYS A 23 -0.404 1.518 11.939 1.00 0.00 C
+ATOM 340 NZ LYS A 23 -0.999 0.575 12.925 1.00 0.00 N
+ATOM 341 H LYS A 23 3.765 2.126 9.051 1.00 0.00 H
+ATOM 342 HA LYS A 23 3.222 4.680 10.229 1.00 0.00 H
+ATOM 343 1HB LYS A 23 3.646 1.924 11.411 1.00 0.00 H
+ATOM 344 2HB LYS A 23 3.286 3.331 12.402 1.00 0.00 H
+ATOM 345 1HG LYS A 23 1.161 3.653 11.217 1.00 0.00 H
+ATOM 346 2HG LYS A 23 1.526 2.274 10.170 1.00 0.00 H
+ATOM 347 1HD LYS A 23 1.599 0.794 12.163 1.00 0.00 H
+ATOM 348 2HD LYS A 23 1.200 2.177 13.193 1.00 0.00 H
+ATOM 349 1HE LYS A 23 -0.937 2.466 11.995 1.00 0.00 H
+ATOM 350 2HE LYS A 23 -0.539 1.109 10.938 1.00 0.00 H
+ATOM 351 1HZ LYS A 23 -1.979 0.446 12.720 1.00 0.00 H
+ATOM 352 2HZ LYS A 23 -0.524 -0.316 12.869 1.00 0.00 H
+ATOM 353 3HZ LYS A 23 -0.897 0.952 13.856 1.00 0.00 H
+ATOM 354 N ARG A 24 6.194 3.373 10.832 1.00 0.00 N
+ATOM 355 CA ARG A 24 7.550 3.698 11.259 1.00 0.00 C
+ATOM 356 C ARG A 24 8.166 4.769 10.367 1.00 0.00 C
+ATOM 357 O ARG A 24 8.884 5.648 10.842 1.00 0.00 O
+ATOM 358 CB ARG A 24 8.430 2.457 11.239 1.00 0.00 C
+ATOM 359 CG ARG A 24 8.159 1.463 12.356 1.00 0.00 C
+ATOM 360 CD ARG A 24 9.268 0.485 12.503 1.00 0.00 C
+ATOM 361 NE ARG A 24 9.420 -0.344 11.318 1.00 0.00 N
+ATOM 362 CZ ARG A 24 8.741 -1.486 11.092 1.00 0.00 C
+ATOM 363 NH1 ARG A 24 7.870 -1.919 11.976 1.00 0.00 N
+ATOM 364 NH2 ARG A 24 8.951 -2.170 9.981 1.00 0.00 N
+ATOM 365 H ARG A 24 6.000 2.448 10.474 1.00 0.00 H
+ATOM 366 HA ARG A 24 7.509 4.076 12.281 1.00 0.00 H
+ATOM 367 1HB ARG A 24 8.299 1.934 10.293 1.00 0.00 H
+ATOM 368 2HB ARG A 24 9.477 2.753 11.307 1.00 0.00 H
+ATOM 369 1HG ARG A 24 8.046 1.997 13.300 1.00 0.00 H
+ATOM 370 2HG ARG A 24 7.243 0.912 12.139 1.00 0.00 H
+ATOM 371 1HD ARG A 24 10.203 1.019 12.667 1.00 0.00 H
+ATOM 372 2HD ARG A 24 9.068 -0.167 13.352 1.00 0.00 H
+ATOM 373 HE ARG A 24 10.081 -0.043 10.615 1.00 0.00 H
+ATOM 374 1HH1 ARG A 24 7.710 -1.396 12.825 1.00 0.00 H
+ATOM 375 2HH1 ARG A 24 7.361 -2.775 11.806 1.00 0.00 H
+ATOM 376 1HH2 ARG A 24 9.621 -1.837 9.301 1.00 0.00 H
+ATOM 377 2HH2 ARG A 24 8.443 -3.025 9.811 1.00 0.00 H
+ATOM 378 N LEU A 25 7.881 4.688 9.072 1.00 0.00 N
+ATOM 379 CA LEU A 25 8.362 5.681 8.118 1.00 0.00 C
+ATOM 380 C LEU A 25 7.760 7.052 8.399 1.00 0.00 C
+ATOM 381 O LEU A 25 8.424 8.076 8.241 1.00 0.00 O
+ATOM 382 CB LEU A 25 8.021 5.249 6.687 1.00 0.00 C
+ATOM 383 CG LEU A 25 8.836 4.073 6.134 1.00 0.00 C
+ATOM 384 CD1 LEU A 25 8.152 3.520 4.891 1.00 0.00 C
+ATOM 385 CD2 LEU A 25 10.250 4.540 5.818 1.00 0.00 C
+ATOM 386 H LEU A 25 7.316 3.920 8.739 1.00 0.00 H
+ATOM 387 HA LEU A 25 9.447 5.750 8.209 1.00 0.00 H
+ATOM 388 1HB LEU A 25 6.969 4.969 6.649 1.00 0.00 H
+ATOM 389 2HB LEU A 25 8.173 6.100 6.022 1.00 0.00 H
+ATOM 390 HG LEU A 25 8.875 3.276 6.877 1.00 0.00 H
+ATOM 391 1HD1 LEU A 25 8.732 2.684 4.499 1.00 0.00 H
+ATOM 392 2HD1 LEU A 25 7.151 3.176 5.150 1.00 0.00 H
+ATOM 393 3HD1 LEU A 25 8.084 4.301 4.135 1.00 0.00 H
+ATOM 394 1HD2 LEU A 25 10.830 3.703 5.426 1.00 0.00 H
+ATOM 395 2HD2 LEU A 25 10.213 5.336 5.074 1.00 0.00 H
+ATOM 396 3HD2 LEU A 25 10.721 4.914 6.727 1.00 0.00 H
+ATOM 397 N GLU A 26 6.499 7.064 8.817 1.00 0.00 N
+ATOM 398 CA GLU A 26 5.825 8.304 9.184 1.00 0.00 C
+ATOM 399 C GLU A 26 6.516 8.978 10.362 1.00 0.00 C
+ATOM 400 O GLU A 26 6.785 10.179 10.332 1.00 0.00 O
+ATOM 401 CB GLU A 26 4.358 8.034 9.526 1.00 0.00 C
+ATOM 402 CG GLU A 26 3.586 9.258 9.995 1.00 0.00 C
+ATOM 403 CD GLU A 26 2.147 8.957 10.311 1.00 0.00 C
+ATOM 404 OE1 GLU A 26 1.747 7.830 10.148 1.00 0.00 O
+ATOM 405 OE2 GLU A 26 1.448 9.856 10.717 1.00 0.00 O
+ATOM 406 H GLU A 26 5.993 6.192 8.882 1.00 0.00 H
+ATOM 407 HA GLU A 26 5.854 8.980 8.328 1.00 0.00 H
+ATOM 408 1HB GLU A 26 3.848 7.632 8.650 1.00 0.00 H
+ATOM 409 2HB GLU A 26 4.301 7.281 10.312 1.00 0.00 H
+ATOM 410 1HG GLU A 26 4.066 9.658 10.888 1.00 0.00 H
+ATOM 411 2HG GLU A 26 3.631 10.022 9.220 1.00 0.00 H
+ATOM 412 N GLU A 27 6.800 8.198 11.400 1.00 0.00 N
+ATOM 413 CA GLU A 27 7.432 8.725 12.603 1.00 0.00 C
+ATOM 414 C GLU A 27 8.784 9.351 12.286 1.00 0.00 C
+ATOM 415 O GLU A 27 9.110 10.431 12.778 1.00 0.00 O
+ATOM 416 CB GLU A 27 7.604 7.616 13.644 1.00 0.00 C
+ATOM 417 CG GLU A 27 6.305 7.150 14.286 1.00 0.00 C
+ATOM 418 CD GLU A 27 6.503 6.008 15.244 1.00 0.00 C
+ATOM 419 OE1 GLU A 27 7.584 5.471 15.284 1.00 0.00 O
+ATOM 420 OE2 GLU A 27 5.571 5.672 15.936 1.00 0.00 O
+ATOM 421 H GLU A 27 6.572 7.216 11.354 1.00 0.00 H
+ATOM 422 HA GLU A 27 6.783 9.491 13.028 1.00 0.00 H
+ATOM 423 1HB GLU A 27 8.077 6.751 13.180 1.00 0.00 H
+ATOM 424 2HB GLU A 27 8.264 7.963 14.439 1.00 0.00 H
+ATOM 425 1HG GLU A 27 5.856 7.985 14.823 1.00 0.00 H
+ATOM 426 2HG GLU A 27 5.614 6.844 13.501 1.00 0.00 H
+ATOM 427 N GLU A 28 9.569 8.665 11.462 1.00 0.00 N
+ATOM 428 CA GLU A 28 10.882 9.160 11.066 1.00 0.00 C
+ATOM 429 C GLU A 28 10.762 10.356 10.131 1.00 0.00 C
+ATOM 430 O GLU A 28 11.506 11.329 10.253 1.00 0.00 O
+ATOM 431 CB GLU A 28 11.688 8.049 10.388 1.00 0.00 C
+ATOM 432 CG GLU A 28 13.098 8.454 9.982 1.00 0.00 C
+ATOM 433 CD GLU A 28 13.979 8.768 11.159 1.00 0.00 C
+ATOM 434 OE1 GLU A 28 13.733 8.243 12.218 1.00 0.00 O
+ATOM 435 OE2 GLU A 28 14.899 9.535 10.999 1.00 0.00 O
+ATOM 436 H GLU A 28 9.247 7.779 11.099 1.00 0.00 H
+ATOM 437 HA GLU A 28 11.420 9.469 11.963 1.00 0.00 H
+ATOM 438 1HB GLU A 28 11.766 7.194 11.060 1.00 0.00 H
+ATOM 439 2HB GLU A 28 11.165 7.715 9.492 1.00 0.00 H
+ATOM 440 1HG GLU A 28 13.548 7.642 9.412 1.00 0.00 H
+ATOM 441 2HG GLU A 28 13.041 9.327 9.333 1.00 0.00 H
+ATOM 442 N ALA A 29 9.820 10.278 9.197 1.00 0.00 N
+ATOM 443 CA ALA A 29 9.625 11.339 8.215 1.00 0.00 C
+ATOM 444 C ALA A 29 9.263 12.655 8.891 1.00 0.00 C
+ATOM 445 O ALA A 29 9.768 13.714 8.519 1.00 0.00 O
+ATOM 446 CB ALA A 29 8.549 10.944 7.215 1.00 0.00 C
+ATOM 447 H ALA A 29 9.224 9.464 9.166 1.00 0.00 H
+ATOM 448 HA ALA A 29 10.556 11.474 7.663 1.00 0.00 H
+ATOM 449 1HB ALA A 29 8.415 11.745 6.489 1.00 0.00 H
+ATOM 450 2HB ALA A 29 8.849 10.032 6.698 1.00 0.00 H
+ATOM 451 3HB ALA A 29 7.611 10.770 7.741 1.00 0.00 H
+ATOM 452 N ARG A 30 8.385 12.582 9.886 1.00 0.00 N
+ATOM 453 CA ARG A 30 7.945 13.769 10.608 1.00 0.00 C
+ATOM 454 C ARG A 30 9.104 14.424 11.350 1.00 0.00 C
+ATOM 455 O ARG A 30 9.220 15.649 11.382 1.00 0.00 O
+ATOM 456 CB ARG A 30 6.847 13.416 11.601 1.00 0.00 C
+ATOM 457 CG ARG A 30 5.492 13.121 10.977 1.00 0.00 C
+ATOM 458 CD ARG A 30 4.459 12.849 12.009 1.00 0.00 C
+ATOM 459 NE ARG A 30 3.192 12.453 11.417 1.00 0.00 N
+ATOM 460 CZ ARG A 30 2.268 13.311 10.943 1.00 0.00 C
+ATOM 461 NH1 ARG A 30 2.484 14.607 10.997 1.00 0.00 N
+ATOM 462 NH2 ARG A 30 1.144 12.851 10.422 1.00 0.00 N
+ATOM 463 H ARG A 30 8.013 11.680 10.148 1.00 0.00 H
+ATOM 464 HA ARG A 30 7.543 14.483 9.889 1.00 0.00 H
+ATOM 465 1HB ARG A 30 7.144 12.539 12.174 1.00 0.00 H
+ATOM 466 2HB ARG A 30 6.714 14.237 12.304 1.00 0.00 H
+ATOM 467 1HG ARG A 30 5.169 13.978 10.386 1.00 0.00 H
+ATOM 468 2HG ARG A 30 5.571 12.245 10.332 1.00 0.00 H
+ATOM 469 1HD ARG A 30 4.798 12.044 12.660 1.00 0.00 H
+ATOM 470 2HD ARG A 30 4.293 13.748 12.602 1.00 0.00 H
+ATOM 471 HE ARG A 30 2.989 11.464 11.358 1.00 0.00 H
+ATOM 472 1HH1 ARG A 30 3.344 14.959 11.395 1.00 0.00 H
+ATOM 473 2HH1 ARG A 30 1.792 15.250 10.641 1.00 0.00 H
+ATOM 474 1HH2 ARG A 30 0.977 11.855 10.380 1.00 0.00 H
+ATOM 475 2HH2 ARG A 30 0.452 13.494 10.067 1.00 0.00 H
+ATOM 476 N ARG A 31 9.959 13.600 11.945 1.00 0.00 N
+ATOM 477 CA ARG A 31 11.126 14.096 12.665 1.00 0.00 C
+ATOM 478 C ARG A 31 12.110 14.772 11.718 1.00 0.00 C
+ATOM 479 O ARG A 31 12.732 15.775 12.067 1.00 0.00 O
+ATOM 480 CB ARG A 31 11.828 12.961 13.395 1.00 0.00 C
+ATOM 481 CG ARG A 31 11.126 12.482 14.657 1.00 0.00 C
+ATOM 482 CD ARG A 31 12.010 11.620 15.483 1.00 0.00 C
+ATOM 483 NE ARG A 31 12.256 10.333 14.851 1.00 0.00 N
+ATOM 484 CZ ARG A 31 11.503 9.232 15.039 1.00 0.00 C
+ATOM 485 NH1 ARG A 31 10.462 9.277 15.841 1.00 0.00 N
+ATOM 486 NH2 ARG A 31 11.810 8.107 14.418 1.00 0.00 N
+ATOM 487 H ARG A 31 9.797 12.604 11.898 1.00 0.00 H
+ATOM 488 HA ARG A 31 10.793 14.827 13.402 1.00 0.00 H
+ATOM 489 1HB ARG A 31 11.926 12.105 12.729 1.00 0.00 H
+ATOM 490 2HB ARG A 31 12.833 13.275 13.676 1.00 0.00 H
+ATOM 491 1HG ARG A 31 10.829 13.343 15.257 1.00 0.00 H
+ATOM 492 2HG ARG A 31 10.241 11.906 14.385 1.00 0.00 H
+ATOM 493 1HD ARG A 31 12.968 12.116 15.630 1.00 0.00 H
+ATOM 494 2HD ARG A 31 11.542 11.441 16.450 1.00 0.00 H
+ATOM 495 HE ARG A 31 13.048 10.260 14.227 1.00 0.00 H
+ATOM 496 1HH1 ARG A 31 10.227 10.137 16.316 1.00 0.00 H
+ATOM 497 2HH1 ARG A 31 9.897 8.452 15.982 1.00 0.00 H
+ATOM 498 1HH2 ARG A 31 12.610 8.073 13.801 1.00 0.00 H
+ATOM 499 2HH2 ARG A 31 11.246 7.282 14.559 1.00 0.00 H
+ATOM 500 N ARG A 32 12.248 14.215 10.520 1.00 0.00 N
+ATOM 501 CA ARG A 32 13.178 14.746 9.530 1.00 0.00 C
+ATOM 502 C ARG A 32 12.654 16.041 8.921 1.00 0.00 C
+ATOM 503 O ARG A 32 13.420 16.969 8.660 1.00 0.00 O
+ATOM 504 CB ARG A 32 13.421 13.730 8.424 1.00 0.00 C
+ATOM 505 CG ARG A 32 14.254 12.526 8.833 1.00 0.00 C
+ATOM 506 CD ARG A 32 14.439 11.578 7.705 1.00 0.00 C
+ATOM 507 NE ARG A 32 15.217 10.413 8.098 1.00 0.00 N
+ATOM 508 CZ ARG A 32 15.696 9.490 7.242 1.00 0.00 C
+ATOM 509 NH1 ARG A 32 15.470 9.608 5.953 1.00 0.00 N
+ATOM 510 NH2 ARG A 32 16.394 8.465 7.699 1.00 0.00 N
+ATOM 511 H ARG A 32 11.693 13.404 10.288 1.00 0.00 H
+ATOM 512 HA ARG A 32 14.128 14.952 10.024 1.00 0.00 H
+ATOM 513 1HB ARG A 32 12.465 13.360 8.055 1.00 0.00 H
+ATOM 514 2HB ARG A 32 13.928 14.215 7.590 1.00 0.00 H
+ATOM 515 1HG ARG A 32 15.237 12.860 9.166 1.00 0.00 H
+ATOM 516 2HG ARG A 32 13.755 11.998 9.647 1.00 0.00 H
+ATOM 517 1HD ARG A 32 13.466 11.235 7.355 1.00 0.00 H
+ATOM 518 2HD ARG A 32 14.962 12.078 6.891 1.00 0.00 H
+ATOM 519 HE ARG A 32 15.411 10.288 9.082 1.00 0.00 H
+ATOM 520 1HH1 ARG A 32 14.936 10.392 5.603 1.00 0.00 H
+ATOM 521 2HH1 ARG A 32 15.829 8.916 5.311 1.00 0.00 H
+ATOM 522 1HH2 ARG A 32 16.568 8.374 8.691 1.00 0.00 H
+ATOM 523 2HH2 ARG A 32 16.753 7.773 7.058 1.00 0.00 H
+ATOM 524 N MET A 33 11.346 16.096 8.697 1.00 0.00 N
+ATOM 525 CA MET A 33 10.723 17.264 8.086 1.00 0.00 C
+ATOM 526 C MET A 33 10.662 18.431 9.063 1.00 0.00 C
+ATOM 527 O MET A 33 10.796 19.590 8.669 1.00 0.00 O
+ATOM 528 CB MET A 33 9.322 16.914 7.586 1.00 0.00 C
+ATOM 529 CG MET A 33 9.298 16.035 6.344 1.00 0.00 C
+ATOM 530 SD MET A 33 7.642 15.853 5.653 1.00 0.00 S
+ATOM 531 CE MET A 33 6.907 14.720 6.829 1.00 0.00 C
+ATOM 532 H MET A 33 10.768 15.310 8.956 1.00 0.00 H
+ATOM 533 HA MET A 33 11.318 17.562 7.221 1.00 0.00 H
+ATOM 534 1HB MET A 33 8.775 16.396 8.373 1.00 0.00 H
+ATOM 535 2HB MET A 33 8.777 17.831 7.358 1.00 0.00 H
+ATOM 536 1HG MET A 33 9.945 16.466 5.581 1.00 0.00 H
+ATOM 537 2HG MET A 33 9.678 15.044 6.592 1.00 0.00 H
+ATOM 538 1HE MET A 33 5.878 14.510 6.537 1.00 0.00 H
+ATOM 539 2HE MET A 33 7.478 13.791 6.844 1.00 0.00 H
+ATOM 540 3HE MET A 33 6.917 15.169 7.822 1.00 0.00 H
+ATOM 541 N ARG A 34 10.460 18.119 10.338 1.00 0.00 N
+ATOM 542 CA ARG A 34 10.346 19.143 11.369 1.00 0.00 C
+ATOM 543 C ARG A 34 11.647 19.920 11.520 1.00 0.00 C
+ATOM 544 O ARG A 34 12.731 19.386 11.286 1.00 0.00 O
+ATOM 545 OXT ARG A 34 11.624 21.068 11.870 1.00 0.00 O
+ATOM 546 CB ARG A 34 9.974 18.518 12.706 1.00 0.00 C
+ATOM 547 CG ARG A 34 9.964 19.482 13.882 1.00 0.00 C
+ATOM 548 CD ARG A 34 8.829 20.436 13.800 1.00 0.00 C
+ATOM 549 NE ARG A 34 7.559 19.795 14.103 1.00 0.00 N
+ATOM 550 CZ ARG A 34 6.356 20.257 13.710 1.00 0.00 C
+ATOM 551 NH1 ARG A 34 6.275 21.361 13.001 1.00 0.00 N
+ATOM 552 NH2 ARG A 34 5.257 19.600 14.037 1.00 0.00 N
+ATOM 553 H ARG A 34 10.383 17.146 10.600 1.00 0.00 H
+ATOM 554 HA ARG A 34 9.556 19.837 11.081 1.00 0.00 H
+ATOM 555 1HB ARG A 34 8.983 18.074 12.636 1.00 0.00 H
+ATOM 556 2HB ARG A 34 10.676 17.718 12.941 1.00 0.00 H
+ATOM 557 1HG ARG A 34 9.874 18.921 14.812 1.00 0.00 H
+ATOM 558 2HG ARG A 34 10.893 20.055 13.891 1.00 0.00 H
+ATOM 559 1HD ARG A 34 8.981 21.245 14.514 1.00 0.00 H
+ATOM 560 2HD ARG A 34 8.771 20.848 12.793 1.00 0.00 H
+ATOM 561 HE ARG A 34 7.581 18.943 14.647 1.00 0.00 H
+ATOM 562 1HH1 ARG A 34 7.115 21.863 12.750 1.00 0.00 H
+ATOM 563 2HH1 ARG A 34 5.373 21.707 12.706 1.00 0.00 H
+ATOM 564 1HH2 ARG A 34 5.319 18.751 14.583 1.00 0.00 H
+ATOM 565 2HH2 ARG A 34 4.356 19.946 13.743 1.00 0.00 H
+TER
+REMARK PDBinfo-LABEL: 18 DISULFIDIZE
+REMARK PDBinfo-LABEL: 20 DISULFIDIZE
+
+# All scores below are weighted scores, not raw scores.
+#BEGIN_POSE_ENERGIES_TABLE /home/job/save/disulfided_eeh_6.2.6.3.15_6_4_20200725031924.pdb
+label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro total
+weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1.25 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 NA
+pose -178.829 16.5013 150.124 -13.64 5.479 11.8855 72.8067 -78.0603 -0.31599 -1.9341 -61.2674 -12.2101 0 -16.8587 -6.22491 -3.52658 -8.06101 -0.03176 2.27532 3.77007 21.2378 35.7692 -8.61353 0.61486 -18.8668 -1.98379 -89.9606
+ASP:NtermProteinFull_1 -2.38925 0.05779 2.61586 -0.27382 0.05673 0.95763 1.3812 -1.30876 -0.06841 -0.37776 -1.26304 -2.91314 0 0 0 0 0 0 0.04482 0.36006 0 2.34744 0 0 -2.3716 0 -3.14424
+SER_2 -3.12235 0.23624 2.08483 -0.02888 0 0.06803 0.6043 -1.24369 -0.06841 -0.37776 -0.19744 -0.21896 0 0 0 0 0 0 0.00284 0 0.09385 0 -0.49226 0.61486 -0.77834 -0.1812 -3.00434
+LEU_3 -6.05377 0.51212 3.47112 -0.60155 0.32742 0.15142 2.3769 -2.14877 -0.00047 -0.00123 -1.80779 0.30397 0 0 0 0 0 0 0.15361 0.10685 0.75679 0 -0.17154 0 0.18072 0.12464 -2.31955
+HIS_D_4 -5.13263 0.18696 4.12241 -0.64844 0.07925 0.628 1.09227 -2.06486 -0.01042 -0.0327 -1.37673 -0.83443 0 0 0 0 -0.95509 0 -0.0142 0.07651 0 2.50629 0.08524 0 -0.45461 0.23232 -2.51486
+ILE_5 -8.67864 1.18148 3.79553 -0.48717 0.44276 0.10937 2.62604 -2.78797 -0.00147 -0.00404 -1.5344 0.02971 0 0 0 0 0 0 0.34634 0.57053 0.40384 0 -0.75949 0 0.73287 -0.38246 -4.39717
+ASN_6 -3.88601 0.17863 3.87773 -0.32984 0.2394 0.60125 1.70175 -2.03058 -0.01719 -0.07992 -1.72951 -0.82263 0 0 0 -1.22594 0 0 0.36135 0 0 1.86867 -0.2999 0 -0.93687 -0.41498 -2.94459
+LEU_7 -8.36038 1.08396 4.92996 -0.67136 0.45737 0.2506 2.66572 -2.94437 -0.001 -0.00281 -1.34171 0.08347 0 0 0 0 0 0 0.19543 0.17439 0.82833 0 -0.10598 0 0.18072 0.31174 -2.26593
+ASP_8 -2.55551 0.20583 3.80142 -0.12896 0.02684 0.41254 1.66187 -1.6115 -9e-05 -0.00097 -2.47653 -0.84398 0 0 0 0 -0.91587 0 0.14336 0.05475 0 2.50747 -0.5923 0 -2.3716 0.46829 -2.21491
+GLY_9 -1.93274 0.17137 2.3245 -7e-05 0 0 0.69774 -1.13434 -0 -0 -0.80736 -0.39124 0 0 0 -0.72351 0 0 -0.15967 0 0 0 -1.52489 0 0.83697 -0.31303 -2.95629
+ILE_10 -5.44323 0.61312 4.52496 -0.49385 0.54326 0.1079 2.70563 -2.32023 -0.00686 -0.04746 -1.88986 0.26042 0 0 0 0 0 0 -0.05816 0.08224 0.37032 0 -0.47332 0 0.73287 -0.59394 -1.38618
+ARG_11 -3.08321 0.12628 2.43801 -0.63415 0.10259 0.38543 1.22039 -1.19651 -0.00032 -0.00653 -1.45276 0.34281 0 0 0 0 -0.95509 0 -0.03319 0.04152 2.6321 0 0.19628 0 -1.2888 -0.20707 -1.37223
+PHE_12 -6.14069 0.84662 3.3952 -0.77757 0.0418 0.08011 2.49811 -2.13194 -0.0014 -0.0051 -1.69788 -0.52796 0 0 0 0 0 0 0.16875 0.02728 0 2.29212 -0.22683 0 1.0402 0.2241 -0.89509
+GLU_13 -3.74516 0.14417 2.29143 -0.21027 0.0352 0.32047 0.75075 -1.34273 -0.00032 -0.00653 -0.53424 -0.50264 0 0 0 0 0 0 0.3421 0.00404 0 3.09902 0.14035 0 -2.7348 0.13229 -1.81688
+VAL_14 -6.89645 0.80461 1.85721 -0.31281 0.23173 0.06615 2.12809 -2.11393 -0.00131 -0.00487 -1.89267 -0.32823 0 0 0 0 0 0 0.17698 0.00814 0.15571 0 -0.43143 0 1.9342 -0.26278 -4.88165
+HIS_D_15 -4.04881 0.29754 2.21984 -0.38939 0.0239 0.48662 0.51725 -1.45105 -0 -0 -0.60038 -0.41773 0 0 0 0 0 0 0.01221 0.02683 0 2.14362 -0.24902 0 -0.45461 -0.40271 -2.28591
+GLY_16 -2.57035 0.11992 2.64595 -0.00184 0 0 1.2273 -1.38285 -1e-05 -4e-05 -0.87946 -0.37443 0 0 0 0 0 0 0.00933 0 0 0 -1.23589 0 0.83697 -0.07985 -1.68525
+ASP_17 -1.41313 0.05546 2.21829 -0.12341 0.02635 0.38609 0.73772 -0.90098 -1e-05 -4e-05 -1.58935 -0.19405 0 0 0 -0.53735 0 0 0.04567 0.00085 0 2.44014 -0.32797 0 -2.3716 -0.20011 -1.74742
+CYS:disulfide_18 -5.20731 0.95869 5.24516 -0.05562 0 0.03933 2.50852 -2.41209 -0.01556 -0.09788 -1.94421 -0.50008 0 0 0 0 0 -0.01588 0.11914 0.04923 0.21624 0 -0.30249 0 3.6196 -0.09047 2.11433
+GLU_19 -3.78312 0.31598 3.65831 -0.46137 0.23811 1.44022 1.59055 -1.75156 -0.02846 -0.15563 -1.29255 -2.97444 0 0 0 0 0 0 0.12457 0.0069 0 3.91109 -0.31474 0 -2.7348 0.08815 -2.12278
+CYS:disulfide_20 -4.97115 0.76232 4.65137 -0.05643 0 0.03329 1.91897 -2.22898 -0.02846 -0.15563 -1.29555 -0.50721 0 0 0 0 0 -0.01588 0.02182 0.02471 1.32899 0 0.28327 0 3.6196 0.09421 3.47928
+GLU_21 -7.65125 0.88132 8.39412 -0.21361 0.03537 0.31415 3.54398 -3.73042 -0.01556 -0.09788 -3.74213 -0.60177 0 0 0 -0.53735 0 0 -0.02777 0.17317 0 3.14555 -0.2055 0 -2.7348 0.15901 -2.91135
+LEU_22 -9.68384 0.74857 4.94464 -0.50614 0.47476 0.11962 2.5318 -3.52051 -0 -0 -1.49944 0.26603 0 0 0 0 0 0 0.03884 0.12147 0.29445 0 -0.29236 0 0.18072 -0.10905 -5.89042
+LYS_23 -4.9226 0.38189 5.79452 -0.30282 0.02714 0.13308 2.66265 -2.62329 -0 -0 -1.6245 -0.01433 0 0 0 0 0 0 0.10629 0.04703 1.81169 0 0.02383 0 -1.5107 0.00775 -0.00236
+ARG_24 -6.1827 0.3106 7.02322 -0.81653 0.18991 0.54277 2.61491 -3.20911 -0.01968 -0.16921 -2.0935 0.39899 0 0 0 0 0 0 0.13258 0.14356 1.46664 0 -0.11701 0 -1.2888 -0.06301 -1.13635
+LEU_25 -6.84419 0.84069 4.60467 -0.49557 0.34652 0.12241 2.73633 -2.8774 -0 -0 -2.4826 0.20964 0 0 0 0 0 0 0.17313 0.50907 0.28977 0 -0.30432 0 0.18072 -0.14819 -3.13933
+GLU_26 -7.62508 1.05902 7.23803 -0.33508 0.09202 0.39064 4.15894 -3.48808 -0 -0 -3.62417 -0.56749 0 0 0 0 -0.96789 0 -0.01719 0.11663 0 3.0998 -0.04017 0 -2.7348 0.06839 -3.17649
+GLU_27 -5.07481 0.20276 6.22125 -0.21353 0.02947 0.29599 2.30064 -2.78865 -0.02483 -0.23488 -1.74417 -0.57864 0 0 0 0 0 0 0.01146 0.00367 0 3.05979 -0.12689 0 -2.7348 0.08734 -1.30882
+GLU_28 -6.44735 0.37326 8.20798 -0.64663 0.14627 1.18687 3.51173 -3.48966 -0 -0 -4.17952 -0.56632 0 0 0 0 -1.19166 0 -0.03743 0.01522 0 3.34822 -0.22684 0 -2.7348 -0.16555 -2.89621
+ALA_29 -5.96052 0.70801 3.88508 -0.02142 0 0 3.13705 -2.69355 -0 -0 -2.47374 -0.35216 0 0 0 0 0 0 -0.02587 0 0 0 -0.18738 0 1.8394 -0.10312 -2.24824
+ARG_30 -8.84881 0.53683 7.98982 -0.62788 0.16876 0.34857 4.35961 -3.9161 -9e-05 -0.00097 -4.05609 0.2629 0 0 0 -0.50243 -0.96789 0 0.04391 0.0792 2.51024 0 -0.09182 0 -1.2888 -0.01365 -4.01469
+ARG_31 -5.44441 0.23466 6.87525 -0.75782 0.2023 0.48903 2.40339 -3.04452 -0.00564 -0.07427 -1.76718 0.39641 0 0 0 0 -0.41816 0 -0.04795 0.31272 1.47694 0 -0.12774 0 -1.2888 -0.14757 -0.73336
+ARG_32 -4.50163 0.28739 5.53509 -0.44084 0.05909 0.22124 2.34338 -2.26582 -0 -0 -1.55602 0.35016 0 0 0 0 -0.7735 0 -0.03675 0.2173 2.02829 0 -0.11881 0 -1.2888 -0.16221 -0.10244
+MET_33 -6.738 0.90091 2.41228 -0.34946 0.11458 0.10576 1.41699 -1.76839 -0 -0 -0.79673 -0.079 0 0 0 0 0 0 -0.04104 0.0677 1.80702 0 0.00441 0 0.60916 0.00144 -2.33238
+ARG:CtermProteinFull_34 -3.49004 0.17633 4.82866 -1.22587 0.72006 1.09096 2.4742 -2.13716 -0 -0 -2.02417 -0.00369 0 0 0 0 -0.91587 0 0 0.34847 2.76654 0 0 0 -1.2888 0.05748 1.3771
+#END_POSE_ENERGIES_TABLE /home/job/save/disulfided_eeh_6.2.6.3.15_6_4_20200725031924.pdb
+
+DisulfideBondEnergys -0.015882061736805994
+PHI 0.0,-149.39869036355222,-146.07046178008804,-91.33298645042237,-107.64699936073166,-106.85192157011156,-108.54336017891504,51.123218338140695,99.18442632281433,-81.13615910070929,-101.1718223093756,-140.78228040202723,-106.39604539040897,-126.13240576547052,-135.2506305042501,-176.09106622887512,-105.19383171336615,-156.1752895204319,-58.24183439018936,-62.28225825078193,-71.84464266488467,-63.181157192479276,-66.07879396088624,-65.5534377562976,-64.67353711739624,-61.95672051599109,-59.39447911332187,-70.79722511583232,-61.06255038868808,-63.662343314978216,-65.63881845853496,-73.87646277332888,-73.35073495002695,-64.20054960248041
+PSI 23.14949812771904,158.73586724809996,128.73659103200694,126.54452798067892,123.8826290447244,106.33684967191832,92.87339892944813,43.39545137350014,-13.060388378988483,123.01848046276515,115.3469204929025,131.67408873086717,142.2332926508372,161.3593048140233,154.1363491248866,-179.53043159656195,12.083780807029099,140.09670890213374,-35.051741035811546,-36.04772157156154,-42.46951946427043,-37.74220989559303,-44.87217540534791,-38.14296789014041,-36.53274443246971,-47.86843270334883,-43.969969001543916,-41.42702522277446,-42.62987829557458,-40.41947821119277,-37.369571332023575,-38.118373094710755,-34.986528940457234,0.0
+SSE LEEEEEELLEEEEEELLLHHHHHHHHHHHHHHHL
+AlaCount 1
+AverageDegree 12.8235
+BuriedUnsatHbond 0
+Buried_non_polar_SASA_per_res 41.5075
+CavityVolume 0
+CoreAverageDegree 16.25
+CoreResidueCount 12
+ExposeCoreHydrophobicsPerCoreResidue 34.163
+ExposeCoreHydrophobicsSASA 409.955
+ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent 27.654
+ExposedHydrophobics_on_TotalSASAPercent 14.332
+HasCoreResidueNum 7
+PackStat 0.702403
+Rg 9.628
+SSShapeComplementarity 0.788027
+ScorePerResFilter -2.6459
+deltaS_conf_folding 2.76418
+driftRMSD 0.450971
+frac_helix 44.1176
+frac_loop 20.5882
+frac_sheet 35.2941
+n_hydrophobic 10
+netcharge -2
+nres_helix 15
+nres_loop 7
+nres_sheet 12
+nres_total 34
+ss_mismatch_probability 0.332809
+
diff --git a/8_Filter/data/denovo_helix.pdb b/8_Filter/data/denovo_helix.pdb
new file mode 100644
index 0000000..0814fdd
--- /dev/null
+++ b/8_Filter/data/denovo_helix.pdb
@@ -0,0 +1,1028 @@
+ATOM 1 N ASP B 143 28.362 -12.788 -40.316 1.00 0.00 N
+ATOM 2 CA ASP B 143 29.054 -13.139 -39.082 1.00 0.00 C
+ATOM 3 C ASP B 143 28.791 -12.108 -37.991 1.00 0.00 C
+ATOM 4 O ASP B 143 28.286 -12.440 -36.919 1.00 0.00 O
+ATOM 5 CB ASP B 143 30.560 -13.258 -39.327 1.00 0.00 C
+ATOM 6 CG ASP B 143 31.139 -12.053 -40.057 1.00 0.00 C
+ATOM 7 OD1 ASP B 143 30.375 -11.267 -40.564 1.00 0.00 O
+ATOM 8 OD2 ASP B 143 32.340 -11.931 -40.099 1.00 0.00 O1-
+ATOM 9 1H ASP B 143 28.552 -13.480 -41.013 1.00 0.00 H
+ATOM 10 2H ASP B 143 27.377 -12.748 -40.146 1.00 0.00 H
+ATOM 11 3H ASP B 143 28.682 -11.897 -40.637 1.00 0.00 H
+ATOM 12 HA ASP B 143 28.682 -14.104 -38.738 1.00 0.00 H
+ATOM 13 1HB ASP B 143 31.077 -13.369 -38.373 1.00 0.00 H
+ATOM 14 2HB ASP B 143 30.764 -14.153 -39.916 1.00 0.00 H
+ATOM 15 N GLU B 144 29.137 -10.857 -38.271 1.00 0.00 N
+ATOM 16 CA GLU B 144 29.029 -9.791 -37.281 1.00 0.00 C
+ATOM 17 C GLU B 144 27.580 -9.571 -36.866 1.00 0.00 C
+ATOM 18 O GLU B 144 27.293 -9.299 -35.700 1.00 0.00 O
+ATOM 19 CB GLU B 144 29.615 -8.489 -37.832 1.00 0.00 C
+ATOM 20 CG GLU B 144 31.131 -8.492 -37.972 1.00 0.00 C
+ATOM 21 CD GLU B 144 31.676 -7.180 -38.462 1.00 0.00 C
+ATOM 22 OE1 GLU B 144 30.895 -6.330 -38.819 1.00 0.00 O
+ATOM 23 OE2 GLU B 144 32.874 -7.026 -38.481 1.00 0.00 O1-
+ATOM 24 H GLU B 144 29.485 -10.636 -39.194 1.00 0.00 H
+ATOM 25 HA GLU B 144 29.595 -10.084 -36.396 1.00 0.00 H
+ATOM 26 1HB GLU B 144 29.189 -8.285 -38.815 1.00 0.00 H
+ATOM 27 2HB GLU B 144 29.341 -7.661 -37.178 1.00 0.00 H
+ATOM 28 1HG GLU B 144 31.575 -8.717 -37.003 1.00 0.00 H
+ATOM 29 2HG GLU B 144 31.420 -9.282 -38.665 1.00 0.00 H
+ATOM 30 N GLU B 145 26.670 -9.688 -37.827 1.00 0.00 N
+ATOM 31 CA GLU B 145 25.254 -9.456 -37.573 1.00 0.00 C
+ATOM 32 C GLU B 145 24.678 -10.521 -36.648 1.00 0.00 C
+ATOM 33 O GLU B 145 23.926 -10.214 -35.723 1.00 0.00 O
+ATOM 34 CB GLU B 145 24.474 -9.435 -38.890 1.00 0.00 C
+ATOM 35 CG GLU B 145 24.807 -8.260 -39.798 1.00 0.00 C
+ATOM 36 CD GLU B 145 26.082 -8.459 -40.569 1.00 0.00 C
+ATOM 37 OE1 GLU B 145 26.656 -9.517 -40.468 1.00 0.00 O
+ATOM 38 OE2 GLU B 145 26.483 -7.552 -41.260 1.00 0.00 O1-
+ATOM 39 H GLU B 145 26.968 -9.945 -38.757 1.00 0.00 H
+ATOM 40 HA GLU B 145 25.143 -8.488 -37.085 1.00 0.00 H
+ATOM 41 1HB GLU B 145 24.670 -10.352 -39.444 1.00 0.00 H
+ATOM 42 2HB GLU B 145 23.405 -9.402 -38.679 1.00 0.00 H
+ATOM 43 1HG GLU B 145 23.988 -8.116 -40.503 1.00 0.00 H
+ATOM 44 2HG GLU B 145 24.891 -7.358 -39.193 1.00 0.00 H
+ATOM 45 N GLU B 146 25.036 -11.775 -36.903 1.00 0.00 N
+ATOM 46 CA GLU B 146 24.569 -12.887 -36.083 1.00 0.00 C
+ATOM 47 C GLU B 146 25.093 -12.779 -34.656 1.00 0.00 C
+ATOM 48 O GLU B 146 24.366 -13.035 -33.697 1.00 0.00 O
+ATOM 49 CB GLU B 146 25.002 -14.221 -36.696 1.00 0.00 C
+ATOM 50 CG GLU B 146 24.339 -14.545 -38.027 1.00 0.00 C
+ATOM 51 CD GLU B 146 24.989 -13.849 -39.190 1.00 0.00 C
+ATOM 52 OE1 GLU B 146 25.976 -13.186 -38.984 1.00 0.00 O
+ATOM 53 OE2 GLU B 146 24.497 -13.981 -40.286 1.00 0.00 O1-
+ATOM 54 H GLU B 146 25.648 -11.963 -37.684 1.00 0.00 H
+ATOM 55 HA GLU B 146 23.480 -12.857 -36.048 1.00 0.00 H
+ATOM 56 1HB GLU B 146 26.081 -14.216 -36.852 1.00 0.00 H
+ATOM 57 2HB GLU B 146 24.776 -15.030 -36.002 1.00 0.00 H
+ATOM 58 1HG GLU B 146 24.386 -15.623 -38.190 1.00 0.00 H
+ATOM 59 2HG GLU B 146 23.289 -14.258 -37.977 1.00 0.00 H
+ATOM 60 N GLU B 147 26.359 -12.398 -34.524 1.00 0.00 N
+ATOM 61 CA GLU B 147 26.973 -12.219 -33.214 1.00 0.00 C
+ATOM 62 C GLU B 147 26.286 -11.108 -32.431 1.00 0.00 C
+ATOM 63 O GLU B 147 26.031 -11.246 -31.234 1.00 0.00 O
+ATOM 64 CB GLU B 147 28.464 -11.906 -33.362 1.00 0.00 C
+ATOM 65 CG GLU B 147 29.312 -13.086 -33.817 1.00 0.00 C
+ATOM 66 CD GLU B 147 30.751 -12.717 -34.048 1.00 0.00 C
+ATOM 67 OE1 GLU B 147 31.067 -11.554 -33.965 1.00 0.00 O
+ATOM 68 OE2 GLU B 147 31.535 -13.599 -34.309 1.00 0.00 O1-
+ATOM 69 H GLU B 147 26.911 -12.228 -35.353 1.00 0.00 H
+ATOM 70 HA GLU B 147 26.865 -13.147 -32.652 1.00 0.00 H
+ATOM 71 1HB GLU B 147 28.596 -11.100 -34.084 1.00 0.00 H
+ATOM 72 2HB GLU B 147 28.859 -11.559 -32.407 1.00 0.00 H
+ATOM 73 1HG GLU B 147 29.266 -13.867 -33.059 1.00 0.00 H
+ATOM 74 2HG GLU B 147 28.892 -13.487 -34.739 1.00 0.00 H
+ATOM 75 N CYS B 148 25.988 -10.008 -33.113 1.00 0.00 N
+ATOM 76 CA CYS B 148 25.282 -8.892 -32.494 1.00 0.00 C
+ATOM 77 C CYS B 148 23.952 -9.341 -31.903 1.00 0.00 C
+ATOM 78 O CYS B 148 23.646 -9.050 -30.746 1.00 0.00 O
+ATOM 79 CB CYS B 148 25.031 -7.782 -33.516 1.00 0.00 C
+ATOM 80 SG CYS B 148 24.031 -6.412 -32.887 1.00 0.00 S
+ATOM 81 H CYS B 148 26.257 -9.942 -34.084 1.00 0.00 H
+ATOM 82 HA CYS B 148 25.902 -8.492 -31.692 1.00 0.00 H
+ATOM 83 1HB CYS B 148 25.984 -7.376 -33.854 1.00 0.00 H
+ATOM 84 2HB CYS B 148 24.524 -8.197 -34.387 1.00 0.00 H
+ATOM 85 N GLU B 149 23.164 -10.051 -32.702 1.00 0.00 N
+ATOM 86 CA GLU B 149 21.845 -10.504 -32.274 1.00 0.00 C
+ATOM 87 C GLU B 149 21.944 -11.410 -31.053 1.00 0.00 C
+ATOM 88 O GLU B 149 21.133 -11.317 -30.133 1.00 0.00 O
+ATOM 89 CB GLU B 149 21.139 -11.242 -33.414 1.00 0.00 C
+ATOM 90 CG GLU B 149 20.687 -10.346 -34.558 1.00 0.00 C
+ATOM 91 CD GLU B 149 20.068 -11.114 -35.693 1.00 0.00 C
+ATOM 92 OE1 GLU B 149 20.086 -12.321 -35.648 1.00 0.00 O
+ATOM 93 OE2 GLU B 149 19.577 -10.493 -36.606 1.00 0.00 O1-
+ATOM 94 H GLU B 149 23.486 -10.284 -33.631 1.00 0.00 H
+ATOM 95 HA GLU B 149 21.254 -9.632 -31.994 1.00 0.00 H
+ATOM 96 1HB GLU B 149 21.806 -12.000 -33.825 1.00 0.00 H
+ATOM 97 2HB GLU B 149 20.260 -11.756 -33.025 1.00 0.00 H
+ATOM 98 1HG GLU B 149 19.959 -9.630 -34.180 1.00 0.00 H
+ATOM 99 2HG GLU B 149 21.546 -9.788 -34.929 1.00 0.00 H
+ATOM 100 N LYS B 150 22.942 -12.287 -31.053 1.00 0.00 N
+ATOM 101 CA LYS B 150 23.176 -13.182 -29.926 1.00 0.00 C
+ATOM 102 C LYS B 150 23.550 -12.402 -28.673 1.00 0.00 C
+ATOM 103 O LYS B 150 23.087 -12.713 -27.575 1.00 0.00 O
+ATOM 104 CB LYS B 150 24.273 -14.194 -30.264 1.00 0.00 C
+ATOM 105 CG LYS B 150 23.857 -15.262 -31.266 1.00 0.00 C
+ATOM 106 CD LYS B 150 25.012 -16.199 -31.587 1.00 0.00 C
+ATOM 107 CE LYS B 150 24.606 -17.250 -32.609 1.00 0.00 C
+ATOM 108 NZ LYS B 150 25.735 -18.157 -32.953 1.00 0.00 N1+
+ATOM 109 H LYS B 150 23.554 -12.336 -31.855 1.00 0.00 H
+ATOM 110 HA LYS B 150 22.253 -13.726 -29.718 1.00 0.00 H
+ATOM 111 1HB LYS B 150 25.138 -13.670 -30.672 1.00 0.00 H
+ATOM 112 2HB LYS B 150 24.595 -14.698 -29.352 1.00 0.00 H
+ATOM 113 1HG LYS B 150 23.031 -15.844 -30.856 1.00 0.00 H
+ATOM 114 2HG LYS B 150 23.521 -14.785 -32.187 1.00 0.00 H
+ATOM 115 1HD LYS B 150 25.849 -15.622 -31.983 1.00 0.00 H
+ATOM 116 2HD LYS B 150 25.338 -16.699 -30.675 1.00 0.00 H
+ATOM 117 1HE LYS B 150 23.786 -17.846 -32.211 1.00 0.00 H
+ATOM 118 2HE LYS B 150 24.261 -16.759 -33.518 1.00 0.00 H
+ATOM 119 1HZ LYS B 150 25.426 -18.838 -33.632 1.00 0.00 H
+ATOM 120 2HZ LYS B 150 26.496 -17.616 -33.341 1.00 0.00 H
+ATOM 121 3HZ LYS B 150 26.051 -18.632 -32.120 1.00 0.00 H
+ATOM 122 N ILE B 151 24.389 -11.387 -28.842 1.00 0.00 N
+ATOM 123 CA ILE B 151 24.829 -10.561 -27.723 1.00 0.00 C
+ATOM 124 C ILE B 151 23.651 -9.868 -27.053 1.00 0.00 C
+ATOM 125 O ILE B 151 23.571 -9.805 -25.826 1.00 0.00 O
+ATOM 126 CB ILE B 151 25.849 -9.505 -28.187 1.00 0.00 C
+ATOM 127 CG1 ILE B 151 27.178 -10.171 -28.553 1.00 0.00 C
+ATOM 128 CG2 ILE B 151 26.056 -8.455 -27.107 1.00 0.00 C
+ATOM 129 CD1 ILE B 151 28.109 -9.283 -29.346 1.00 0.00 C
+ATOM 130 H ILE B 151 24.731 -11.181 -29.770 1.00 0.00 H
+ATOM 131 HA ILE B 151 25.302 -11.207 -26.983 1.00 0.00 H
+ATOM 132 HB ILE B 151 25.482 -9.017 -29.089 1.00 0.00 H
+ATOM 133 1HG1 ILE B 151 27.693 -10.480 -27.644 1.00 0.00 H
+ATOM 134 2HG1 ILE B 151 26.985 -11.070 -29.139 1.00 0.00 H
+ATOM 135 1HG2 ILE B 151 26.781 -7.717 -27.451 1.00 0.00 H
+ATOM 136 2HG2 ILE B 151 25.109 -7.961 -26.893 1.00 0.00 H
+ATOM 137 3HG2 ILE B 151 26.429 -8.934 -26.201 1.00 0.00 H
+ATOM 138 1HD1 ILE B 151 29.028 -9.825 -29.568 1.00 0.00 H
+ATOM 139 2HD1 ILE B 151 27.626 -8.990 -30.279 1.00 0.00 H
+ATOM 140 3HD1 ILE B 151 28.344 -8.392 -28.765 1.00 0.00 H
+ATOM 141 N ILE B 152 22.736 -9.348 -27.865 1.00 0.00 N
+ATOM 142 CA ILE B 152 21.560 -8.655 -27.351 1.00 0.00 C
+ATOM 143 C ILE B 152 20.729 -9.569 -26.461 1.00 0.00 C
+ATOM 144 O ILE B 152 20.322 -9.181 -25.366 1.00 0.00 O
+ATOM 145 CB ILE B 152 20.687 -8.127 -28.504 1.00 0.00 C
+ATOM 146 CG1 ILE B 152 21.413 -7.007 -29.254 1.00 0.00 C
+ATOM 147 CG2 ILE B 152 19.348 -7.636 -27.975 1.00 0.00 C
+ATOM 148 CD1 ILE B 152 20.767 -6.634 -30.569 1.00 0.00 C
+ATOM 149 H ILE B 152 22.859 -9.435 -28.864 1.00 0.00 H
+ATOM 150 HA ILE B 152 21.893 -7.807 -26.755 1.00 0.00 H
+ATOM 151 HB ILE B 152 20.511 -8.926 -29.224 1.00 0.00 H
+ATOM 152 1HG1 ILE B 152 21.452 -6.116 -28.628 1.00 0.00 H
+ATOM 153 2HG1 ILE B 152 22.441 -7.310 -29.454 1.00 0.00 H
+ATOM 154 1HG2 ILE B 152 18.743 -7.265 -28.803 1.00 0.00 H
+ATOM 155 2HG2 ILE B 152 18.827 -8.458 -27.485 1.00 0.00 H
+ATOM 156 3HG2 ILE B 152 19.513 -6.832 -27.258 1.00 0.00 H
+ATOM 157 1HD1 ILE B 152 21.339 -5.835 -31.042 1.00 0.00 H
+ATOM 158 2HD1 ILE B 152 20.749 -7.505 -31.226 1.00 0.00 H
+ATOM 159 3HD1 ILE B 152 19.748 -6.294 -30.390 1.00 0.00 H
+ATOM 160 N GLU B 153 20.478 -10.783 -26.937 1.00 0.00 N
+ATOM 161 CA GLU B 153 19.690 -11.754 -26.186 1.00 0.00 C
+ATOM 162 C GLU B 153 20.394 -12.152 -24.895 1.00 0.00 C
+ATOM 163 O GLU B 153 19.756 -12.318 -23.854 1.00 0.00 O
+ATOM 164 CB GLU B 153 19.423 -12.997 -27.038 1.00 0.00 C
+ATOM 165 CG GLU B 153 18.491 -12.762 -28.218 1.00 0.00 C
+ATOM 166 CD GLU B 153 17.134 -12.269 -27.803 1.00 0.00 C
+ATOM 167 OE1 GLU B 153 16.523 -12.897 -26.972 1.00 0.00 O
+ATOM 168 OE2 GLU B 153 16.707 -11.262 -28.317 1.00 0.00 O1-
+ATOM 169 H GLU B 153 20.842 -11.041 -27.843 1.00 0.00 H
+ATOM 170 HA GLU B 153 18.736 -11.296 -25.925 1.00 0.00 H
+ATOM 171 1HB GLU B 153 20.366 -13.381 -27.427 1.00 0.00 H
+ATOM 172 2HB GLU B 153 18.984 -13.777 -26.415 1.00 0.00 H
+ATOM 173 1HG GLU B 153 18.944 -12.028 -28.884 1.00 0.00 H
+ATOM 174 2HG GLU B 153 18.381 -13.694 -28.771 1.00 0.00 H
+ATOM 175 N GLU B 154 21.712 -12.306 -24.968 1.00 0.00 N
+ATOM 176 CA GLU B 154 22.509 -12.648 -23.796 1.00 0.00 C
+ATOM 177 C GLU B 154 22.451 -11.543 -22.749 1.00 0.00 C
+ATOM 178 O GLU B 154 22.352 -11.814 -21.553 1.00 0.00 O
+ATOM 179 CB GLU B 154 23.963 -12.908 -24.197 1.00 0.00 C
+ATOM 180 CG GLU B 154 24.186 -14.218 -24.940 1.00 0.00 C
+ATOM 181 CD GLU B 154 25.604 -14.392 -25.406 1.00 0.00 C
+ATOM 182 OE1 GLU B 154 26.395 -13.505 -25.188 1.00 0.00 O
+ATOM 183 OE2 GLU B 154 25.898 -15.414 -25.981 1.00 0.00 O1-
+ATOM 184 H GLU B 154 22.173 -12.183 -25.858 1.00 0.00 H
+ATOM 185 HA GLU B 154 22.099 -13.555 -23.352 1.00 0.00 H
+ATOM 186 1HB GLU B 154 24.315 -12.097 -24.836 1.00 0.00 H
+ATOM 187 2HB GLU B 154 24.590 -12.918 -23.306 1.00 0.00 H
+ATOM 188 1HG GLU B 154 23.928 -15.046 -24.280 1.00 0.00 H
+ATOM 189 2HG GLU B 154 23.519 -14.253 -25.800 1.00 0.00 H
+ATOM 190 N LEU B 155 22.516 -10.298 -23.207 1.00 0.00 N
+ATOM 191 CA LEU B 155 22.447 -9.149 -22.311 1.00 0.00 C
+ATOM 192 C LEU B 155 21.116 -9.107 -21.570 1.00 0.00 C
+ATOM 193 O LEU B 155 21.070 -8.816 -20.375 1.00 0.00 O
+ATOM 194 CB LEU B 155 22.639 -7.849 -23.103 1.00 0.00 C
+ATOM 195 CG LEU B 155 24.064 -7.579 -23.603 1.00 0.00 C
+ATOM 196 CD1 LEU B 155 24.039 -6.449 -24.623 1.00 0.00 C
+ATOM 197 CD2 LEU B 155 24.959 -7.231 -22.423 1.00 0.00 C
+ATOM 198 H LEU B 155 22.615 -10.143 -24.200 1.00 0.00 H
+ATOM 199 HA LEU B 155 23.247 -9.234 -21.577 1.00 0.00 H
+ATOM 200 1HB LEU B 155 21.982 -7.870 -23.970 1.00 0.00 H
+ATOM 201 2HB LEU B 155 22.346 -7.010 -22.471 1.00 0.00 H
+ATOM 202 HG LEU B 155 24.450 -8.469 -24.101 1.00 0.00 H
+ATOM 203 1HD1 LEU B 155 25.052 -6.258 -24.979 1.00 0.00 H
+ATOM 204 2HD1 LEU B 155 23.408 -6.733 -25.465 1.00 0.00 H
+ATOM 205 3HD1 LEU B 155 23.642 -5.548 -24.158 1.00 0.00 H
+ATOM 206 1HD2 LEU B 155 25.972 -7.040 -22.778 1.00 0.00 H
+ATOM 207 2HD2 LEU B 155 24.576 -6.340 -21.925 1.00 0.00 H
+ATOM 208 3HD2 LEU B 155 24.973 -8.063 -21.718 1.00 0.00 H
+ATOM 209 N LEU B 156 20.036 -9.400 -22.286 1.00 0.00 N
+ATOM 210 CA LEU B 156 18.701 -9.386 -21.701 1.00 0.00 C
+ATOM 211 C LEU B 156 18.554 -10.466 -20.637 1.00 0.00 C
+ATOM 212 O LEU B 156 17.945 -10.242 -19.591 1.00 0.00 O
+ATOM 213 CB LEU B 156 17.642 -9.586 -22.792 1.00 0.00 C
+ATOM 214 CG LEU B 156 17.505 -8.442 -23.805 1.00 0.00 C
+ATOM 215 CD1 LEU B 156 16.640 -8.897 -24.972 1.00 0.00 C
+ATOM 216 CD2 LEU B 156 16.903 -7.225 -23.119 1.00 0.00 C
+ATOM 217 H LEU B 156 20.142 -9.640 -23.261 1.00 0.00 H
+ATOM 218 HA LEU B 156 18.541 -8.416 -21.229 1.00 0.00 H
+ATOM 219 1HB LEU B 156 17.881 -10.492 -23.346 1.00 0.00 H
+ATOM 220 2HB LEU B 156 16.672 -9.723 -22.314 1.00 0.00 H
+ATOM 221 HG LEU B 156 18.489 -8.186 -24.199 1.00 0.00 H
+ATOM 222 1HD1 LEU B 156 16.543 -8.084 -25.692 1.00 0.00 H
+ATOM 223 2HD1 LEU B 156 17.104 -9.756 -25.456 1.00 0.00 H
+ATOM 224 3HD1 LEU B 156 15.652 -9.175 -24.605 1.00 0.00 H
+ATOM 225 1HD2 LEU B 156 16.807 -6.411 -23.838 1.00 0.00 H
+ATOM 226 2HD2 LEU B 156 15.919 -7.479 -22.725 1.00 0.00 H
+ATOM 227 3HD2 LEU B 156 17.551 -6.911 -22.300 1.00 0.00 H
+ATOM 228 N GLU B 157 19.114 -11.638 -20.911 1.00 0.00 N
+ATOM 229 CA GLU B 157 19.116 -12.732 -19.946 1.00 0.00 C
+ATOM 230 C GLU B 157 19.987 -12.401 -18.741 1.00 0.00 C
+ATOM 231 O GLU B 157 19.608 -12.662 -17.599 1.00 0.00 O
+ATOM 232 CB GLU B 157 19.607 -14.023 -20.604 1.00 0.00 C
+ATOM 233 CG GLU B 157 18.638 -14.623 -21.613 1.00 0.00 C
+ATOM 234 CD GLU B 157 19.182 -15.850 -22.290 1.00 0.00 C
+ATOM 235 OE1 GLU B 157 20.327 -16.167 -22.071 1.00 0.00 O
+ATOM 236 OE2 GLU B 157 18.453 -16.471 -23.026 1.00 0.00 O1-
+ATOM 237 H GLU B 157 19.552 -11.777 -21.812 1.00 0.00 H
+ATOM 238 HA GLU B 157 18.093 -12.891 -19.601 1.00 0.00 H
+ATOM 239 1HB GLU B 157 20.550 -13.835 -21.117 1.00 0.00 H
+ATOM 240 2HB GLU B 157 19.796 -14.774 -19.836 1.00 0.00 H
+ATOM 241 1HG GLU B 157 17.712 -14.885 -21.101 1.00 0.00 H
+ATOM 242 2HG GLU B 157 18.404 -13.872 -22.367 1.00 0.00 H
+ATOM 243 N LYS B 158 21.156 -11.825 -19.001 1.00 0.00 N
+ATOM 244 CA LYS B 158 22.063 -11.416 -17.937 1.00 0.00 C
+ATOM 245 C LYS B 158 21.425 -10.357 -17.047 1.00 0.00 C
+ATOM 246 O LYS B 158 21.640 -10.339 -15.835 1.00 0.00 O
+ATOM 247 CB LYS B 158 23.374 -10.889 -18.524 1.00 0.00 C
+ATOM 248 CG LYS B 158 24.290 -11.969 -19.086 1.00 0.00 C
+ATOM 249 CD LYS B 158 25.505 -11.361 -19.769 1.00 0.00 C
+ATOM 250 CE LYS B 158 26.421 -12.438 -20.332 1.00 0.00 C
+ATOM 251 NZ LYS B 158 27.568 -11.857 -21.082 1.00 0.00 N1+
+ATOM 252 H LYS B 158 21.423 -11.668 -19.963 1.00 0.00 H
+ATOM 253 HA LYS B 158 22.289 -12.287 -17.320 1.00 0.00 H
+ATOM 254 1HB LYS B 158 23.156 -10.184 -19.326 1.00 0.00 H
+ATOM 255 2HB LYS B 158 23.926 -10.349 -17.754 1.00 0.00 H
+ATOM 256 1HG LYS B 158 24.625 -12.619 -18.277 1.00 0.00 H
+ATOM 257 2HG LYS B 158 23.741 -12.572 -19.808 1.00 0.00 H
+ATOM 258 1HD LYS B 158 25.179 -10.712 -20.583 1.00 0.00 H
+ATOM 259 2HD LYS B 158 26.065 -10.761 -19.051 1.00 0.00 H
+ATOM 260 1HE LYS B 158 26.807 -13.049 -19.518 1.00 0.00 H
+ATOM 261 2HE LYS B 158 25.854 -13.083 -21.004 1.00 0.00 H
+ATOM 262 1HZ LYS B 158 28.150 -12.602 -21.438 1.00 0.00 H
+ATOM 263 2HZ LYS B 158 27.222 -11.303 -21.852 1.00 0.00 H
+ATOM 264 3HZ LYS B 158 28.113 -11.272 -20.464 1.00 0.00 H
+ATOM 265 N ALA B 159 20.638 -9.475 -17.655 1.00 0.00 N
+ATOM 266 CA ALA B 159 19.953 -8.422 -16.916 1.00 0.00 C
+ATOM 267 C ALA B 159 19.232 -8.983 -15.698 1.00 0.00 C
+ATOM 268 O ALA B 159 19.313 -8.424 -14.604 1.00 0.00 O
+ATOM 269 CB ALA B 159 18.972 -7.692 -17.821 1.00 0.00 C
+ATOM 270 H ALA B 159 20.513 -9.537 -18.655 1.00 0.00 H
+ATOM 271 HA ALA B 159 20.696 -7.701 -16.572 1.00 0.00 H
+ATOM 272 1HB ALA B 159 18.468 -6.908 -17.255 1.00 0.00 H
+ATOM 273 2HB ALA B 159 19.511 -7.246 -18.657 1.00 0.00 H
+ATOM 274 3HB ALA B 159 18.234 -8.396 -18.201 1.00 0.00 H
+ATOM 275 N ARG B 160 18.527 -10.093 -15.893 1.00 0.00 N
+ATOM 276 CA ARG B 160 17.786 -10.730 -14.811 1.00 0.00 C
+ATOM 277 C ARG B 160 18.720 -11.204 -13.706 1.00 0.00 C
+ATOM 278 O ARG B 160 18.415 -11.070 -12.522 1.00 0.00 O
+ATOM 279 CB ARG B 160 16.985 -11.913 -15.335 1.00 0.00 C
+ATOM 280 CG ARG B 160 15.805 -11.545 -16.221 1.00 0.00 C
+ATOM 281 CD ARG B 160 14.972 -12.730 -16.548 1.00 0.00 C
+ATOM 282 NE ARG B 160 14.283 -13.248 -15.377 1.00 0.00 N
+ATOM 283 CZ ARG B 160 13.797 -14.500 -15.267 1.00 0.00 C
+ATOM 284 NH1 ARG B 160 13.931 -15.347 -16.263 1.00 0.00 N1+
+ATOM 285 NH2 ARG B 160 13.185 -14.876 -14.157 1.00 0.00 N
+ATOM 286 H ARG B 160 18.504 -10.505 -16.815 1.00 0.00 H
+ATOM 287 HA ARG B 160 17.104 -9.995 -14.379 1.00 0.00 H
+ATOM 288 1HB ARG B 160 17.638 -12.567 -15.911 1.00 0.00 H
+ATOM 289 2HB ARG B 160 16.599 -12.492 -14.496 1.00 0.00 H
+ATOM 290 1HG ARG B 160 15.178 -10.816 -15.707 1.00 0.00 H
+ATOM 291 2HG ARG B 160 16.171 -11.115 -17.154 1.00 0.00 H
+ATOM 292 1HD ARG B 160 14.224 -12.456 -17.290 1.00 0.00 H
+ATOM 293 2HD ARG B 160 15.606 -13.521 -16.948 1.00 0.00 H
+ATOM 294 HE ARG B 160 14.161 -12.625 -14.590 1.00 0.00 H
+ATOM 295 1HH1 ARG B 160 14.400 -15.060 -17.111 1.00 0.00 H
+ATOM 296 2HH1 ARG B 160 13.567 -16.285 -16.180 1.00 0.00 H
+ATOM 297 1HH2 ARG B 160 13.081 -14.224 -13.392 1.00 0.00 H
+ATOM 298 2HH2 ARG B 160 12.820 -15.813 -14.075 1.00 0.00 H
+ATOM 299 N LYS B 161 19.862 -11.757 -14.101 1.00 0.00 N
+ATOM 300 CA LYS B 161 20.874 -12.191 -13.146 1.00 0.00 C
+ATOM 301 C LYS B 161 21.483 -11.004 -12.411 1.00 0.00 C
+ATOM 302 O LYS B 161 22.027 -11.152 -11.317 1.00 0.00 O
+ATOM 303 CB LYS B 161 21.970 -12.991 -13.853 1.00 0.00 C
+ATOM 304 CG LYS B 161 21.516 -14.341 -14.392 1.00 0.00 C
+ATOM 305 CD LYS B 161 22.654 -15.068 -15.090 1.00 0.00 C
+ATOM 306 CE LYS B 161 22.197 -16.408 -15.647 1.00 0.00 C
+ATOM 307 NZ LYS B 161 23.295 -17.121 -16.355 1.00 0.00 N1+
+ATOM 308 H LYS B 161 20.033 -11.880 -15.089 1.00 0.00 H
+ATOM 309 HA LYS B 161 20.399 -12.839 -12.409 1.00 0.00 H
+ATOM 310 1HB LYS B 161 22.361 -12.411 -14.689 1.00 0.00 H
+ATOM 311 2HB LYS B 161 22.795 -13.167 -13.162 1.00 0.00 H
+ATOM 312 1HG LYS B 161 21.152 -14.957 -13.569 1.00 0.00 H
+ATOM 313 2HG LYS B 161 20.701 -14.194 -15.100 1.00 0.00 H
+ATOM 314 1HD LYS B 161 23.032 -14.454 -15.908 1.00 0.00 H
+ATOM 315 2HD LYS B 161 23.466 -15.238 -14.383 1.00 0.00 H
+ATOM 316 1HE LYS B 161 21.838 -17.037 -14.834 1.00 0.00 H
+ATOM 317 2HE LYS B 161 21.375 -16.250 -16.345 1.00 0.00 H
+ATOM 318 1HZ LYS B 161 22.952 -18.002 -16.709 1.00 0.00 H
+ATOM 319 2HZ LYS B 161 23.624 -16.554 -17.125 1.00 0.00 H
+ATOM 320 3HZ LYS B 161 24.056 -17.290 -15.713 1.00 0.00 H
+ATOM 321 N LEU B 162 21.386 -9.826 -13.018 1.00 0.00 N
+ATOM 322 CA LEU B 162 21.974 -8.619 -12.448 1.00 0.00 C
+ATOM 323 C LEU B 162 20.977 -7.891 -11.555 1.00 0.00 C
+ATOM 324 O LEU B 162 21.259 -6.801 -11.057 1.00 0.00 O
+ATOM 325 CB LEU B 162 22.450 -7.681 -13.565 1.00 0.00 C
+ATOM 326 CG LEU B 162 23.591 -8.214 -14.440 1.00 0.00 C
+ATOM 327 CD1 LEU B 162 23.775 -7.303 -15.646 1.00 0.00 C
+ATOM 328 CD2 LEU B 162 24.868 -8.296 -13.616 1.00 0.00 C
+ATOM 329 H LEU B 162 20.893 -9.764 -13.897 1.00 0.00 H
+ATOM 330 HA LEU B 162 22.819 -8.909 -11.821 1.00 0.00 H
+ATOM 331 1HB LEU B 162 21.606 -7.462 -14.217 1.00 0.00 H
+ATOM 332 2HB LEU B 162 22.786 -6.747 -13.115 1.00 0.00 H
+ATOM 333 HG LEU B 162 23.333 -9.207 -14.809 1.00 0.00 H
+ATOM 334 1HD1 LEU B 162 24.586 -7.682 -16.268 1.00 0.00 H
+ATOM 335 2HD1 LEU B 162 22.853 -7.279 -16.228 1.00 0.00 H
+ATOM 336 3HD1 LEU B 162 24.018 -6.297 -15.308 1.00 0.00 H
+ATOM 337 1HD2 LEU B 162 25.679 -8.675 -14.239 1.00 0.00 H
+ATOM 338 2HD2 LEU B 162 25.127 -7.303 -13.248 1.00 0.00 H
+ATOM 339 3HD2 LEU B 162 24.713 -8.967 -12.772 1.00 0.00 H
+ATOM 340 N GLY B 163 19.814 -8.499 -11.357 1.00 0.00 N
+ATOM 341 CA GLY B 163 18.852 -8.011 -10.375 1.00 0.00 C
+ATOM 342 C GLY B 163 17.728 -7.231 -11.046 1.00 0.00 C
+ATOM 343 O GLY B 163 16.932 -6.572 -10.378 1.00 0.00 O
+ATOM 344 H GLY B 163 19.589 -9.320 -11.901 1.00 0.00 H
+ATOM 345 1HA GLY B 163 18.435 -8.854 -9.824 1.00 0.00 H
+ATOM 346 2HA GLY B 163 19.361 -7.374 -9.653 1.00 0.00 H
+ATOM 347 N VAL B 164 17.669 -7.308 -12.371 1.00 0.00 N
+ATOM 348 CA VAL B 164 16.592 -6.684 -13.128 1.00 0.00 C
+ATOM 349 C VAL B 164 15.336 -7.547 -13.115 1.00 0.00 C
+ATOM 350 O VAL B 164 15.401 -8.757 -13.333 1.00 0.00 O
+ATOM 351 CB VAL B 164 17.032 -6.444 -14.585 1.00 0.00 C
+ATOM 352 CG1 VAL B 164 15.883 -5.871 -15.401 1.00 0.00 C
+ATOM 353 CG2 VAL B 164 18.233 -5.513 -14.616 1.00 0.00 C
+ATOM 354 H VAL B 164 18.390 -7.813 -12.866 1.00 0.00 H
+ATOM 355 HA VAL B 164 16.359 -5.722 -12.670 1.00 0.00 H
+ATOM 356 HB VAL B 164 17.300 -7.400 -15.035 1.00 0.00 H
+ATOM 357 1HG1 VAL B 164 16.211 -5.708 -16.428 1.00 0.00 H
+ATOM 358 2HG1 VAL B 164 15.047 -6.570 -15.394 1.00 0.00 H
+ATOM 359 3HG1 VAL B 164 15.567 -4.922 -14.967 1.00 0.00 H
+ATOM 360 1HG2 VAL B 164 18.540 -5.349 -15.649 1.00 0.00 H
+ATOM 361 2HG2 VAL B 164 17.967 -4.559 -14.160 1.00 0.00 H
+ATOM 362 3HG2 VAL B 164 19.057 -5.962 -14.061 1.00 0.00 H
+ATOM 363 N SER B 165 14.195 -6.918 -12.858 1.00 0.00 N
+ATOM 364 CA SER B 165 12.952 -7.648 -12.635 1.00 0.00 C
+ATOM 365 C SER B 165 12.465 -8.310 -13.917 1.00 0.00 C
+ATOM 366 O SER B 165 12.899 -7.957 -15.013 1.00 0.00 O
+ATOM 367 CB SER B 165 11.885 -6.712 -12.101 1.00 0.00 C
+ATOM 368 OG SER B 165 11.496 -5.786 -13.078 1.00 0.00 O
+ATOM 369 H SER B 165 14.187 -5.909 -12.816 1.00 0.00 H
+ATOM 370 HA SER B 165 13.137 -8.429 -11.895 1.00 0.00 H
+ATOM 371 1HB SER B 165 11.020 -7.292 -11.780 1.00 0.00 H
+ATOM 372 2HB SER B 165 12.267 -6.185 -11.228 1.00 0.00 H
+ATOM 373 HG SER B 165 12.167 -5.099 -13.074 1.00 0.00 H
+ATOM 374 N GLU B 166 11.558 -9.271 -13.773 1.00 0.00 N
+ATOM 375 CA GLU B 166 11.001 -9.977 -14.920 1.00 0.00 C
+ATOM 376 C GLU B 166 10.245 -9.025 -15.839 1.00 0.00 C
+ATOM 377 O GLU B 166 10.288 -9.161 -17.062 1.00 0.00 O
+ATOM 378 CB GLU B 166 10.070 -11.099 -14.455 1.00 0.00 C
+ATOM 379 CG GLU B 166 10.783 -12.289 -13.831 1.00 0.00 C
+ATOM 380 CD GLU B 166 11.312 -11.998 -12.454 1.00 0.00 C
+ATOM 381 OE1 GLU B 166 10.938 -10.996 -11.894 1.00 0.00 O
+ATOM 382 OE2 GLU B 166 12.092 -12.779 -11.961 1.00 0.00 O1-
+ATOM 383 H GLU B 166 11.247 -9.519 -12.844 1.00 0.00 H
+ATOM 384 HA GLU B 166 11.822 -10.416 -15.488 1.00 0.00 H
+ATOM 385 1HB GLU B 166 9.367 -10.707 -13.720 1.00 0.00 H
+ATOM 386 2HB GLU B 166 9.488 -11.464 -15.302 1.00 0.00 H
+ATOM 387 1HG GLU B 166 10.088 -13.126 -13.771 1.00 0.00 H
+ATOM 388 2HG GLU B 166 11.609 -12.584 -14.477 1.00 0.00 H
+ATOM 389 N ILE B 167 9.552 -8.061 -15.242 1.00 0.00 N
+ATOM 390 CA ILE B 167 8.778 -7.089 -16.005 1.00 0.00 C
+ATOM 391 C ILE B 167 9.687 -6.158 -16.796 1.00 0.00 C
+ATOM 392 O ILE B 167 9.424 -5.860 -17.961 1.00 0.00 O
+ATOM 393 CB ILE B 167 7.873 -6.258 -15.078 1.00 0.00 C
+ATOM 394 CG1 ILE B 167 6.926 -7.172 -14.296 1.00 0.00 C
+ATOM 395 CG2 ILE B 167 7.086 -5.233 -15.881 1.00 0.00 C
+ATOM 396 CD1 ILE B 167 6.076 -8.065 -15.172 1.00 0.00 C
+ATOM 397 H ILE B 167 9.563 -7.999 -14.234 1.00 0.00 H
+ATOM 398 HA ILE B 167 8.146 -7.629 -16.712 1.00 0.00 H
+ATOM 399 HB ILE B 167 8.485 -5.737 -14.343 1.00 0.00 H
+ATOM 400 1HG1 ILE B 167 7.504 -7.805 -13.623 1.00 0.00 H
+ATOM 401 2HG1 ILE B 167 6.260 -6.566 -13.681 1.00 0.00 H
+ATOM 402 1HG2 ILE B 167 6.451 -4.655 -15.210 1.00 0.00 H
+ATOM 403 2HG2 ILE B 167 7.777 -4.565 -16.393 1.00 0.00 H
+ATOM 404 3HG2 ILE B 167 6.465 -5.746 -16.616 1.00 0.00 H
+ATOM 405 1HD1 ILE B 167 5.432 -8.682 -14.546 1.00 0.00 H
+ATOM 406 2HD1 ILE B 167 5.462 -7.450 -15.831 1.00 0.00 H
+ATOM 407 3HD1 ILE B 167 6.721 -8.706 -15.771 1.00 0.00 H
+ATOM 408 N GLU B 168 10.758 -5.701 -16.156 1.00 0.00 N
+ATOM 409 CA GLU B 168 11.756 -4.874 -16.826 1.00 0.00 C
+ATOM 410 C GLU B 168 12.429 -5.635 -17.960 1.00 0.00 C
+ATOM 411 O GLU B 168 12.733 -5.066 -19.009 1.00 0.00 O
+ATOM 412 CB GLU B 168 12.810 -4.393 -15.826 1.00 0.00 C
+ATOM 413 CG GLU B 168 12.329 -3.298 -14.884 1.00 0.00 C
+ATOM 414 CD GLU B 168 13.274 -3.054 -13.741 1.00 0.00 C
+ATOM 415 OE1 GLU B 168 13.662 -4.003 -13.102 1.00 0.00 O
+ATOM 416 OE2 GLU B 168 13.609 -1.917 -13.505 1.00 0.00 O1-
+ATOM 417 H GLU B 168 10.883 -5.930 -15.181 1.00 0.00 H
+ATOM 418 HA GLU B 168 11.247 -4.012 -17.258 1.00 0.00 H
+ATOM 419 1HB GLU B 168 13.145 -5.234 -15.219 1.00 0.00 H
+ATOM 420 2HB GLU B 168 13.677 -4.013 -16.366 1.00 0.00 H
+ATOM 421 1HG GLU B 168 12.213 -2.373 -15.448 1.00 0.00 H
+ATOM 422 2HG GLU B 168 11.353 -3.576 -14.489 1.00 0.00 H
+ATOM 423 N TYR B 169 12.660 -6.927 -17.745 1.00 0.00 N
+ATOM 424 CA TYR B 169 13.163 -7.801 -18.798 1.00 0.00 C
+ATOM 425 C TYR B 169 12.251 -7.773 -20.017 1.00 0.00 C
+ATOM 426 O TYR B 169 12.711 -7.591 -21.145 1.00 0.00 O
+ATOM 427 CB TYR B 169 13.312 -9.233 -18.279 1.00 0.00 C
+ATOM 428 CG TYR B 169 13.511 -10.260 -19.372 1.00 0.00 C
+ATOM 429 CD1 TYR B 169 14.772 -10.459 -19.916 1.00 0.00 C
+ATOM 430 CD2 TYR B 169 12.434 -11.004 -19.830 1.00 0.00 C
+ATOM 431 CE1 TYR B 169 14.954 -11.397 -20.913 1.00 0.00 C
+ATOM 432 CE2 TYR B 169 12.616 -11.942 -20.827 1.00 0.00 C
+ATOM 433 CZ TYR B 169 13.870 -12.139 -21.368 1.00 0.00 C
+ATOM 434 OH TYR B 169 14.052 -13.073 -22.362 1.00 0.00 O
+ATOM 435 H TYR B 169 12.484 -7.311 -16.828 1.00 0.00 H
+ATOM 436 HA TYR B 169 14.149 -7.449 -19.098 1.00 0.00 H
+ATOM 437 1HB TYR B 169 14.164 -9.288 -17.601 1.00 0.00 H
+ATOM 438 2HB TYR B 169 12.424 -9.509 -17.712 1.00 0.00 H
+ATOM 439 HD1 TYR B 169 15.619 -9.874 -19.556 1.00 0.00 H
+ATOM 440 HD2 TYR B 169 11.443 -10.847 -19.403 1.00 0.00 H
+ATOM 441 HE1 TYR B 169 15.945 -11.552 -21.340 1.00 0.00 H
+ATOM 442 HE2 TYR B 169 11.769 -12.526 -21.188 1.00 0.00 H
+ATOM 443 HH TYR B 169 13.212 -13.495 -22.560 1.00 0.00 H
+ATOM 444 N TYR B 170 10.955 -7.955 -19.786 1.00 0.00 N
+ATOM 445 CA TYR B 170 9.974 -7.939 -20.865 1.00 0.00 C
+ATOM 446 C TYR B 170 9.859 -6.553 -21.484 1.00 0.00 C
+ATOM 447 O TYR B 170 9.703 -6.416 -22.698 1.00 0.00 O
+ATOM 448 CB TYR B 170 8.610 -8.408 -20.354 1.00 0.00 C
+ATOM 449 CG TYR B 170 8.565 -9.875 -19.988 1.00 0.00 C
+ATOM 450 CD1 TYR B 170 8.219 -10.258 -18.701 1.00 0.00 C
+ATOM 451 CD2 TYR B 170 8.871 -10.836 -20.940 1.00 0.00 C
+ATOM 452 CE1 TYR B 170 8.178 -11.598 -18.366 1.00 0.00 C
+ATOM 453 CE2 TYR B 170 8.831 -12.176 -20.605 1.00 0.00 C
+ATOM 454 CZ TYR B 170 8.486 -12.558 -19.325 1.00 0.00 C
+ATOM 455 OH TYR B 170 8.446 -13.892 -18.992 1.00 0.00 O
+ATOM 456 H TYR B 170 10.642 -8.107 -18.838 1.00 0.00 H
+ATOM 457 HA TYR B 170 10.307 -8.626 -21.643 1.00 0.00 H
+ATOM 458 1HB TYR B 170 8.332 -7.828 -19.472 1.00 0.00 H
+ATOM 459 2HB TYR B 170 7.853 -8.224 -21.117 1.00 0.00 H
+ATOM 460 HD1 TYR B 170 7.978 -9.502 -17.953 1.00 0.00 H
+ATOM 461 HD2 TYR B 170 9.144 -10.535 -21.951 1.00 0.00 H
+ATOM 462 HE1 TYR B 170 7.906 -11.899 -17.355 1.00 0.00 H
+ATOM 463 HE2 TYR B 170 9.072 -12.932 -21.353 1.00 0.00 H
+ATOM 464 HH TYR B 170 8.609 -14.421 -19.776 1.00 0.00 H
+ATOM 465 N ILE B 171 9.935 -5.526 -20.644 1.00 0.00 N
+ATOM 466 CA ILE B 171 9.867 -4.147 -21.111 1.00 0.00 C
+ATOM 467 C ILE B 171 10.995 -3.840 -22.088 1.00 0.00 C
+ATOM 468 O ILE B 171 10.781 -3.200 -23.118 1.00 0.00 O
+ATOM 469 CB ILE B 171 9.928 -3.163 -19.929 1.00 0.00 C
+ATOM 470 CG1 ILE B 171 8.605 -3.169 -19.160 1.00 0.00 C
+ATOM 471 CG2 ILE B 171 10.256 -1.761 -20.420 1.00 0.00 C
+ATOM 472 CD1 ILE B 171 8.675 -2.475 -17.819 1.00 0.00 C
+ATOM 473 H ILE B 171 10.043 -5.706 -19.656 1.00 0.00 H
+ATOM 474 HA ILE B 171 8.920 -4.004 -21.630 1.00 0.00 H
+ATOM 475 HB ILE B 171 10.701 -3.482 -19.230 1.00 0.00 H
+ATOM 476 1HG1 ILE B 171 7.835 -2.682 -19.757 1.00 0.00 H
+ATOM 477 2HG1 ILE B 171 8.286 -4.198 -18.993 1.00 0.00 H
+ATOM 478 1HG2 ILE B 171 10.295 -1.078 -19.572 1.00 0.00 H
+ATOM 479 2HG2 ILE B 171 11.221 -1.769 -20.924 1.00 0.00 H
+ATOM 480 3HG2 ILE B 171 9.485 -1.430 -21.117 1.00 0.00 H
+ATOM 481 1HD1 ILE B 171 7.699 -2.521 -17.334 1.00 0.00 H
+ATOM 482 2HD1 ILE B 171 9.416 -2.970 -17.191 1.00 0.00 H
+ATOM 483 3HD1 ILE B 171 8.958 -1.433 -17.963 1.00 0.00 H
+ATOM 484 N ALA B 172 12.197 -4.300 -21.759 1.00 0.00 N
+ATOM 485 CA ALA B 172 13.338 -4.177 -22.659 1.00 0.00 C
+ATOM 486 C ALA B 172 13.029 -4.777 -24.025 1.00 0.00 C
+ATOM 487 O ALA B 172 13.316 -4.173 -25.058 1.00 0.00 O
+ATOM 488 CB ALA B 172 14.565 -4.843 -22.053 1.00 0.00 C
+ATOM 489 H ALA B 172 12.324 -4.748 -20.862 1.00 0.00 H
+ATOM 490 HA ALA B 172 13.551 -3.118 -22.804 1.00 0.00 H
+ATOM 491 1HB ALA B 172 15.408 -4.742 -22.737 1.00 0.00 H
+ATOM 492 2HB ALA B 172 14.808 -4.364 -21.105 1.00 0.00 H
+ATOM 493 3HB ALA B 172 14.359 -5.899 -21.884 1.00 0.00 H
+ATOM 494 N ARG B 173 12.444 -5.970 -24.022 1.00 0.00 N
+ATOM 495 CA ARG B 173 12.085 -6.651 -25.261 1.00 0.00 C
+ATOM 496 C ARG B 173 11.019 -5.876 -26.025 1.00 0.00 C
+ATOM 497 O ARG B 173 11.109 -5.715 -27.242 1.00 0.00 O
+ATOM 498 CB ARG B 173 11.578 -8.056 -24.972 1.00 0.00 C
+ATOM 499 CG ARG B 173 12.623 -9.012 -24.420 1.00 0.00 C
+ATOM 500 CD ARG B 173 12.065 -10.372 -24.206 1.00 0.00 C
+ATOM 501 NE ARG B 173 11.855 -11.075 -25.462 1.00 0.00 N
+ATOM 502 CZ ARG B 173 12.806 -11.767 -26.119 1.00 0.00 C
+ATOM 503 NH1 ARG B 173 14.024 -11.840 -25.628 1.00 0.00 N1+
+ATOM 504 NH2 ARG B 173 12.515 -12.374 -27.257 1.00 0.00 N
+ATOM 505 H ARG B 173 12.242 -6.417 -23.139 1.00 0.00 H
+ATOM 506 HA ARG B 173 12.973 -6.715 -25.890 1.00 0.00 H
+ATOM 507 1HB ARG B 173 10.762 -8.007 -24.252 1.00 0.00 H
+ATOM 508 2HB ARG B 173 11.181 -8.495 -25.887 1.00 0.00 H
+ATOM 509 1HG ARG B 173 13.454 -9.088 -25.122 1.00 0.00 H
+ATOM 510 2HG ARG B 173 12.989 -8.638 -23.463 1.00 0.00 H
+ATOM 511 1HD ARG B 173 12.755 -10.957 -23.599 1.00 0.00 H
+ATOM 512 2HD ARG B 173 11.107 -10.296 -23.694 1.00 0.00 H
+ATOM 513 HE ARG B 173 10.931 -11.042 -25.870 1.00 0.00 H
+ATOM 514 1HH1 ARG B 173 14.247 -11.377 -24.759 1.00 0.00 H
+ATOM 515 2HH1 ARG B 173 14.736 -12.359 -26.121 1.00 0.00 H
+ATOM 516 1HH2 ARG B 173 11.579 -12.318 -27.634 1.00 0.00 H
+ATOM 517 2HH2 ARG B 173 13.227 -12.892 -27.749 1.00 0.00 H
+ATOM 518 N LEU B 174 10.009 -5.399 -25.304 1.00 0.00 N
+ATOM 519 CA LEU B 174 8.903 -4.676 -25.920 1.00 0.00 C
+ATOM 520 C LEU B 174 9.389 -3.405 -26.603 1.00 0.00 C
+ATOM 521 O LEU B 174 8.963 -3.084 -27.713 1.00 0.00 O
+ATOM 522 CB LEU B 174 7.846 -4.326 -24.865 1.00 0.00 C
+ATOM 523 CG LEU B 174 7.092 -5.516 -24.258 1.00 0.00 C
+ATOM 524 CD1 LEU B 174 6.282 -5.046 -23.058 1.00 0.00 C
+ATOM 525 CD2 LEU B 174 6.192 -6.139 -25.315 1.00 0.00 C
+ATOM 526 H LEU B 174 10.010 -5.542 -24.305 1.00 0.00 H
+ATOM 527 HA LEU B 174 8.447 -5.318 -26.673 1.00 0.00 H
+ATOM 528 1HB LEU B 174 8.333 -3.792 -24.050 1.00 0.00 H
+ATOM 529 2HB LEU B 174 7.109 -3.663 -25.318 1.00 0.00 H
+ATOM 530 HG LEU B 174 7.808 -6.260 -23.907 1.00 0.00 H
+ATOM 531 1HD1 LEU B 174 5.746 -5.892 -22.626 1.00 0.00 H
+ATOM 532 2HD1 LEU B 174 6.952 -4.623 -22.309 1.00 0.00 H
+ATOM 533 3HD1 LEU B 174 5.567 -4.288 -23.376 1.00 0.00 H
+ATOM 534 1HD2 LEU B 174 5.657 -6.986 -24.884 1.00 0.00 H
+ATOM 535 2HD2 LEU B 174 5.475 -5.397 -25.666 1.00 0.00 H
+ATOM 536 3HD2 LEU B 174 6.799 -6.483 -26.153 1.00 0.00 H
+ATOM 537 N LEU B 175 10.279 -2.682 -25.932 1.00 0.00 N
+ATOM 538 CA LEU B 175 10.825 -1.443 -26.474 1.00 0.00 C
+ATOM 539 C LEU B 175 11.726 -1.715 -27.673 1.00 0.00 C
+ATOM 540 O LEU B 175 11.727 -0.960 -28.644 1.00 0.00 O
+ATOM 541 CB LEU B 175 11.615 -0.695 -25.393 1.00 0.00 C
+ATOM 542 CG LEU B 175 10.789 -0.157 -24.217 1.00 0.00 C
+ATOM 543 CD1 LEU B 175 11.722 0.268 -23.092 1.00 0.00 C
+ATOM 544 CD2 LEU B 175 9.934 1.010 -24.689 1.00 0.00 C
+ATOM 545 H LEU B 175 10.587 -3.000 -25.024 1.00 0.00 H
+ATOM 546 HA LEU B 175 9.997 -0.817 -26.805 1.00 0.00 H
+ATOM 547 1HB LEU B 175 12.370 -1.366 -24.987 1.00 0.00 H
+ATOM 548 2HB LEU B 175 12.122 0.152 -25.856 1.00 0.00 H
+ATOM 549 HG LEU B 175 10.143 -0.948 -23.834 1.00 0.00 H
+ATOM 550 1HD1 LEU B 175 11.135 0.649 -22.256 1.00 0.00 H
+ATOM 551 2HD1 LEU B 175 12.307 -0.591 -22.761 1.00 0.00 H
+ATOM 552 3HD1 LEU B 175 12.392 1.048 -23.450 1.00 0.00 H
+ATOM 553 1HD2 LEU B 175 9.346 1.391 -23.853 1.00 0.00 H
+ATOM 554 2HD2 LEU B 175 10.578 1.802 -25.071 1.00 0.00 H
+ATOM 555 3HD2 LEU B 175 9.264 0.674 -25.481 1.00 0.00 H
+ATOM 556 N LEU B 176 12.490 -2.799 -27.597 1.00 0.00 N
+ATOM 557 CA LEU B 176 13.393 -3.176 -28.678 1.00 0.00 C
+ATOM 558 C LEU B 176 12.623 -3.515 -29.947 1.00 0.00 C
+ATOM 559 O LEU B 176 13.049 -3.181 -31.053 1.00 0.00 O
+ATOM 560 CB LEU B 176 14.251 -4.377 -28.258 1.00 0.00 C
+ATOM 561 CG LEU B 176 15.387 -4.071 -27.274 1.00 0.00 C
+ATOM 562 CD1 LEU B 176 15.928 -5.374 -26.701 1.00 0.00 C
+ATOM 563 CD2 LEU B 176 16.482 -3.292 -27.989 1.00 0.00 C
+ATOM 564 H LEU B 176 12.445 -3.377 -26.769 1.00 0.00 H
+ATOM 565 HA LEU B 176 14.050 -2.333 -28.890 1.00 0.00 H
+ATOM 566 1HB LEU B 176 13.604 -5.121 -27.796 1.00 0.00 H
+ATOM 567 2HB LEU B 176 14.695 -4.816 -29.151 1.00 0.00 H
+ATOM 568 HG LEU B 176 15.001 -3.477 -26.445 1.00 0.00 H
+ATOM 569 1HD1 LEU B 176 16.736 -5.156 -26.002 1.00 0.00 H
+ATOM 570 2HD1 LEU B 176 15.129 -5.901 -26.179 1.00 0.00 H
+ATOM 571 3HD1 LEU B 176 16.307 -5.997 -27.510 1.00 0.00 H
+ATOM 572 1HD2 LEU B 176 17.289 -3.074 -27.289 1.00 0.00 H
+ATOM 573 2HD2 LEU B 176 16.869 -3.886 -28.817 1.00 0.00 H
+ATOM 574 3HD2 LEU B 176 16.072 -2.358 -28.373 1.00 0.00 H
+ATOM 575 N VAL B 177 11.484 -4.180 -29.782 1.00 0.00 N
+ATOM 576 CA VAL B 177 10.623 -4.517 -30.910 1.00 0.00 C
+ATOM 577 C VAL B 177 10.114 -3.262 -31.608 1.00 0.00 C
+ATOM 578 O VAL B 177 10.122 -3.178 -32.836 1.00 0.00 O
+ATOM 579 CB VAL B 177 9.424 -5.358 -30.434 1.00 0.00 C
+ATOM 580 CG1 VAL B 177 8.368 -5.446 -31.525 1.00 0.00 C
+ATOM 581 CG2 VAL B 177 9.895 -6.746 -30.026 1.00 0.00 C
+ATOM 582 H VAL B 177 11.208 -4.459 -28.851 1.00 0.00 H
+ATOM 583 HA VAL B 177 11.203 -5.104 -31.624 1.00 0.00 H
+ATOM 584 HB VAL B 177 8.962 -4.865 -29.579 1.00 0.00 H
+ATOM 585 1HG1 VAL B 177 7.528 -6.044 -31.172 1.00 0.00 H
+ATOM 586 2HG1 VAL B 177 8.020 -4.444 -31.776 1.00 0.00 H
+ATOM 587 3HG1 VAL B 177 8.798 -5.914 -32.411 1.00 0.00 H
+ATOM 588 1HG2 VAL B 177 9.042 -7.335 -29.690 1.00 0.00 H
+ATOM 589 2HG2 VAL B 177 10.362 -7.237 -30.880 1.00 0.00 H
+ATOM 590 3HG2 VAL B 177 10.619 -6.661 -29.215 1.00 0.00 H
+ATOM 591 N ALA B 178 9.672 -2.290 -30.819 1.00 0.00 N
+ATOM 592 CA ALA B 178 9.223 -1.011 -31.356 1.00 0.00 C
+ATOM 593 C ALA B 178 10.312 -0.352 -32.193 1.00 0.00 C
+ATOM 594 O ALA B 178 10.029 0.290 -33.204 1.00 0.00 O
+ATOM 595 CB ALA B 178 8.789 -0.086 -30.228 1.00 0.00 C
+ATOM 596 H ALA B 178 9.646 -2.441 -29.820 1.00 0.00 H
+ATOM 597 HA ALA B 178 8.369 -1.199 -32.007 1.00 0.00 H
+ATOM 598 1HB ALA B 178 8.457 0.865 -30.646 1.00 0.00 H
+ATOM 599 2HB ALA B 178 7.970 -0.545 -29.676 1.00 0.00 H
+ATOM 600 3HB ALA B 178 9.628 0.087 -29.557 1.00 0.00 H
+ATOM 601 N LEU B 179 11.559 -0.516 -31.766 1.00 0.00 N
+ATOM 602 CA LEU B 179 12.700 -0.014 -32.522 1.00 0.00 C
+ATOM 603 C LEU B 179 12.970 -0.877 -33.748 1.00 0.00 C
+ATOM 604 O LEU B 179 13.265 -0.363 -34.827 1.00 0.00 O
+ATOM 605 CB LEU B 179 13.950 0.026 -31.633 1.00 0.00 C
+ATOM 606 CG LEU B 179 13.903 1.018 -30.464 1.00 0.00 C
+ATOM 607 CD1 LEU B 179 15.091 0.775 -29.543 1.00 0.00 C
+ATOM 608 CD2 LEU B 179 13.911 2.440 -31.004 1.00 0.00 C
+ATOM 609 H LEU B 179 11.721 -1.000 -30.894 1.00 0.00 H
+ATOM 610 HA LEU B 179 12.462 0.992 -32.866 1.00 0.00 H
+ATOM 611 1HB LEU B 179 14.112 -0.968 -31.218 1.00 0.00 H
+ATOM 612 2HB LEU B 179 14.809 0.283 -32.252 1.00 0.00 H
+ATOM 613 HG LEU B 179 12.993 0.855 -29.884 1.00 0.00 H
+ATOM 614 1HD1 LEU B 179 15.058 1.480 -28.712 1.00 0.00 H
+ATOM 615 2HD1 LEU B 179 15.049 -0.243 -29.156 1.00 0.00 H
+ATOM 616 3HD1 LEU B 179 16.017 0.915 -30.100 1.00 0.00 H
+ATOM 617 1HD2 LEU B 179 13.877 3.145 -30.173 1.00 0.00 H
+ATOM 618 2HD2 LEU B 179 14.821 2.604 -31.582 1.00 0.00 H
+ATOM 619 3HD2 LEU B 179 13.042 2.591 -31.644 1.00 0.00 H
+ATOM 620 N LYS B 180 12.865 -2.189 -33.577 1.00 0.00 N
+ATOM 621 CA LYS B 180 13.065 -3.124 -34.678 1.00 0.00 C
+ATOM 622 C LYS B 180 12.086 -2.856 -35.815 1.00 0.00 C
+ATOM 623 O LYS B 180 12.439 -2.962 -36.989 1.00 0.00 O
+ATOM 624 CB LYS B 180 12.922 -4.566 -34.190 1.00 0.00 C
+ATOM 625 CG LYS B 180 14.107 -5.078 -33.383 1.00 0.00 C
+ATOM 626 CD LYS B 180 13.841 -6.472 -32.833 1.00 0.00 C
+ATOM 627 CE LYS B 180 15.037 -6.998 -32.053 1.00 0.00 C
+ATOM 628 NZ LYS B 180 14.791 -8.360 -31.508 1.00 0.00 N1+
+ATOM 629 H LYS B 180 12.640 -2.550 -32.662 1.00 0.00 H
+ATOM 630 HA LYS B 180 14.080 -2.999 -35.059 1.00 0.00 H
+ATOM 631 1HB LYS B 180 12.031 -4.652 -33.567 1.00 0.00 H
+ATOM 632 2HB LYS B 180 12.788 -5.229 -35.045 1.00 0.00 H
+ATOM 633 1HG LYS B 180 14.993 -5.111 -34.018 1.00 0.00 H
+ATOM 634 2HG LYS B 180 14.302 -4.401 -32.552 1.00 0.00 H
+ATOM 635 1HD LYS B 180 12.972 -6.444 -32.174 1.00 0.00 H
+ATOM 636 2HD LYS B 180 13.629 -7.153 -33.657 1.00 0.00 H
+ATOM 637 1HE LYS B 180 15.909 -7.033 -32.705 1.00 0.00 H
+ATOM 638 2HE LYS B 180 15.257 -6.324 -31.226 1.00 0.00 H
+ATOM 639 1HZ LYS B 180 15.606 -8.672 -30.999 1.00 0.00 H
+ATOM 640 2HZ LYS B 180 13.994 -8.336 -30.887 1.00 0.00 H
+ATOM 641 3HZ LYS B 180 14.605 -8.999 -32.268 1.00 0.00 H
+ATOM 642 N LEU B 181 10.855 -2.507 -35.457 1.00 0.00 N
+ATOM 643 CA LEU B 181 9.828 -2.201 -36.446 1.00 0.00 C
+ATOM 644 C LEU B 181 10.125 -0.890 -37.162 1.00 0.00 C
+ATOM 645 O LEU B 181 9.522 -0.582 -38.189 1.00 0.00 O
+ATOM 646 CB LEU B 181 8.451 -2.124 -35.774 1.00 0.00 C
+ATOM 647 CG LEU B 181 7.884 -3.455 -35.265 1.00 0.00 C
+ATOM 648 CD1 LEU B 181 6.684 -3.186 -34.368 1.00 0.00 C
+ATOM 649 CD2 LEU B 181 7.495 -4.327 -36.450 1.00 0.00 C
+ATOM 650 H LEU B 181 10.624 -2.452 -34.475 1.00 0.00 H
+ATOM 651 HA LEU B 181 9.813 -3.001 -37.186 1.00 0.00 H
+ATOM 652 1HB LEU B 181 8.517 -1.446 -34.924 1.00 0.00 H
+ATOM 653 2HB LEU B 181 7.739 -1.710 -36.488 1.00 0.00 H
+ATOM 654 HG LEU B 181 8.638 -3.969 -34.669 1.00 0.00 H
+ATOM 655 1HD1 LEU B 181 6.280 -4.132 -34.006 1.00 0.00 H
+ATOM 656 2HD1 LEU B 181 6.994 -2.577 -33.518 1.00 0.00 H
+ATOM 657 3HD1 LEU B 181 5.917 -2.658 -34.933 1.00 0.00 H
+ATOM 658 1HD2 LEU B 181 7.092 -5.274 -36.089 1.00 0.00 H
+ATOM 659 2HD2 LEU B 181 6.740 -3.815 -37.047 1.00 0.00 H
+ATOM 660 3HD2 LEU B 181 8.375 -4.518 -37.065 1.00 0.00 H
+ATOM 661 N ARG B 182 11.057 -0.120 -36.611 1.00 0.00 N
+ATOM 662 CA ARG B 182 11.369 1.203 -37.140 1.00 0.00 C
+ATOM 663 C ARG B 182 12.600 1.161 -38.036 1.00 0.00 C
+ATOM 664 O ARG B 182 13.039 2.190 -38.553 1.00 0.00 O
+ATOM 665 CB ARG B 182 11.603 2.191 -36.007 1.00 0.00 C
+ATOM 666 CG ARG B 182 11.600 3.653 -36.424 1.00 0.00 C
+ATOM 667 CD ARG B 182 11.693 4.559 -35.250 1.00 0.00 C
+ATOM 668 NE ARG B 182 10.579 4.374 -34.334 1.00 0.00 N
+ATOM 669 CZ ARG B 182 10.579 4.758 -33.043 1.00 0.00 C
+ATOM 670 NH1 ARG B 182 11.638 5.345 -32.531 1.00 0.00 N1+
+ATOM 671 NH2 ARG B 182 9.514 4.545 -32.290 1.00 0.00 N
+ATOM 672 H ARG B 182 11.563 -0.459 -35.806 1.00 0.00 H
+ATOM 673 HA ARG B 182 10.532 1.535 -37.756 1.00 0.00 H
+ATOM 674 1HB ARG B 182 10.833 2.063 -35.248 1.00 0.00 H
+ATOM 675 2HB ARG B 182 12.565 1.984 -35.537 1.00 0.00 H
+ATOM 676 1HG ARG B 182 12.453 3.848 -37.075 1.00 0.00 H
+ATOM 677 2HG ARG B 182 10.676 3.878 -36.959 1.00 0.00 H
+ATOM 678 1HD ARG B 182 12.616 4.359 -34.708 1.00 0.00 H
+ATOM 679 2HD ARG B 182 11.687 5.595 -35.589 1.00 0.00 H
+ATOM 680 HE ARG B 182 9.745 3.926 -34.691 1.00 0.00 H
+ATOM 681 1HH1 ARG B 182 12.452 5.508 -33.107 1.00 0.00 H
+ATOM 682 2HH1 ARG B 182 11.638 5.633 -31.564 1.00 0.00 H
+ATOM 683 1HH2 ARG B 182 8.699 4.094 -32.683 1.00 0.00 H
+ATOM 684 2HH2 ARG B 182 9.514 4.833 -31.323 1.00 0.00 H
+ATOM 685 N GLY B 183 13.154 -0.033 -38.217 1.00 0.00 N
+ATOM 686 CA GLY B 183 14.302 -0.219 -39.097 1.00 0.00 C
+ATOM 687 C GLY B 183 15.601 0.151 -38.392 1.00 0.00 C
+ATOM 688 O GLY B 183 16.583 0.525 -39.035 1.00 0.00 O
+ATOM 689 H GLY B 183 12.770 -0.832 -37.734 1.00 0.00 H
+ATOM 690 1HA GLY B 183 14.344 -1.258 -39.424 1.00 0.00 H
+ATOM 691 2HA GLY B 183 14.180 0.394 -39.989 1.00 0.00 H
+ATOM 692 N VAL B 184 15.601 0.045 -37.068 1.00 0.00 N
+ATOM 693 CA VAL B 184 16.790 0.335 -36.276 1.00 0.00 C
+ATOM 694 C VAL B 184 17.796 -0.807 -36.353 1.00 0.00 C
+ATOM 695 O VAL B 184 17.430 -1.977 -36.241 1.00 0.00 O
+ATOM 696 CB VAL B 184 16.405 0.579 -34.805 1.00 0.00 C
+ATOM 697 CG1 VAL B 184 17.652 0.763 -33.952 1.00 0.00 C
+ATOM 698 CG2 VAL B 184 15.497 1.795 -34.702 1.00 0.00 C
+ATOM 699 H VAL B 184 14.756 -0.244 -36.597 1.00 0.00 H
+ATOM 700 HA VAL B 184 17.257 1.239 -36.670 1.00 0.00 H
+ATOM 701 HB VAL B 184 15.883 -0.299 -34.425 1.00 0.00 H
+ATOM 702 1HG1 VAL B 184 17.362 0.934 -32.915 1.00 0.00 H
+ATOM 703 2HG1 VAL B 184 18.269 -0.133 -34.012 1.00 0.00 H
+ATOM 704 3HG1 VAL B 184 18.218 1.620 -34.316 1.00 0.00 H
+ATOM 705 1HG2 VAL B 184 15.229 1.961 -33.659 1.00 0.00 H
+ATOM 706 2HG2 VAL B 184 16.018 2.672 -35.087 1.00 0.00 H
+ATOM 707 3HG2 VAL B 184 14.593 1.624 -35.286 1.00 0.00 H
+ATOM 708 N SER B 185 19.064 -0.460 -36.544 1.00 0.00 N
+ATOM 709 CA SER B 185 20.105 -1.454 -36.774 1.00 0.00 C
+ATOM 710 C SER B 185 20.384 -2.261 -35.511 1.00 0.00 C
+ATOM 711 O SER B 185 20.028 -1.847 -34.408 1.00 0.00 O
+ATOM 712 CB SER B 185 21.378 -0.779 -37.245 1.00 0.00 C
+ATOM 713 OG SER B 185 21.960 -0.030 -36.214 1.00 0.00 O
+ATOM 714 H SER B 185 19.314 0.519 -36.530 1.00 0.00 H
+ATOM 715 HA SER B 185 19.761 -2.141 -37.550 1.00 0.00 H
+ATOM 716 1HB SER B 185 22.083 -1.533 -37.593 1.00 0.00 H
+ATOM 717 2HB SER B 185 21.153 -0.127 -38.088 1.00 0.00 H
+ATOM 718 HG SER B 185 21.462 0.790 -36.168 1.00 0.00 H
+ATOM 719 N CYS B 186 21.023 -3.413 -35.681 1.00 0.00 N
+ATOM 720 CA CYS B 186 21.319 -4.297 -34.560 1.00 0.00 C
+ATOM 721 C CYS B 186 22.193 -3.600 -33.525 1.00 0.00 C
+ATOM 722 O CYS B 186 21.947 -3.698 -32.322 1.00 0.00 O
+ATOM 723 CB CYS B 186 22.025 -5.564 -35.045 1.00 0.00 C
+ATOM 724 SG CYS B 186 22.245 -6.823 -33.765 1.00 0.00 S
+ATOM 725 H CYS B 186 21.311 -3.683 -36.611 1.00 0.00 H
+ATOM 726 HA CYS B 186 20.379 -4.582 -34.087 1.00 0.00 H
+ATOM 727 1HB CYS B 186 21.454 -6.009 -35.860 1.00 0.00 H
+ATOM 728 2HB CYS B 186 23.008 -5.305 -35.437 1.00 0.00 H
+ATOM 729 N GLU B 187 23.214 -2.895 -33.998 1.00 0.00 N
+ATOM 730 CA GLU B 187 24.160 -2.227 -33.113 1.00 0.00 C
+ATOM 731 C GLU B 187 23.472 -1.150 -32.284 1.00 0.00 C
+ATOM 732 O GLU B 187 23.772 -0.977 -31.102 1.00 0.00 O
+ATOM 733 CB GLU B 187 25.303 -1.609 -33.922 1.00 0.00 C
+ATOM 734 CG GLU B 187 26.190 -2.623 -34.632 1.00 0.00 C
+ATOM 735 CD GLU B 187 25.577 -3.147 -35.901 1.00 0.00 C
+ATOM 736 OE1 GLU B 187 24.519 -2.690 -36.261 1.00 0.00 O
+ATOM 737 OE2 GLU B 187 26.168 -4.007 -36.510 1.00 0.00 O1-
+ATOM 738 H GLU B 187 23.339 -2.820 -34.998 1.00 0.00 H
+ATOM 739 HA GLU B 187 24.577 -2.967 -32.429 1.00 0.00 H
+ATOM 740 1HB GLU B 187 24.894 -0.936 -34.676 1.00 0.00 H
+ATOM 741 2HB GLU B 187 25.937 -1.016 -33.263 1.00 0.00 H
+ATOM 742 1HG GLU B 187 27.143 -2.152 -34.871 1.00 0.00 H
+ATOM 743 2HG GLU B 187 26.386 -3.454 -33.957 1.00 0.00 H
+ATOM 744 N GLU B 188 22.550 -0.428 -32.910 1.00 0.00 N
+ATOM 745 CA GLU B 188 21.757 0.576 -32.210 1.00 0.00 C
+ATOM 746 C GLU B 188 20.848 -0.066 -31.171 1.00 0.00 C
+ATOM 747 O GLU B 188 20.666 0.467 -30.077 1.00 0.00 O
+ATOM 748 CB GLU B 188 20.920 1.383 -33.205 1.00 0.00 C
+ATOM 749 CG GLU B 188 21.722 2.351 -34.063 1.00 0.00 C
+ATOM 750 CD GLU B 188 20.916 2.947 -35.183 1.00 0.00 C
+ATOM 751 OE1 GLU B 188 20.350 2.200 -35.945 1.00 0.00 O
+ATOM 752 OE2 GLU B 188 20.866 4.151 -35.277 1.00 0.00 O1-
+ATOM 753 H GLU B 188 22.393 -0.577 -33.897 1.00 0.00 H
+ATOM 754 HA GLU B 188 22.436 1.255 -31.694 1.00 0.00 H
+ATOM 755 1HB GLU B 188 20.392 0.702 -33.873 1.00 0.00 H
+ATOM 756 2HB GLU B 188 20.168 1.959 -32.665 1.00 0.00 H
+ATOM 757 1HG GLU B 188 22.096 3.157 -33.431 1.00 0.00 H
+ATOM 758 2HG GLU B 188 22.581 1.825 -34.479 1.00 0.00 H
+ATOM 759 N LEU B 189 20.279 -1.215 -31.520 1.00 0.00 N
+ATOM 760 CA LEU B 189 19.418 -1.953 -30.604 1.00 0.00 C
+ATOM 761 C LEU B 189 20.199 -2.453 -29.395 1.00 0.00 C
+ATOM 762 O LEU B 189 19.712 -2.405 -28.265 1.00 0.00 O
+ATOM 763 CB LEU B 189 18.768 -3.139 -31.327 1.00 0.00 C
+ATOM 764 CG LEU B 189 17.733 -2.778 -32.400 1.00 0.00 C
+ATOM 765 CD1 LEU B 189 17.422 -4.009 -33.241 1.00 0.00 C
+ATOM 766 CD2 LEU B 189 16.476 -2.239 -31.733 1.00 0.00 C
+ATOM 767 H LEU B 189 20.447 -1.587 -32.443 1.00 0.00 H
+ATOM 768 HA LEU B 189 18.635 -1.283 -30.249 1.00 0.00 H
+ATOM 769 1HB LEU B 189 19.551 -3.725 -31.805 1.00 0.00 H
+ATOM 770 2HB LEU B 189 18.272 -3.768 -30.587 1.00 0.00 H
+ATOM 771 HG LEU B 189 18.147 -2.017 -33.063 1.00 0.00 H
+ATOM 772 1HD1 LEU B 189 16.687 -3.752 -34.004 1.00 0.00 H
+ATOM 773 2HD1 LEU B 189 18.335 -4.361 -33.722 1.00 0.00 H
+ATOM 774 3HD1 LEU B 189 17.021 -4.794 -32.601 1.00 0.00 H
+ATOM 775 1HD2 LEU B 189 15.741 -1.982 -32.497 1.00 0.00 H
+ATOM 776 2HD2 LEU B 189 16.061 -2.999 -31.072 1.00 0.00 H
+ATOM 777 3HD2 LEU B 189 16.724 -1.350 -31.154 1.00 0.00 H
+ATOM 778 N GLN B 190 21.414 -2.932 -29.640 1.00 0.00 N
+ATOM 779 CA GLN B 190 22.284 -3.396 -28.566 1.00 0.00 C
+ATOM 780 C GLN B 190 22.615 -2.268 -27.598 1.00 0.00 C
+ATOM 781 O GLN B 190 22.551 -2.443 -26.381 1.00 0.00 O
+ATOM 782 CB GLN B 190 23.575 -3.986 -29.141 1.00 0.00 C
+ATOM 783 CG GLN B 190 24.510 -4.573 -28.097 1.00 0.00 C
+ATOM 784 CD GLN B 190 25.808 -5.075 -28.699 1.00 0.00 C
+ATOM 785 NE2 GLN B 190 26.900 -4.922 -27.959 1.00 0.00 N
+ATOM 786 OE1 GLN B 190 25.830 -5.595 -29.818 1.00 0.00 O
+ATOM 787 H GLN B 190 21.743 -2.976 -30.594 1.00 0.00 H
+ATOM 788 HA GLN B 190 21.767 -4.181 -28.016 1.00 0.00 H
+ATOM 789 1HB GLN B 190 23.330 -4.773 -29.853 1.00 0.00 H
+ATOM 790 2HB GLN B 190 24.120 -3.212 -29.682 1.00 0.00 H
+ATOM 791 1HG GLN B 190 24.748 -3.803 -27.363 1.00 0.00 H
+ATOM 792 2HG GLN B 190 24.012 -5.412 -27.610 1.00 0.00 H
+ATOM 793 1HE2 GLN B 190 27.787 -5.234 -28.304 1.00 0.00 H
+ATOM 794 2HE2 GLN B 190 26.838 -4.495 -27.057 1.00 0.00 H
+ATOM 795 N LYS B 191 22.966 -1.109 -28.144 1.00 0.00 N
+ATOM 796 CA LYS B 191 23.252 0.067 -27.331 1.00 0.00 C
+ATOM 797 C LYS B 191 22.057 0.443 -26.465 1.00 0.00 C
+ATOM 798 O LYS B 191 22.204 0.731 -25.277 1.00 0.00 O
+ATOM 799 CB LYS B 191 23.651 1.248 -28.218 1.00 0.00 C
+ATOM 800 CG LYS B 191 24.031 2.509 -27.453 1.00 0.00 C
+ATOM 801 CD LYS B 191 24.507 3.604 -28.396 1.00 0.00 C
+ATOM 802 CE LYS B 191 25.054 4.798 -27.627 1.00 0.00 C
+ATOM 803 NZ LYS B 191 23.980 5.536 -26.909 1.00 0.00 N1+
+ATOM 804 H LYS B 191 23.036 -1.040 -29.149 1.00 0.00 H
+ATOM 805 HA LYS B 191 24.086 -0.167 -26.666 1.00 0.00 H
+ATOM 806 1HB LYS B 191 24.500 0.965 -28.841 1.00 0.00 H
+ATOM 807 2HB LYS B 191 22.825 1.497 -28.884 1.00 0.00 H
+ATOM 808 1HG LYS B 191 23.167 2.871 -26.896 1.00 0.00 H
+ATOM 809 2HG LYS B 191 24.827 2.279 -26.746 1.00 0.00 H
+ATOM 810 1HD LYS B 191 25.290 3.211 -29.046 1.00 0.00 H
+ATOM 811 2HD LYS B 191 23.675 3.935 -29.018 1.00 0.00 H
+ATOM 812 1HE LYS B 191 25.791 4.456 -26.902 1.00 0.00 H
+ATOM 813 2HE LYS B 191 25.546 5.481 -28.319 1.00 0.00 H
+ATOM 814 1HZ LYS B 191 24.383 6.319 -26.413 1.00 0.00 H
+ATOM 815 2HZ LYS B 191 23.299 5.874 -27.575 1.00 0.00 H
+ATOM 816 3HZ LYS B 191 23.528 4.918 -26.250 1.00 0.00 H
+ATOM 817 N PHE B 192 20.872 0.436 -27.066 1.00 0.00 N
+ATOM 818 CA PHE B 192 19.642 0.721 -26.338 1.00 0.00 C
+ATOM 819 C PHE B 192 19.440 -0.261 -25.191 1.00 0.00 C
+ATOM 820 O PHE B 192 19.153 0.138 -24.063 1.00 0.00 O
+ATOM 821 CB PHE B 192 18.439 0.666 -27.281 1.00 0.00 C
+ATOM 822 CG PHE B 192 17.130 0.978 -26.613 1.00 0.00 C
+ATOM 823 CD1 PHE B 192 16.716 2.291 -26.446 1.00 0.00 C
+ATOM 824 CD2 PHE B 192 16.311 -0.040 -26.149 1.00 0.00 C
+ATOM 825 CE1 PHE B 192 15.512 2.580 -25.831 1.00 0.00 C
+ATOM 826 CE2 PHE B 192 15.107 0.245 -25.535 1.00 0.00 C
+ATOM 827 CZ PHE B 192 14.708 1.557 -25.376 1.00 0.00 C
+ATOM 828 H PHE B 192 20.823 0.228 -28.054 1.00 0.00 H
+ATOM 829 HA PHE B 192 19.713 1.725 -25.919 1.00 0.00 H
+ATOM 830 1HB PHE B 192 18.582 1.374 -28.096 1.00 0.00 H
+ATOM 831 2HB PHE B 192 18.367 -0.328 -27.721 1.00 0.00 H
+ATOM 832 HD1 PHE B 192 17.352 3.100 -26.807 1.00 0.00 H
+ATOM 833 HD2 PHE B 192 16.626 -1.076 -26.274 1.00 0.00 H
+ATOM 834 HE1 PHE B 192 15.199 3.616 -25.707 1.00 0.00 H
+ATOM 835 HE2 PHE B 192 14.472 -0.564 -25.176 1.00 0.00 H
+ATOM 836 HZ PHE B 192 13.759 1.784 -24.891 1.00 0.00 H
+ATOM 837 N ALA B 193 19.593 -1.547 -25.487 1.00 0.00 N
+ATOM 838 CA ALA B 193 19.414 -2.590 -24.485 1.00 0.00 C
+ATOM 839 C ALA B 193 20.390 -2.415 -23.327 1.00 0.00 C
+ATOM 840 O ALA B 193 20.020 -2.567 -22.163 1.00 0.00 O
+ATOM 841 CB ALA B 193 19.582 -3.965 -25.115 1.00 0.00 C
+ATOM 842 H ALA B 193 19.840 -1.809 -26.431 1.00 0.00 H
+ATOM 843 HA ALA B 193 18.400 -2.522 -24.092 1.00 0.00 H
+ATOM 844 1HB ALA B 193 19.444 -4.733 -24.354 1.00 0.00 H
+ATOM 845 2HB ALA B 193 18.839 -4.097 -25.902 1.00 0.00 H
+ATOM 846 3HB ALA B 193 20.580 -4.050 -25.540 1.00 0.00 H
+ATOM 847 N GLU B 194 21.637 -2.097 -23.656 1.00 0.00 N
+ATOM 848 CA GLU B 194 22.672 -1.913 -22.644 1.00 0.00 C
+ATOM 849 C GLU B 194 22.335 -0.753 -21.716 1.00 0.00 C
+ATOM 850 O GLU B 194 22.510 -0.847 -20.501 1.00 0.00 O
+ATOM 851 CB GLU B 194 24.029 -1.670 -23.307 1.00 0.00 C
+ATOM 852 CG GLU B 194 24.633 -2.899 -23.972 1.00 0.00 C
+ATOM 853 CD GLU B 194 25.873 -2.586 -24.762 1.00 0.00 C
+ATOM 854 OE1 GLU B 194 26.239 -1.438 -24.828 1.00 0.00 O
+ATOM 855 OE2 GLU B 194 26.456 -3.498 -25.301 1.00 0.00 O1-
+ATOM 856 H GLU B 194 21.874 -1.977 -24.630 1.00 0.00 H
+ATOM 857 HA GLU B 194 22.734 -2.821 -22.044 1.00 0.00 H
+ATOM 858 1HB GLU B 194 23.930 -0.894 -24.066 1.00 0.00 H
+ATOM 859 2HB GLU B 194 24.739 -1.310 -22.562 1.00 0.00 H
+ATOM 860 1HG GLU B 194 24.880 -3.631 -23.204 1.00 0.00 H
+ATOM 861 2HG GLU B 194 23.890 -3.343 -24.633 1.00 0.00 H
+ATOM 862 N GLU B 195 21.853 0.341 -22.295 1.00 0.00 N
+ATOM 863 CA GLU B 195 21.480 1.518 -21.519 1.00 0.00 C
+ATOM 864 C GLU B 195 20.297 1.224 -20.607 1.00 0.00 C
+ATOM 865 O GLU B 195 20.288 1.616 -19.440 1.00 0.00 O
+ATOM 866 CB GLU B 195 21.142 2.686 -22.448 1.00 0.00 C
+ATOM 867 CG GLU B 195 22.343 3.285 -23.167 1.00 0.00 C
+ATOM 868 CD GLU B 195 21.957 4.324 -24.183 1.00 0.00 C
+ATOM 869 OE1 GLU B 195 20.786 4.480 -24.430 1.00 0.00 O
+ATOM 870 OE2 GLU B 195 22.836 4.963 -24.712 1.00 0.00 O1-
+ATOM 871 H GLU B 195 21.741 0.358 -23.299 1.00 0.00 H
+ATOM 872 HA GLU B 195 22.325 1.799 -20.890 1.00 0.00 H
+ATOM 873 1HB GLU B 195 20.431 2.354 -23.205 1.00 0.00 H
+ATOM 874 2HB GLU B 195 20.665 3.480 -21.875 1.00 0.00 H
+ATOM 875 1HG GLU B 195 23.004 3.741 -22.430 1.00 0.00 H
+ATOM 876 2HG GLU B 195 22.893 2.486 -23.662 1.00 0.00 H
+ATOM 877 N PHE B 196 19.300 0.532 -21.145 1.00 0.00 N
+ATOM 878 CA PHE B 196 18.113 0.173 -20.375 1.00 0.00 C
+ATOM 879 C PHE B 196 18.479 -0.672 -19.162 1.00 0.00 C
+ATOM 880 O PHE B 196 18.022 -0.408 -18.049 1.00 0.00 O
+ATOM 881 CB PHE B 196 17.117 -0.589 -21.251 1.00 0.00 C
+ATOM 882 CG PHE B 196 15.866 -1.002 -20.529 1.00 0.00 C
+ATOM 883 CD1 PHE B 196 14.738 -0.195 -20.550 1.00 0.00 C
+ATOM 884 CD2 PHE B 196 15.815 -2.196 -19.827 1.00 0.00 C
+ATOM 885 CE1 PHE B 196 13.587 -0.573 -19.886 1.00 0.00 C
+ATOM 886 CE2 PHE B 196 14.665 -2.577 -19.163 1.00 0.00 C
+ATOM 887 CZ PHE B 196 13.550 -1.764 -19.193 1.00 0.00 C
+ATOM 888 H PHE B 196 19.363 0.247 -22.111 1.00 0.00 H
+ATOM 889 HA PHE B 196 17.637 1.089 -20.027 1.00 0.00 H
+ATOM 890 1HB PHE B 196 16.831 0.031 -22.100 1.00 0.00 H
+ATOM 891 2HB PHE B 196 17.593 -1.486 -21.647 1.00 0.00 H
+ATOM 892 HD1 PHE B 196 14.767 0.746 -21.099 1.00 0.00 H
+ATOM 893 HD2 PHE B 196 16.696 -2.838 -19.803 1.00 0.00 H
+ATOM 894 HE1 PHE B 196 12.708 0.070 -19.910 1.00 0.00 H
+ATOM 895 HE2 PHE B 196 14.638 -3.519 -18.615 1.00 0.00 H
+ATOM 896 HZ PHE B 196 12.644 -2.063 -18.668 1.00 0.00 H
+ATOM 897 N ILE B 197 19.307 -1.687 -19.381 1.00 0.00 N
+ATOM 898 CA ILE B 197 19.676 -2.617 -18.320 1.00 0.00 C
+ATOM 899 C ILE B 197 20.408 -1.903 -17.192 1.00 0.00 C
+ATOM 900 O ILE B 197 20.125 -2.127 -16.016 1.00 0.00 O
+ATOM 901 CB ILE B 197 20.558 -3.753 -18.868 1.00 0.00 C
+ATOM 902 CG1 ILE B 197 19.757 -4.636 -19.828 1.00 0.00 C
+ATOM 903 CG2 ILE B 197 21.127 -4.582 -17.727 1.00 0.00 C
+ATOM 904 CD1 ILE B 197 20.612 -5.553 -20.672 1.00 0.00 C
+ATOM 905 H ILE B 197 19.690 -1.819 -20.306 1.00 0.00 H
+ATOM 906 HA ILE B 197 18.766 -3.055 -17.913 1.00 0.00 H
+ATOM 907 HB ILE B 197 21.381 -3.329 -19.443 1.00 0.00 H
+ATOM 908 1HG1 ILE B 197 19.057 -5.249 -19.260 1.00 0.00 H
+ATOM 909 2HG1 ILE B 197 19.170 -4.007 -20.498 1.00 0.00 H
+ATOM 910 1HG2 ILE B 197 21.748 -5.381 -18.132 1.00 0.00 H
+ATOM 911 2HG2 ILE B 197 21.731 -3.945 -17.081 1.00 0.00 H
+ATOM 912 3HG2 ILE B 197 20.311 -5.014 -17.149 1.00 0.00 H
+ATOM 913 1HD1 ILE B 197 19.973 -6.147 -21.327 1.00 0.00 H
+ATOM 914 2HD1 ILE B 197 21.298 -4.958 -21.276 1.00 0.00 H
+ATOM 915 3HD1 ILE B 197 21.182 -6.217 -20.024 1.00 0.00 H
+ATOM 916 N GLU B 198 21.352 -1.042 -17.558 1.00 0.00 N
+ATOM 917 CA GLU B 198 22.107 -0.271 -16.577 1.00 0.00 C
+ATOM 918 C GLU B 198 21.185 0.602 -15.735 1.00 0.00 C
+ATOM 919 O GLU B 198 21.317 0.661 -14.513 1.00 0.00 O
+ATOM 920 CB GLU B 198 23.154 0.601 -17.275 1.00 0.00 C
+ATOM 921 CG GLU B 198 24.002 1.441 -16.331 1.00 0.00 C
+ATOM 922 CD GLU B 198 25.059 2.236 -17.046 1.00 0.00 C
+ATOM 923 OE1 GLU B 198 25.192 2.078 -18.236 1.00 0.00 O
+ATOM 924 OE2 GLU B 198 25.735 3.003 -16.401 1.00 0.00 O1-
+ATOM 925 H GLU B 198 21.552 -0.919 -18.541 1.00 0.00 H
+ATOM 926 HA GLU B 198 22.620 -0.964 -15.911 1.00 0.00 H
+ATOM 927 1HB GLU B 198 23.826 -0.032 -17.855 1.00 0.00 H
+ATOM 928 2HB GLU B 198 22.658 1.277 -17.971 1.00 0.00 H
+ATOM 929 1HG GLU B 198 23.352 2.128 -15.789 1.00 0.00 H
+ATOM 930 2HG GLU B 198 24.478 0.784 -15.604 1.00 0.00 H
+ATOM 931 N GLU B 199 20.251 1.278 -16.395 1.00 0.00 N
+ATOM 932 CA GLU B 199 19.288 2.129 -15.706 1.00 0.00 C
+ATOM 933 C GLU B 199 18.408 1.315 -14.766 1.00 0.00 C
+ATOM 934 O GLU B 199 18.103 1.750 -13.656 1.00 0.00 O
+ATOM 935 CB GLU B 199 18.417 2.876 -16.718 1.00 0.00 C
+ATOM 936 CG GLU B 199 19.141 3.977 -17.479 1.00 0.00 C
+ATOM 937 CD GLU B 199 18.292 4.603 -18.550 1.00 0.00 C
+ATOM 938 OE1 GLU B 199 17.207 4.125 -18.778 1.00 0.00 O
+ATOM 939 OE2 GLU B 199 18.730 5.562 -19.143 1.00 0.00 O1-
+ATOM 940 H GLU B 199 20.205 1.199 -17.402 1.00 0.00 H
+ATOM 941 HA GLU B 199 19.837 2.854 -15.105 1.00 0.00 H
+ATOM 942 1HB GLU B 199 18.019 2.170 -17.447 1.00 0.00 H
+ATOM 943 2HB GLU B 199 17.568 3.328 -16.203 1.00 0.00 H
+ATOM 944 1HG GLU B 199 19.446 4.751 -16.775 1.00 0.00 H
+ATOM 945 2HG GLU B 199 20.040 3.561 -17.931 1.00 0.00 H
+ATOM 946 N ALA B 200 18.003 0.134 -15.217 1.00 0.00 N
+ATOM 947 CA ALA B 200 17.182 -0.757 -14.406 1.00 0.00 C
+ATOM 948 C ALA B 200 17.920 -1.191 -13.145 1.00 0.00 C
+ATOM 949 O ALA B 200 17.316 -1.348 -12.084 1.00 0.00 O
+ATOM 950 CB ALA B 200 16.759 -1.973 -15.217 1.00 0.00 C
+ATOM 951 H ALA B 200 18.270 -0.156 -16.147 1.00 0.00 H
+ATOM 952 HA ALA B 200 16.281 -0.221 -14.109 1.00 0.00 H
+ATOM 953 1HB ALA B 200 16.146 -2.628 -14.597 1.00 0.00 H
+ATOM 954 2HB ALA B 200 16.182 -1.650 -16.084 1.00 0.00 H
+ATOM 955 3HB ALA B 200 17.643 -2.513 -15.550 1.00 0.00 H
+ATOM 956 N ARG B 201 19.229 -1.381 -13.269 1.00 0.00 N
+ATOM 957 CA ARG B 201 20.054 -1.787 -12.137 1.00 0.00 C
+ATOM 958 C ARG B 201 20.272 -0.631 -11.171 1.00 0.00 C
+ATOM 959 O ARG B 201 20.299 -0.821 -9.956 1.00 0.00 O
+ATOM 960 CB ARG B 201 21.403 -2.304 -12.616 1.00 0.00 C
+ATOM 961 CG ARG B 201 21.353 -3.634 -13.352 1.00 0.00 C
+ATOM 962 CD ARG B 201 22.633 -3.925 -14.048 1.00 0.00 C
+ATOM 963 NE ARG B 201 23.714 -4.179 -13.109 1.00 0.00 N
+ATOM 964 CZ ARG B 201 25.024 -4.153 -13.426 1.00 0.00 C
+ATOM 965 NH1 ARG B 201 25.397 -3.885 -14.657 1.00 0.00 N1+
+ATOM 966 NH2 ARG B 201 25.933 -4.399 -12.498 1.00 0.00 N
+ATOM 967 H ARG B 201 19.663 -1.241 -14.170 1.00 0.00 H
+ATOM 968 HA ARG B 201 19.538 -2.585 -11.602 1.00 0.00 H
+ATOM 969 1HB ARG B 201 21.855 -1.574 -13.285 1.00 0.00 H
+ATOM 970 2HB ARG B 201 22.070 -2.424 -11.763 1.00 0.00 H
+ATOM 971 1HG ARG B 201 21.159 -4.437 -12.641 1.00 0.00 H
+ATOM 972 2HG ARG B 201 20.556 -3.608 -14.097 1.00 0.00 H
+ATOM 973 1HD ARG B 201 22.513 -4.806 -14.676 1.00 0.00 H
+ATOM 974 2HD ARG B 201 22.912 -3.073 -14.667 1.00 0.00 H
+ATOM 975 HE ARG B 201 23.466 -4.389 -12.152 1.00 0.00 H
+ATOM 976 1HH1 ARG B 201 24.702 -3.697 -15.366 1.00 0.00 H
+ATOM 977 2HH1 ARG B 201 26.378 -3.866 -14.895 1.00 0.00 H
+ATOM 978 1HH2 ARG B 201 25.645 -4.606 -11.551 1.00 0.00 H
+ATOM 979 2HH2 ARG B 201 26.913 -4.380 -12.735 1.00 0.00 H
+ATOM 980 N ARG B 202 20.426 0.570 -11.718 1.00 0.00 N
+ATOM 981 CA ARG B 202 20.640 1.761 -10.905 1.00 0.00 C
+ATOM 982 C ARG B 202 19.350 2.204 -10.227 1.00 0.00 C
+ATOM 983 O ARG B 202 19.370 2.729 -9.115 1.00 0.00 O
+ATOM 984 CB ARG B 202 21.179 2.901 -11.757 1.00 0.00 C
+ATOM 985 CG ARG B 202 22.613 2.723 -12.229 1.00 0.00 C
+ATOM 986 CD ARG B 202 23.084 3.896 -13.010 1.00 0.00 C
+ATOM 987 NE ARG B 202 24.413 3.684 -13.560 1.00 0.00 N
+ATOM 988 CZ ARG B 202 25.560 3.837 -12.870 1.00 0.00 C
+ATOM 989 NH1 ARG B 202 25.524 4.203 -11.608 1.00 0.00 N1+
+ATOM 990 NH2 ARG B 202 26.721 3.619 -13.462 1.00 0.00 N
+ATOM 991 H ARG B 202 20.394 0.660 -12.724 1.00 0.00 H
+ATOM 992 HA ARG B 202 21.374 1.526 -10.134 1.00 0.00 H
+ATOM 993 1HB ARG B 202 20.554 3.022 -12.640 1.00 0.00 H
+ATOM 994 2HB ARG B 202 21.131 3.832 -11.192 1.00 0.00 H
+ATOM 995 1HG ARG B 202 23.268 2.601 -11.366 1.00 0.00 H
+ATOM 996 2HG ARG B 202 22.680 1.839 -12.865 1.00 0.00 H
+ATOM 997 1HD ARG B 202 22.398 4.082 -13.836 1.00 0.00 H
+ATOM 998 2HD ARG B 202 23.118 4.773 -12.363 1.00 0.00 H
+ATOM 999 HE ARG B 202 24.481 3.401 -14.529 1.00 0.00 H
+ATOM 1000 1HH1 ARG B 202 24.636 4.369 -11.155 1.00 0.00 H
+ATOM 1001 2HH1 ARG B 202 26.383 4.317 -11.091 1.00 0.00 H
+ATOM 1002 1HH2 ARG B 202 26.749 3.338 -14.433 1.00 0.00 H
+ATOM 1003 2HH2 ARG B 202 27.580 3.734 -12.945 1.00 0.00 H
+ATOM 1004 N LYS B 203 18.227 1.989 -10.905 1.00 0.00 N
+ATOM 1005 CA LYS B 203 16.926 2.373 -10.373 1.00 0.00 C
+ATOM 1006 C LYS B 203 16.515 1.470 -9.217 1.00 0.00 C
+ATOM 1007 O LYS B 203 16.965 1.659 -8.119 1.00 0.00 O
+ATOM 1008 CB LYS B 203 15.865 2.332 -11.474 1.00 0.00 C
+ATOM 1009 CG LYS B 203 14.476 2.768 -11.026 1.00 0.00 C
+ATOM 1010 CD LYS B 203 13.495 2.772 -12.189 1.00 0.00 C
+ATOM 1011 CE LYS B 203 12.069 3.001 -11.711 1.00 0.00 C
+ATOM 1012 NZ LYS B 203 11.089 2.924 -12.828 1.00 0.00 N1+
+ATOM 1013 OXT LYS B 203 15.743 0.571 -9.402 1.00 0.00 O1-
+ATOM 1014 H LYS B 203 18.277 1.548 -11.813 1.00 0.00 H
+ATOM 1015 HA LYS B 203 16.993 3.393 -9.992 1.00 0.00 H
+ATOM 1016 1HB LYS B 203 16.169 2.980 -12.297 1.00 0.00 H
+ATOM 1017 2HB LYS B 203 15.786 1.319 -11.868 1.00 0.00 H
+ATOM 1018 1HG LYS B 203 14.111 2.086 -10.257 1.00 0.00 H
+ATOM 1019 2HG LYS B 203 14.528 3.771 -10.603 1.00 0.00 H
+ATOM 1020 1HD LYS B 203 13.766 3.561 -12.891 1.00 0.00 H
+ATOM 1021 2HD LYS B 203 13.544 1.815 -12.709 1.00 0.00 H
+ATOM 1022 1HE LYS B 203 11.811 2.251 -10.965 1.00 0.00 H
+ATOM 1023 2HE LYS B 203 11.995 3.984 -11.247 1.00 0.00 H
+ATOM 1024 1HZ LYS B 203 10.157 3.082 -12.471 1.00 0.00 H
+ATOM 1025 2HZ LYS B 203 11.308 3.629 -13.518 1.00 0.00 H
+ATOM 1026 3HZ LYS B 203 11.135 2.010 -13.255 1.00 0.00 H
+TER
+END
diff --git a/8_Filter/data/pose.pdb b/8_Filter/data/pose.pdb
new file mode 100644
index 0000000..57dc68a
--- /dev/null
+++ b/8_Filter/data/pose.pdb
@@ -0,0 +1,667 @@
+HEADER 25-JUL-20 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 25-JUL-20
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2019.50+release.91b7a94
+SSBOND CYS A 18 CYS A 20 2.17
+ATOM 1 N THR A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA THR A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C THR A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O THR A 1 1.703 2.215 -0.889 1.00 0.00 O
+ATOM 5 CB THR A 1 2.012 -0.770 -1.213 1.00 0.00 C
+ATOM 6 OG1 THR A 1 1.586 -2.137 -1.150 1.00 0.00 O
+ATOM 7 CG2 THR A 1 3.532 -0.717 -1.229 1.00 0.00 C
+ATOM 8 1H THR A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 9 2H THR A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 10 3H THR A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 11 HA THR A 1 1.804 -0.509 0.900 1.00 0.00 H
+ATOM 12 HB THR A 1 1.629 -0.326 -2.132 1.00 0.00 H
+ATOM 13 HG1 THR A 1 1.903 -2.607 -1.925 1.00 0.00 H
+ATOM 14 1HG2 THR A 1 3.906 -1.266 -2.093 1.00 0.00 H
+ATOM 15 2HG2 THR A 1 3.860 0.321 -1.288 1.00 0.00 H
+ATOM 16 3HG2 THR A 1 3.921 -1.168 -0.317 1.00 0.00 H
+ATOM 17 N THR A 2 2.822 1.734 1.003 1.00 0.00 N
+ATOM 18 CA THR A 2 3.436 3.052 1.108 1.00 0.00 C
+ATOM 19 C THR A 2 4.953 2.963 1.006 1.00 0.00 C
+ATOM 20 O THR A 2 5.591 2.209 1.741 1.00 0.00 O
+ATOM 21 CB THR A 2 3.046 3.742 2.428 1.00 0.00 C
+ATOM 22 OG1 THR A 2 1.622 3.894 2.488 1.00 0.00 O
+ATOM 23 CG2 THR A 2 3.703 5.110 2.530 1.00 0.00 C
+ATOM 24 H THR A 2 3.021 1.041 1.710 1.00 0.00 H
+ATOM 25 HA THR A 2 3.066 3.672 0.290 1.00 0.00 H
+ATOM 26 HB THR A 2 3.367 3.127 3.268 1.00 0.00 H
+ATOM 27 HG1 THR A 2 1.371 4.212 3.358 1.00 0.00 H
+ATOM 28 1HG2 THR A 2 3.416 5.582 3.469 1.00 0.00 H
+ATOM 29 2HG2 THR A 2 4.786 4.996 2.496 1.00 0.00 H
+ATOM 30 3HG2 THR A 2 3.378 5.732 1.697 1.00 0.00 H
+ATOM 31 N LEU A 3 5.526 3.738 0.090 1.00 0.00 N
+ATOM 32 CA LEU A 3 6.975 3.801 -0.061 1.00 0.00 C
+ATOM 33 C LEU A 3 7.505 5.187 0.286 1.00 0.00 C
+ATOM 34 O LEU A 3 6.860 6.197 0.003 1.00 0.00 O
+ATOM 35 CB LEU A 3 7.374 3.439 -1.497 1.00 0.00 C
+ATOM 36 CG LEU A 3 6.845 2.096 -2.016 1.00 0.00 C
+ATOM 37 CD1 LEU A 3 7.198 1.945 -3.489 1.00 0.00 C
+ATOM 38 CD2 LEU A 3 7.439 0.963 -1.193 1.00 0.00 C
+ATOM 39 H LEU A 3 4.943 4.296 -0.516 1.00 0.00 H
+ATOM 40 HA LEU A 3 7.426 3.075 0.616 1.00 0.00 H
+ATOM 41 1HB LEU A 3 7.012 4.218 -2.165 1.00 0.00 H
+ATOM 42 2HB LEU A 3 8.462 3.413 -1.559 1.00 0.00 H
+ATOM 43 HG LEU A 3 5.758 2.075 -1.930 1.00 0.00 H
+ATOM 44 1HD1 LEU A 3 6.821 0.991 -3.858 1.00 0.00 H
+ATOM 45 2HD1 LEU A 3 6.743 2.758 -4.057 1.00 0.00 H
+ATOM 46 3HD1 LEU A 3 8.280 1.979 -3.609 1.00 0.00 H
+ATOM 47 1HD2 LEU A 3 7.062 0.009 -1.561 1.00 0.00 H
+ATOM 48 2HD2 LEU A 3 8.526 0.982 -1.279 1.00 0.00 H
+ATOM 49 3HD2 LEU A 3 7.157 1.086 -0.147 1.00 0.00 H
+ATOM 50 N ARG A 4 8.682 5.228 0.900 1.00 0.00 N
+ATOM 51 CA ARG A 4 9.332 6.491 1.226 1.00 0.00 C
+ATOM 52 C ARG A 4 10.807 6.466 0.845 1.00 0.00 C
+ATOM 53 O ARG A 4 11.526 5.522 1.172 1.00 0.00 O
+ATOM 54 CB ARG A 4 9.200 6.794 2.711 1.00 0.00 C
+ATOM 55 CG ARG A 4 7.794 7.151 3.168 1.00 0.00 C
+ATOM 56 CD ARG A 4 7.695 7.202 4.649 1.00 0.00 C
+ATOM 57 NE ARG A 4 8.438 8.322 5.204 1.00 0.00 N
+ATOM 58 CZ ARG A 4 8.650 8.523 6.520 1.00 0.00 C
+ATOM 59 NH1 ARG A 4 8.169 7.673 7.400 1.00 0.00 N
+ATOM 60 NH2 ARG A 4 9.340 9.574 6.925 1.00 0.00 N
+ATOM 61 H ARG A 4 9.138 4.362 1.147 1.00 0.00 H
+ATOM 62 HA ARG A 4 8.841 7.288 0.666 1.00 0.00 H
+ATOM 63 1HB ARG A 4 9.524 5.930 3.289 1.00 0.00 H
+ATOM 64 2HB ARG A 4 9.853 7.627 2.972 1.00 0.00 H
+ATOM 65 1HG ARG A 4 7.521 8.130 2.772 1.00 0.00 H
+ATOM 66 2HG ARG A 4 7.091 6.402 2.803 1.00 0.00 H
+ATOM 67 1HD ARG A 4 6.650 7.309 4.940 1.00 0.00 H
+ATOM 68 2HD ARG A 4 8.097 6.283 5.073 1.00 0.00 H
+ATOM 69 HE ARG A 4 8.823 8.997 4.558 1.00 0.00 H
+ATOM 70 1HH1 ARG A 4 7.642 6.869 7.090 1.00 0.00 H
+ATOM 71 2HH1 ARG A 4 8.328 7.823 8.386 1.00 0.00 H
+ATOM 72 1HH2 ARG A 4 9.710 10.228 6.248 1.00 0.00 H
+ATOM 73 2HH2 ARG A 4 9.499 9.724 7.910 1.00 0.00 H
+ATOM 74 N ARG A 5 11.252 7.509 0.153 1.00 0.00 N
+ATOM 75 CA ARG A 5 12.654 7.632 -0.230 1.00 0.00 C
+ATOM 76 C ARG A 5 13.146 9.064 -0.065 1.00 0.00 C
+ATOM 77 O ARG A 5 12.387 10.017 -0.243 1.00 0.00 O
+ATOM 78 CB ARG A 5 12.855 7.194 -1.673 1.00 0.00 C
+ATOM 79 CG ARG A 5 12.550 5.729 -1.945 1.00 0.00 C
+ATOM 80 CD ARG A 5 13.578 4.835 -1.352 1.00 0.00 C
+ATOM 81 NE ARG A 5 13.361 3.444 -1.715 1.00 0.00 N
+ATOM 82 CZ ARG A 5 12.552 2.597 -1.049 1.00 0.00 C
+ATOM 83 NH1 ARG A 5 11.891 3.014 0.008 1.00 0.00 N
+ATOM 84 NH2 ARG A 5 12.421 1.348 -1.460 1.00 0.00 N
+ATOM 85 H ARG A 5 10.603 8.235 -0.115 1.00 0.00 H
+ATOM 86 HA ARG A 5 13.247 6.982 0.413 1.00 0.00 H
+ATOM 87 1HB ARG A 5 12.218 7.789 -2.326 1.00 0.00 H
+ATOM 88 2HB ARG A 5 13.888 7.376 -1.969 1.00 0.00 H
+ATOM 89 1HG ARG A 5 11.582 5.473 -1.513 1.00 0.00 H
+ATOM 90 2HG ARG A 5 12.525 5.556 -3.022 1.00 0.00 H
+ATOM 91 1HD ARG A 5 14.565 5.130 -1.707 1.00 0.00 H
+ATOM 92 2HD ARG A 5 13.545 4.914 -0.266 1.00 0.00 H
+ATOM 93 HE ARG A 5 13.852 3.087 -2.524 1.00 0.00 H
+ATOM 94 1HH1 ARG A 5 11.991 3.969 0.322 1.00 0.00 H
+ATOM 95 2HH1 ARG A 5 11.285 2.379 0.507 1.00 0.00 H
+ATOM 96 1HH2 ARG A 5 12.929 1.027 -2.273 1.00 0.00 H
+ATOM 97 2HH2 ARG A 5 11.815 0.713 -0.961 1.00 0.00 H
+ATOM 98 N ARG A 6 14.422 9.210 0.277 1.00 0.00 N
+ATOM 99 CA ARG A 6 15.035 10.527 0.406 1.00 0.00 C
+ATOM 100 C ARG A 6 16.312 10.623 -0.417 1.00 0.00 C
+ATOM 101 O ARG A 6 17.258 9.865 -0.204 1.00 0.00 O
+ATOM 102 CB ARG A 6 15.350 10.830 1.863 1.00 0.00 C
+ATOM 103 CG ARG A 6 15.940 12.208 2.117 1.00 0.00 C
+ATOM 104 CD ARG A 6 16.196 12.439 3.562 1.00 0.00 C
+ATOM 105 NE ARG A 6 14.961 12.524 4.324 1.00 0.00 N
+ATOM 106 CZ ARG A 6 14.892 12.550 5.670 1.00 0.00 C
+ATOM 107 NH1 ARG A 6 15.994 12.496 6.385 1.00 0.00 N
+ATOM 108 NH2 ARG A 6 13.718 12.629 6.270 1.00 0.00 N
+ATOM 109 H ARG A 6 14.981 8.388 0.452 1.00 0.00 H
+ATOM 110 HA ARG A 6 14.328 11.275 0.044 1.00 0.00 H
+ATOM 111 1HB ARG A 6 14.441 10.746 2.457 1.00 0.00 H
+ATOM 112 2HB ARG A 6 16.058 10.093 2.243 1.00 0.00 H
+ATOM 113 1HG ARG A 6 16.885 12.304 1.582 1.00 0.00 H
+ATOM 114 2HG ARG A 6 15.245 12.972 1.765 1.00 0.00 H
+ATOM 115 1HD ARG A 6 16.787 11.616 3.962 1.00 0.00 H
+ATOM 116 2HD ARG A 6 16.741 13.373 3.690 1.00 0.00 H
+ATOM 117 HE ARG A 6 14.092 12.568 3.809 1.00 0.00 H
+ATOM 118 1HH1 ARG A 6 16.892 12.435 5.926 1.00 0.00 H
+ATOM 119 2HH1 ARG A 6 15.943 12.515 7.393 1.00 0.00 H
+ATOM 120 1HH2 ARG A 6 12.871 12.671 5.721 1.00 0.00 H
+ATOM 121 2HH2 ARG A 6 13.667 12.648 7.278 1.00 0.00 H
+ATOM 122 N ILE A 7 16.334 11.560 -1.359 1.00 0.00 N
+ATOM 123 CA ILE A 7 17.503 11.768 -2.205 1.00 0.00 C
+ATOM 124 C ILE A 7 17.922 13.233 -2.216 1.00 0.00 C
+ATOM 125 O ILE A 7 17.130 14.112 -2.555 1.00 0.00 O
+ATOM 126 CB ILE A 7 17.228 11.302 -3.647 1.00 0.00 C
+ATOM 127 CG1 ILE A 7 16.946 9.798 -3.677 1.00 0.00 C
+ATOM 128 CG2 ILE A 7 18.404 11.645 -4.550 1.00 0.00 C
+ATOM 129 CD1 ILE A 7 16.497 9.288 -5.027 1.00 0.00 C
+ATOM 130 H ILE A 7 15.520 12.142 -1.493 1.00 0.00 H
+ATOM 131 HA ILE A 7 18.327 11.172 -1.811 1.00 0.00 H
+ATOM 132 HB ILE A 7 16.335 11.798 -4.025 1.00 0.00 H
+ATOM 133 1HG1 ILE A 7 17.844 9.253 -3.387 1.00 0.00 H
+ATOM 134 2HG1 ILE A 7 16.171 9.559 -2.948 1.00 0.00 H
+ATOM 135 1HG2 ILE A 7 18.193 11.308 -5.564 1.00 0.00 H
+ATOM 136 2HG2 ILE A 7 18.560 12.722 -4.550 1.00 0.00 H
+ATOM 137 3HG2 ILE A 7 19.302 11.148 -4.182 1.00 0.00 H
+ATOM 138 1HD1 ILE A 7 16.316 8.214 -4.969 1.00 0.00 H
+ATOM 139 2HD1 ILE A 7 15.578 9.796 -5.321 1.00 0.00 H
+ATOM 140 3HD1 ILE A 7 17.272 9.484 -5.766 1.00 0.00 H
+ATOM 141 N ASN A 8 19.171 13.489 -1.842 1.00 0.00 N
+ATOM 142 CA ASN A 8 19.704 14.846 -1.830 1.00 0.00 C
+ATOM 143 C ASN A 8 18.851 15.765 -0.965 1.00 0.00 C
+ATOM 144 O ASN A 8 18.675 16.943 -1.280 1.00 0.00 O
+ATOM 145 CB ASN A 8 19.812 15.390 -3.242 1.00 0.00 C
+ATOM 146 CG ASN A 8 20.763 14.597 -4.095 1.00 0.00 C
+ATOM 147 OD1 ASN A 8 21.763 14.064 -3.601 1.00 0.00 O
+ATOM 148 ND2 ASN A 8 20.471 14.508 -5.368 1.00 0.00 N
+ATOM 149 H ASN A 8 19.766 12.724 -1.559 1.00 0.00 H
+ATOM 150 HA ASN A 8 20.714 14.817 -1.419 1.00 0.00 H
+ATOM 151 1HB ASN A 8 18.828 15.382 -3.712 1.00 0.00 H
+ATOM 152 2HB ASN A 8 20.151 16.426 -3.209 1.00 0.00 H
+ATOM 153 1HD2 ASN A 8 21.068 13.993 -5.984 1.00 0.00 H
+ATOM 154 2HD2 ASN A 8 19.651 14.955 -5.725 1.00 0.00 H
+ATOM 155 N GLY A 9 18.322 15.221 0.125 1.00 0.00 N
+ATOM 156 CA GLY A 9 17.603 16.022 1.110 1.00 0.00 C
+ATOM 157 C GLY A 9 16.113 16.069 0.799 1.00 0.00 C
+ATOM 158 O GLY A 9 15.313 16.526 1.616 1.00 0.00 O
+ATOM 159 H GLY A 9 18.421 14.228 0.277 1.00 0.00 H
+ATOM 160 1HA GLY A 9 17.759 15.602 2.104 1.00 0.00 H
+ATOM 161 2HA GLY A 9 18.008 17.033 1.122 1.00 0.00 H
+ATOM 162 N GLU A 10 15.746 15.594 -0.386 1.00 0.00 N
+ATOM 163 CA GLU A 10 14.356 15.623 -0.826 1.00 0.00 C
+ATOM 164 C GLU A 10 13.654 14.307 -0.520 1.00 0.00 C
+ATOM 165 O GLU A 10 14.059 13.249 -1.003 1.00 0.00 O
+ATOM 166 CB GLU A 10 14.277 15.919 -2.326 1.00 0.00 C
+ATOM 167 CG GLU A 10 12.860 16.000 -2.876 1.00 0.00 C
+ATOM 168 CD GLU A 10 12.822 16.179 -4.369 1.00 0.00 C
+ATOM 169 OE1 GLU A 10 13.829 16.539 -4.931 1.00 0.00 O
+ATOM 170 OE2 GLU A 10 11.785 15.956 -4.947 1.00 0.00 O
+ATOM 171 H GLU A 10 16.447 15.203 -0.999 1.00 0.00 H
+ATOM 172 HA GLU A 10 13.842 16.425 -0.295 1.00 0.00 H
+ATOM 173 1HB GLU A 10 14.773 16.866 -2.536 1.00 0.00 H
+ATOM 174 2HB GLU A 10 14.806 15.142 -2.878 1.00 0.00 H
+ATOM 175 1HG GLU A 10 12.328 15.086 -2.618 1.00 0.00 H
+ATOM 176 2HG GLU A 10 12.345 16.834 -2.402 1.00 0.00 H
+ATOM 177 N GLU A 11 12.599 14.377 0.284 1.00 0.00 N
+ATOM 178 CA GLU A 11 11.839 13.190 0.657 1.00 0.00 C
+ATOM 179 C GLU A 11 10.501 13.142 -0.069 1.00 0.00 C
+ATOM 180 O GLU A 11 9.808 14.153 -0.182 1.00 0.00 O
+ATOM 181 CB GLU A 11 11.610 13.157 2.170 1.00 0.00 C
+ATOM 182 CG GLU A 11 10.885 11.915 2.669 1.00 0.00 C
+ATOM 183 CD GLU A 11 10.685 11.913 4.159 1.00 0.00 C
+ATOM 184 OE1 GLU A 11 11.115 12.843 4.798 1.00 0.00 O
+ATOM 185 OE2 GLU A 11 10.102 10.980 4.659 1.00 0.00 O
+ATOM 186 H GLU A 11 12.316 15.276 0.647 1.00 0.00 H
+ATOM 187 HA GLU A 11 12.418 12.308 0.382 1.00 0.00 H
+ATOM 188 1HB GLU A 11 12.570 13.213 2.685 1.00 0.00 H
+ATOM 189 2HB GLU A 11 11.027 14.028 2.469 1.00 0.00 H
+ATOM 190 1HG GLU A 11 9.911 11.857 2.184 1.00 0.00 H
+ATOM 191 2HG GLU A 11 11.456 11.033 2.382 1.00 0.00 H
+ATOM 192 N ILE A 12 10.143 11.961 -0.561 1.00 0.00 N
+ATOM 193 CA ILE A 12 8.832 11.747 -1.163 1.00 0.00 C
+ATOM 194 C ILE A 12 8.123 10.556 -0.531 1.00 0.00 C
+ATOM 195 O ILE A 12 8.752 9.549 -0.204 1.00 0.00 O
+ATOM 196 CB ILE A 12 8.954 11.527 -2.681 1.00 0.00 C
+ATOM 197 CG1 ILE A 12 7.568 11.503 -3.331 1.00 0.00 C
+ATOM 198 CG2 ILE A 12 9.704 10.236 -2.973 1.00 0.00 C
+ATOM 199 CD1 ILE A 12 7.597 11.629 -4.837 1.00 0.00 C
+ATOM 200 H ILE A 12 10.795 11.191 -0.517 1.00 0.00 H
+ATOM 201 HA ILE A 12 8.227 12.640 -1.000 1.00 0.00 H
+ATOM 202 HB ILE A 12 9.497 12.360 -3.127 1.00 0.00 H
+ATOM 203 1HG1 ILE A 12 7.063 10.572 -3.076 1.00 0.00 H
+ATOM 204 2HG1 ILE A 12 6.966 12.320 -2.933 1.00 0.00 H
+ATOM 205 1HG2 ILE A 12 9.781 10.095 -4.051 1.00 0.00 H
+ATOM 206 2HG2 ILE A 12 10.703 10.291 -2.542 1.00 0.00 H
+ATOM 207 3HG2 ILE A 12 9.166 9.395 -2.535 1.00 0.00 H
+ATOM 208 1HD1 ILE A 12 6.578 11.605 -5.224 1.00 0.00 H
+ATOM 209 2HD1 ILE A 12 8.068 12.573 -5.114 1.00 0.00 H
+ATOM 210 3HD1 ILE A 12 8.165 10.802 -5.260 1.00 0.00 H
+ATOM 211 N GLU A 13 6.811 10.675 -0.362 1.00 0.00 N
+ATOM 212 CA GLU A 13 5.990 9.555 0.082 1.00 0.00 C
+ATOM 213 C GLU A 13 4.999 9.137 -0.996 1.00 0.00 C
+ATOM 214 O GLU A 13 4.217 9.952 -1.485 1.00 0.00 O
+ATOM 215 CB GLU A 13 5.240 9.920 1.365 1.00 0.00 C
+ATOM 216 CG GLU A 13 4.375 8.801 1.927 1.00 0.00 C
+ATOM 217 CD GLU A 13 3.789 9.133 3.271 1.00 0.00 C
+ATOM 218 OE1 GLU A 13 4.413 9.859 4.008 1.00 0.00 O
+ATOM 219 OE2 GLU A 13 2.715 8.661 3.561 1.00 0.00 O
+ATOM 220 H GLU A 13 6.370 11.565 -0.547 1.00 0.00 H
+ATOM 221 HA GLU A 13 6.646 8.711 0.301 1.00 0.00 H
+ATOM 222 1HB GLU A 13 5.955 10.209 2.135 1.00 0.00 H
+ATOM 223 2HB GLU A 13 4.595 10.779 1.178 1.00 0.00 H
+ATOM 224 1HG GLU A 13 3.563 8.597 1.230 1.00 0.00 H
+ATOM 225 2HG GLU A 13 4.979 7.898 2.013 1.00 0.00 H
+ATOM 226 N VAL A 14 5.036 7.860 -1.363 1.00 0.00 N
+ATOM 227 CA VAL A 14 4.202 7.350 -2.445 1.00 0.00 C
+ATOM 228 C VAL A 14 3.231 6.291 -1.938 1.00 0.00 C
+ATOM 229 O VAL A 14 3.637 5.306 -1.321 1.00 0.00 O
+ATOM 230 CB VAL A 14 5.080 6.747 -3.558 1.00 0.00 C
+ATOM 231 CG1 VAL A 14 4.212 6.134 -4.647 1.00 0.00 C
+ATOM 232 CG2 VAL A 14 5.993 7.818 -4.134 1.00 0.00 C
+ATOM 233 H VAL A 14 5.658 7.227 -0.881 1.00 0.00 H
+ATOM 234 HA VAL A 14 3.629 8.179 -2.861 1.00 0.00 H
+ATOM 235 HB VAL A 14 5.683 5.943 -3.136 1.00 0.00 H
+ATOM 236 1HG1 VAL A 14 4.849 5.712 -5.425 1.00 0.00 H
+ATOM 237 2HG1 VAL A 14 3.594 5.345 -4.218 1.00 0.00 H
+ATOM 238 3HG1 VAL A 14 3.573 6.903 -5.079 1.00 0.00 H
+ATOM 239 1HG2 VAL A 14 6.611 7.385 -4.920 1.00 0.00 H
+ATOM 240 2HG2 VAL A 14 5.389 8.625 -4.550 1.00 0.00 H
+ATOM 241 3HG2 VAL A 14 6.633 8.214 -3.346 1.00 0.00 H
+ATOM 242 N ARG A 15 1.946 6.499 -2.203 1.00 0.00 N
+ATOM 243 CA ARG A 15 0.914 5.559 -1.781 1.00 0.00 C
+ATOM 244 C ARG A 15 0.124 5.036 -2.973 1.00 0.00 C
+ATOM 245 O ARG A 15 -0.225 5.792 -3.879 1.00 0.00 O
+ATOM 246 CB ARG A 15 -0.038 6.217 -0.794 1.00 0.00 C
+ATOM 247 CG ARG A 15 0.608 6.698 0.495 1.00 0.00 C
+ATOM 248 CD ARG A 15 -0.404 7.181 1.470 1.00 0.00 C
+ATOM 249 NE ARG A 15 0.215 7.739 2.662 1.00 0.00 N
+ATOM 250 CZ ARG A 15 -0.447 8.046 3.795 1.00 0.00 C
+ATOM 251 NH1 ARG A 15 -1.744 7.844 3.874 1.00 0.00 N
+ATOM 252 NH2 ARG A 15 0.207 8.550 4.827 1.00 0.00 N
+ATOM 253 H ARG A 15 1.676 7.330 -2.710 1.00 0.00 H
+ATOM 254 HA ARG A 15 1.397 4.716 -1.284 1.00 0.00 H
+ATOM 255 1HB ARG A 15 -0.513 7.076 -1.265 1.00 0.00 H
+ATOM 256 2HB ARG A 15 -0.827 5.514 -0.525 1.00 0.00 H
+ATOM 257 1HG ARG A 15 1.162 5.878 0.953 1.00 0.00 H
+ATOM 258 2HG ARG A 15 1.291 7.520 0.276 1.00 0.00 H
+ATOM 259 1HD ARG A 15 -1.014 7.956 1.008 1.00 0.00 H
+ATOM 260 2HD ARG A 15 -1.041 6.351 1.773 1.00 0.00 H
+ATOM 261 HE ARG A 15 1.211 7.908 2.639 1.00 0.00 H
+ATOM 262 1HH1 ARG A 15 -2.244 7.458 3.086 1.00 0.00 H
+ATOM 263 2HH1 ARG A 15 -2.239 8.074 4.723 1.00 0.00 H
+ATOM 264 1HH2 ARG A 15 1.204 8.705 4.766 1.00 0.00 H
+ATOM 265 2HH2 ARG A 15 -0.288 8.780 5.675 1.00 0.00 H
+ATOM 266 N ALA A 16 -0.156 3.737 -2.967 1.00 0.00 N
+ATOM 267 CA ALA A 16 -0.991 3.128 -3.995 1.00 0.00 C
+ATOM 268 C ALA A 16 -1.634 1.842 -3.493 1.00 0.00 C
+ATOM 269 O ALA A 16 -1.181 1.252 -2.512 1.00 0.00 O
+ATOM 270 CB ALA A 16 -0.174 2.856 -5.250 1.00 0.00 C
+ATOM 271 H ALA A 16 0.220 3.156 -2.232 1.00 0.00 H
+ATOM 272 HA ALA A 16 -1.781 3.833 -4.261 1.00 0.00 H
+ATOM 273 1HB ALA A 16 -0.812 2.402 -6.008 1.00 0.00 H
+ATOM 274 2HB ALA A 16 0.231 3.794 -5.631 1.00 0.00 H
+ATOM 275 3HB ALA A 16 0.644 2.178 -5.011 1.00 0.00 H
+ATOM 276 N ASP A 17 -2.692 1.411 -4.171 1.00 0.00 N
+ATOM 277 CA ASP A 17 -3.332 0.137 -3.864 1.00 0.00 C
+ATOM 278 C ASP A 17 -2.701 -1.001 -4.656 1.00 0.00 C
+ATOM 279 O ASP A 17 -3.193 -2.129 -4.639 1.00 0.00 O
+ATOM 280 CB ASP A 17 -4.832 0.205 -4.163 1.00 0.00 C
+ATOM 281 CG ASP A 17 -5.132 0.599 -5.603 1.00 0.00 C
+ATOM 282 OD1 ASP A 17 -4.321 1.272 -6.195 1.00 0.00 O
+ATOM 283 OD2 ASP A 17 -6.168 0.225 -6.097 1.00 0.00 O
+ATOM 284 H ASP A 17 -3.063 1.980 -4.918 1.00 0.00 H
+ATOM 285 HA ASP A 17 -3.207 -0.065 -2.800 1.00 0.00 H
+ATOM 286 1HB ASP A 17 -5.286 -0.767 -3.966 1.00 0.00 H
+ATOM 287 2HB ASP A 17 -5.304 0.928 -3.498 1.00 0.00 H
+ATOM 288 N CYS A 18 -1.609 -0.698 -5.348 1.00 0.00 N
+ATOM 289 CA CYS A 18 -0.864 -1.712 -6.086 1.00 0.00 C
+ATOM 290 C CYS A 18 0.637 -1.468 -5.995 1.00 0.00 C
+ATOM 291 O CYS A 18 1.102 -0.338 -6.144 1.00 0.00 O
+ATOM 292 CB CYS A 18 -1.285 -1.725 -7.556 1.00 0.00 C
+ATOM 293 SG CYS A 18 -0.450 -2.983 -8.552 1.00 0.00 S
+ATOM 294 H CYS A 18 -1.285 0.258 -5.365 1.00 0.00 H
+ATOM 295 HA CYS A 18 -1.085 -2.687 -5.653 1.00 0.00 H
+ATOM 296 1HB CYS A 18 -2.359 -1.898 -7.625 1.00 0.00 H
+ATOM 297 2HB CYS A 18 -1.080 -0.752 -8.001 1.00 0.00 H
+ATOM 298 N ASP A 19 1.390 -2.535 -5.749 1.00 0.00 N
+ATOM 299 CA ASP A 19 2.846 -2.458 -5.736 1.00 0.00 C
+ATOM 300 C ASP A 19 3.384 -1.980 -7.079 1.00 0.00 C
+ATOM 301 O ASP A 19 4.394 -1.279 -7.140 1.00 0.00 O
+ATOM 302 CB ASP A 19 3.453 -3.820 -5.393 1.00 0.00 C
+ATOM 303 CG ASP A 19 3.197 -4.236 -3.950 1.00 0.00 C
+ATOM 304 OD1 ASP A 19 2.773 -3.407 -3.180 1.00 0.00 O
+ATOM 305 OD2 ASP A 19 3.428 -5.378 -3.633 1.00 0.00 O
+ATOM 306 H ASP A 19 0.943 -3.421 -5.566 1.00 0.00 H
+ATOM 307 HA ASP A 19 3.149 -1.747 -4.966 1.00 0.00 H
+ATOM 308 1HB ASP A 19 3.037 -4.581 -6.054 1.00 0.00 H
+ATOM 309 2HB ASP A 19 4.530 -3.792 -5.562 1.00 0.00 H
+ATOM 310 N CYS A 20 2.703 -2.363 -8.154 1.00 0.00 N
+ATOM 311 CA CYS A 20 3.084 -1.937 -9.495 1.00 0.00 C
+ATOM 312 C CYS A 20 3.104 -0.418 -9.606 1.00 0.00 C
+ATOM 313 O CYS A 20 4.074 0.167 -10.087 1.00 0.00 O
+ATOM 314 CB CYS A 20 2.120 -2.506 -10.535 1.00 0.00 C
+ATOM 315 SG CYS A 20 0.398 -2.006 -10.297 1.00 0.00 S
+ATOM 316 H CYS A 20 1.900 -2.965 -8.039 1.00 0.00 H
+ATOM 317 HA CYS A 20 4.085 -2.314 -9.706 1.00 0.00 H
+ATOM 318 1HB CYS A 20 2.429 -2.188 -11.531 1.00 0.00 H
+ATOM 319 2HB CYS A 20 2.161 -3.595 -10.512 1.00 0.00 H
+ATOM 320 N LYS A 21 2.026 0.217 -9.157 1.00 0.00 N
+ATOM 321 CA LYS A 21 1.885 1.664 -9.273 1.00 0.00 C
+ATOM 322 C LYS A 21 2.830 2.387 -8.321 1.00 0.00 C
+ATOM 323 O LYS A 21 3.435 3.396 -8.681 1.00 0.00 O
+ATOM 324 CB LYS A 21 0.440 2.085 -9.000 1.00 0.00 C
+ATOM 325 CG LYS A 21 -0.542 1.712 -10.103 1.00 0.00 C
+ATOM 326 CD LYS A 21 -1.886 2.395 -9.900 1.00 0.00 C
+ATOM 327 CE LYS A 21 -2.666 1.757 -8.759 1.00 0.00 C
+ATOM 328 NZ LYS A 21 -4.043 2.309 -8.650 1.00 0.00 N
+ATOM 329 H LYS A 21 1.285 -0.316 -8.725 1.00 0.00 H
+ATOM 330 HA LYS A 21 2.129 1.954 -10.295 1.00 0.00 H
+ATOM 331 1HB LYS A 21 0.095 1.623 -8.075 1.00 0.00 H
+ATOM 332 2HB LYS A 21 0.396 3.165 -8.864 1.00 0.00 H
+ATOM 333 1HG LYS A 21 -0.135 2.010 -11.070 1.00 0.00 H
+ATOM 334 2HG LYS A 21 -0.690 0.632 -10.108 1.00 0.00 H
+ATOM 335 1HD LYS A 21 -1.728 3.451 -9.675 1.00 0.00 H
+ATOM 336 2HD LYS A 21 -2.474 2.321 -10.815 1.00 0.00 H
+ATOM 337 1HE LYS A 21 -2.730 0.682 -8.920 1.00 0.00 H
+ATOM 338 2HE LYS A 21 -2.143 1.931 -7.819 1.00 0.00 H
+ATOM 339 1HZ LYS A 21 -4.526 1.862 -7.883 1.00 0.00 H
+ATOM 340 2HZ LYS A 21 -3.995 3.304 -8.482 1.00 0.00 H
+ATOM 341 3HZ LYS A 21 -4.545 2.137 -9.509 1.00 0.00 H
+ATOM 342 N ALA A 22 2.951 1.864 -7.106 1.00 0.00 N
+ATOM 343 CA ALA A 22 3.803 2.474 -6.092 1.00 0.00 C
+ATOM 344 C ALA A 22 5.258 2.506 -6.541 1.00 0.00 C
+ATOM 345 O ALA A 22 5.954 3.504 -6.356 1.00 0.00 O
+ATOM 346 CB ALA A 22 3.674 1.726 -4.772 1.00 0.00 C
+ATOM 347 H ALA A 22 2.440 1.023 -6.878 1.00 0.00 H
+ATOM 348 HA ALA A 22 3.466 3.497 -5.926 1.00 0.00 H
+ATOM 349 1HB ALA A 22 4.316 2.193 -4.025 1.00 0.00 H
+ATOM 350 2HB ALA A 22 2.638 1.762 -4.434 1.00 0.00 H
+ATOM 351 3HB ALA A 22 3.974 0.689 -4.911 1.00 0.00 H
+ATOM 352 N LYS A 23 5.714 1.407 -7.134 1.00 0.00 N
+ATOM 353 CA LYS A 23 7.091 1.303 -7.601 1.00 0.00 C
+ATOM 354 C LYS A 23 7.329 2.194 -8.814 1.00 0.00 C
+ATOM 355 O LYS A 23 8.367 2.848 -8.921 1.00 0.00 O
+ATOM 356 CB LYS A 23 7.434 -0.148 -7.940 1.00 0.00 C
+ATOM 357 CG LYS A 23 7.579 -1.059 -6.728 1.00 0.00 C
+ATOM 358 CD LYS A 23 7.876 -2.492 -7.146 1.00 0.00 C
+ATOM 359 CE LYS A 23 8.024 -3.403 -5.937 1.00 0.00 C
+ATOM 360 NZ LYS A 23 8.295 -4.812 -6.331 1.00 0.00 N
+ATOM 361 H LYS A 23 5.090 0.624 -7.264 1.00 0.00 H
+ATOM 362 HA LYS A 23 7.754 1.622 -6.797 1.00 0.00 H
+ATOM 363 1HB LYS A 23 6.657 -0.566 -8.581 1.00 0.00 H
+ATOM 364 2HB LYS A 23 8.370 -0.181 -8.497 1.00 0.00 H
+ATOM 365 1HG LYS A 23 8.391 -0.698 -6.096 1.00 0.00 H
+ATOM 366 2HG LYS A 23 6.657 -1.043 -6.148 1.00 0.00 H
+ATOM 367 1HD LYS A 23 7.065 -2.863 -7.774 1.00 0.00 H
+ATOM 368 2HD LYS A 23 8.800 -2.518 -7.724 1.00 0.00 H
+ATOM 369 1HE LYS A 23 8.843 -3.049 -5.313 1.00 0.00 H
+ATOM 370 2HE LYS A 23 7.108 -3.375 -5.346 1.00 0.00 H
+ATOM 371 1HZ LYS A 23 8.385 -5.383 -5.502 1.00 0.00 H
+ATOM 372 2HZ LYS A 23 7.531 -5.157 -6.895 1.00 0.00 H
+ATOM 373 3HZ LYS A 23 9.152 -4.854 -6.863 1.00 0.00 H
+ATOM 374 N GLU A 24 6.363 2.216 -9.725 1.00 0.00 N
+ATOM 375 CA GLU A 24 6.471 3.019 -10.937 1.00 0.00 C
+ATOM 376 C GLU A 24 6.593 4.501 -10.607 1.00 0.00 C
+ATOM 377 O GLU A 24 7.420 5.209 -11.183 1.00 0.00 O
+ATOM 378 CB GLU A 24 5.258 2.786 -11.841 1.00 0.00 C
+ATOM 379 CG GLU A 24 5.303 3.544 -13.161 1.00 0.00 C
+ATOM 380 CD GLU A 24 4.134 3.233 -14.054 1.00 0.00 C
+ATOM 381 OE1 GLU A 24 3.289 2.470 -13.651 1.00 0.00 O
+ATOM 382 OE2 GLU A 24 4.086 3.759 -15.140 1.00 0.00 O
+ATOM 383 H GLU A 24 5.532 1.662 -9.574 1.00 0.00 H
+ATOM 384 HA GLU A 24 7.364 2.707 -11.481 1.00 0.00 H
+ATOM 385 1HB GLU A 24 5.173 1.723 -12.069 1.00 0.00 H
+ATOM 386 2HB GLU A 24 4.351 3.082 -11.316 1.00 0.00 H
+ATOM 387 1HG GLU A 24 5.312 4.614 -12.953 1.00 0.00 H
+ATOM 388 2HG GLU A 24 6.227 3.295 -13.680 1.00 0.00 H
+ATOM 389 N ILE A 25 5.766 4.965 -9.677 1.00 0.00 N
+ATOM 390 CA ILE A 25 5.769 6.368 -9.280 1.00 0.00 C
+ATOM 391 C ILE A 25 7.073 6.740 -8.586 1.00 0.00 C
+ATOM 392 O ILE A 25 7.679 7.767 -8.893 1.00 0.00 O
+ATOM 393 CB ILE A 25 4.584 6.677 -8.346 1.00 0.00 C
+ATOM 394 CG1 ILE A 25 3.260 6.548 -9.104 1.00 0.00 C
+ATOM 395 CG2 ILE A 25 4.726 8.069 -7.750 1.00 0.00 C
+ATOM 396 CD1 ILE A 25 2.047 6.479 -8.205 1.00 0.00 C
+ATOM 397 H ILE A 25 5.117 4.330 -9.235 1.00 0.00 H
+ATOM 398 HA ILE A 25 5.661 6.982 -10.175 1.00 0.00 H
+ATOM 399 HB ILE A 25 4.557 5.947 -7.538 1.00 0.00 H
+ATOM 400 1HG1 ILE A 25 3.141 7.398 -9.775 1.00 0.00 H
+ATOM 401 2HG1 ILE A 25 3.279 5.648 -9.719 1.00 0.00 H
+ATOM 402 1HG2 ILE A 25 3.880 8.271 -7.094 1.00 0.00 H
+ATOM 403 2HG2 ILE A 25 5.651 8.126 -7.178 1.00 0.00 H
+ATOM 404 3HG2 ILE A 25 4.749 8.808 -8.551 1.00 0.00 H
+ATOM 405 1HD1 ILE A 25 1.147 6.388 -8.815 1.00 0.00 H
+ATOM 406 2HD1 ILE A 25 2.129 5.613 -7.548 1.00 0.00 H
+ATOM 407 3HD1 ILE A 25 1.987 7.386 -7.605 1.00 0.00 H
+ATOM 408 N MET A 26 7.501 5.900 -7.650 1.00 0.00 N
+ATOM 409 CA MET A 26 8.736 6.138 -6.913 1.00 0.00 C
+ATOM 410 C MET A 26 9.946 6.095 -7.837 1.00 0.00 C
+ATOM 411 O MET A 26 10.861 6.910 -7.716 1.00 0.00 O
+ATOM 412 CB MET A 26 8.886 5.114 -5.790 1.00 0.00 C
+ATOM 413 CG MET A 26 10.074 5.358 -4.870 1.00 0.00 C
+ATOM 414 SD MET A 26 9.954 6.921 -3.978 1.00 0.00 S
+ATOM 415 CE MET A 26 8.901 6.450 -2.609 1.00 0.00 C
+ATOM 416 H MET A 26 6.956 5.075 -7.444 1.00 0.00 H
+ATOM 417 HA MET A 26 8.681 7.126 -6.455 1.00 0.00 H
+ATOM 418 1HB MET A 26 7.985 5.111 -5.178 1.00 0.00 H
+ATOM 419 2HB MET A 26 8.994 4.117 -6.218 1.00 0.00 H
+ATOM 420 1HG MET A 26 10.142 4.550 -4.142 1.00 0.00 H
+ATOM 421 2HG MET A 26 10.993 5.365 -5.456 1.00 0.00 H
+ATOM 422 1HE MET A 26 8.734 7.313 -1.965 1.00 0.00 H
+ATOM 423 2HE MET A 26 7.945 6.091 -2.992 1.00 0.00 H
+ATOM 424 3HE MET A 26 9.383 5.657 -2.036 1.00 0.00 H
+ATOM 425 N LYS A 27 9.945 5.139 -8.760 1.00 0.00 N
+ATOM 426 CA LYS A 27 11.060 4.965 -9.684 1.00 0.00 C
+ATOM 427 C LYS A 27 11.275 6.214 -10.529 1.00 0.00 C
+ATOM 428 O LYS A 27 12.402 6.681 -10.689 1.00 0.00 O
+ATOM 429 CB LYS A 27 10.824 3.753 -10.586 1.00 0.00 C
+ATOM 430 CG LYS A 27 11.950 3.474 -11.573 1.00 0.00 C
+ATOM 431 CD LYS A 27 11.657 2.240 -12.412 1.00 0.00 C
+ATOM 432 CE LYS A 27 12.824 1.903 -13.328 1.00 0.00 C
+ATOM 433 NZ LYS A 27 13.006 2.924 -14.395 1.00 0.00 N
+ATOM 434 H LYS A 27 9.152 4.517 -8.824 1.00 0.00 H
+ATOM 435 HA LYS A 27 11.964 4.776 -9.103 1.00 0.00 H
+ATOM 436 1HB LYS A 27 10.690 2.862 -9.971 1.00 0.00 H
+ATOM 437 2HB LYS A 27 9.907 3.898 -11.157 1.00 0.00 H
+ATOM 438 1HG LYS A 27 12.075 4.332 -12.235 1.00 0.00 H
+ATOM 439 2HG LYS A 27 12.881 3.321 -11.028 1.00 0.00 H
+ATOM 440 1HD LYS A 27 11.465 1.390 -11.755 1.00 0.00 H
+ATOM 441 2HD LYS A 27 10.769 2.415 -13.019 1.00 0.00 H
+ATOM 442 1HE LYS A 27 13.740 1.839 -12.743 1.00 0.00 H
+ATOM 443 2HE LYS A 27 12.651 0.934 -13.797 1.00 0.00 H
+ATOM 444 1HZ LYS A 27 13.788 2.664 -14.981 1.00 0.00 H
+ATOM 445 2HZ LYS A 27 12.168 2.978 -14.957 1.00 0.00 H
+ATOM 446 3HZ LYS A 27 13.187 3.823 -13.974 1.00 0.00 H
+ATOM 447 N ARG A 28 10.186 6.751 -11.070 1.00 0.00 N
+ATOM 448 CA ARG A 28 10.253 7.946 -11.902 1.00 0.00 C
+ATOM 449 C ARG A 28 10.837 9.122 -11.130 1.00 0.00 C
+ATOM 450 O ARG A 28 11.646 9.884 -11.660 1.00 0.00 O
+ATOM 451 CB ARG A 28 8.871 8.317 -12.419 1.00 0.00 C
+ATOM 452 CG ARG A 28 8.310 7.379 -13.475 1.00 0.00 C
+ATOM 453 CD ARG A 28 6.930 7.761 -13.872 1.00 0.00 C
+ATOM 454 NE ARG A 28 6.307 6.748 -14.709 1.00 0.00 N
+ATOM 455 CZ ARG A 28 6.478 6.646 -16.041 1.00 0.00 C
+ATOM 456 NH1 ARG A 28 7.255 7.499 -16.672 1.00 0.00 N
+ATOM 457 NH2 ARG A 28 5.866 5.688 -16.715 1.00 0.00 N
+ATOM 458 H ARG A 28 9.289 6.320 -10.900 1.00 0.00 H
+ATOM 459 HA ARG A 28 10.896 7.736 -12.758 1.00 0.00 H
+ATOM 460 1HB ARG A 28 8.166 8.338 -11.589 1.00 0.00 H
+ATOM 461 2HB ARG A 28 8.900 9.318 -12.848 1.00 0.00 H
+ATOM 462 1HG ARG A 28 8.943 7.410 -14.363 1.00 0.00 H
+ATOM 463 2HG ARG A 28 8.285 6.362 -13.083 1.00 0.00 H
+ATOM 464 1HD ARG A 28 6.318 7.890 -12.980 1.00 0.00 H
+ATOM 465 2HD ARG A 28 6.958 8.695 -14.431 1.00 0.00 H
+ATOM 466 HE ARG A 28 5.702 6.074 -14.259 1.00 0.00 H
+ATOM 467 1HH1 ARG A 28 7.723 8.231 -16.157 1.00 0.00 H
+ATOM 468 2HH1 ARG A 28 7.384 7.422 -17.670 1.00 0.00 H
+ATOM 469 1HH2 ARG A 28 5.268 5.032 -16.230 1.00 0.00 H
+ATOM 470 2HH2 ARG A 28 5.994 5.611 -17.712 1.00 0.00 H
+ATOM 471 N TRP A 29 10.421 9.265 -9.877 1.00 0.00 N
+ATOM 472 CA TRP A 29 10.945 10.315 -9.011 1.00 0.00 C
+ATOM 473 C TRP A 29 12.442 10.147 -8.784 1.00 0.00 C
+ATOM 474 O TRP A 29 13.207 11.105 -8.891 1.00 0.00 O
+ATOM 475 CB TRP A 29 10.218 10.309 -7.665 1.00 0.00 C
+ATOM 476 CG TRP A 29 10.798 11.264 -6.667 1.00 0.00 C
+ATOM 477 CD1 TRP A 29 10.557 12.602 -6.583 1.00 0.00 C
+ATOM 478 CD2 TRP A 29 11.726 10.956 -5.598 1.00 0.00 C
+ATOM 479 NE1 TRP A 29 11.267 13.147 -5.542 1.00 0.00 N
+ATOM 480 CE2 TRP A 29 11.987 12.154 -4.927 1.00 0.00 C
+ATOM 481 CE3 TRP A 29 12.346 9.778 -5.163 1.00 0.00 C
+ATOM 482 CZ2 TRP A 29 12.845 12.215 -3.841 1.00 0.00 C
+ATOM 483 CZ3 TRP A 29 13.205 9.839 -4.072 1.00 0.00 C
+ATOM 484 CH2 TRP A 29 13.448 11.026 -3.429 1.00 0.00 C
+ATOM 485 H TRP A 29 9.725 8.630 -9.514 1.00 0.00 H
+ATOM 486 HA TRP A 29 10.770 11.279 -9.491 1.00 0.00 H
+ATOM 487 1HB TRP A 29 9.170 10.566 -7.816 1.00 0.00 H
+ATOM 488 2HB TRP A 29 10.250 9.306 -7.239 1.00 0.00 H
+ATOM 489 HD1 TRP A 29 9.896 13.158 -7.246 1.00 0.00 H
+ATOM 490 HE1 TRP A 29 11.262 14.120 -5.272 1.00 0.00 H
+ATOM 491 HE3 TRP A 29 12.155 8.832 -5.669 1.00 0.00 H
+ATOM 492 HZ2 TRP A 29 13.051 13.148 -3.316 1.00 0.00 H
+ATOM 493 HZ3 TRP A 29 13.684 8.917 -3.741 1.00 0.00 H
+ATOM 494 HH2 TRP A 29 14.127 11.038 -2.576 1.00 0.00 H
+ATOM 495 N GLU A 30 12.854 8.923 -8.471 1.00 0.00 N
+ATOM 496 CA GLU A 30 14.255 8.634 -8.189 1.00 0.00 C
+ATOM 497 C GLU A 30 15.143 9.019 -9.365 1.00 0.00 C
+ATOM 498 O GLU A 30 16.234 9.560 -9.181 1.00 0.00 O
+ATOM 499 CB GLU A 30 14.439 7.151 -7.863 1.00 0.00 C
+ATOM 500 CG GLU A 30 13.901 6.735 -6.501 1.00 0.00 C
+ATOM 501 CD GLU A 30 14.103 5.274 -6.213 1.00 0.00 C
+ATOM 502 OE1 GLU A 30 14.506 4.563 -7.102 1.00 0.00 O
+ATOM 503 OE2 GLU A 30 13.854 4.868 -5.102 1.00 0.00 O
+ATOM 504 H GLU A 30 12.178 8.173 -8.426 1.00 0.00 H
+ATOM 505 HA GLU A 30 14.559 9.214 -7.317 1.00 0.00 H
+ATOM 506 1HB GLU A 30 13.937 6.547 -8.619 1.00 0.00 H
+ATOM 507 2HB GLU A 30 15.499 6.900 -7.894 1.00 0.00 H
+ATOM 508 1HG GLU A 30 14.404 7.319 -5.730 1.00 0.00 H
+ATOM 509 2HG GLU A 30 12.838 6.966 -6.456 1.00 0.00 H
+ATOM 510 N GLU A 31 14.671 8.738 -10.575 1.00 0.00 N
+ATOM 511 CA GLU A 31 15.424 9.049 -11.783 1.00 0.00 C
+ATOM 512 C GLU A 31 15.651 10.550 -11.919 1.00 0.00 C
+ATOM 513 O GLU A 31 16.710 10.988 -12.368 1.00 0.00 O
+ATOM 514 CB GLU A 31 14.692 8.521 -13.019 1.00 0.00 C
+ATOM 515 CG GLU A 31 14.694 7.005 -13.151 1.00 0.00 C
+ATOM 516 CD GLU A 31 13.852 6.515 -14.296 1.00 0.00 C
+ATOM 517 OE1 GLU A 31 13.271 7.330 -14.972 1.00 0.00 O
+ATOM 518 OE2 GLU A 31 13.790 5.325 -14.495 1.00 0.00 O
+ATOM 519 H GLU A 31 13.766 8.296 -10.659 1.00 0.00 H
+ATOM 520 HA GLU A 31 16.393 8.553 -11.725 1.00 0.00 H
+ATOM 521 1HB GLU A 31 13.654 8.853 -12.997 1.00 0.00 H
+ATOM 522 2HB GLU A 31 15.149 8.935 -13.918 1.00 0.00 H
+ATOM 523 1HG GLU A 31 15.719 6.665 -13.297 1.00 0.00 H
+ATOM 524 2HG GLU A 31 14.326 6.569 -12.223 1.00 0.00 H
+ATOM 525 N LYS A 32 14.651 11.332 -11.528 1.00 0.00 N
+ATOM 526 CA LYS A 32 14.731 12.785 -11.629 1.00 0.00 C
+ATOM 527 C LYS A 32 15.422 13.384 -10.411 1.00 0.00 C
+ATOM 528 O LYS A 32 16.092 14.412 -10.509 1.00 0.00 O
+ATOM 529 CB LYS A 32 13.334 13.387 -11.791 1.00 0.00 C
+ATOM 530 CG LYS A 32 12.658 13.060 -13.116 1.00 0.00 C
+ATOM 531 CD LYS A 32 11.265 13.668 -13.191 1.00 0.00 C
+ATOM 532 CE LYS A 32 10.584 13.331 -14.509 1.00 0.00 C
+ATOM 533 NZ LYS A 32 9.202 13.881 -14.577 1.00 0.00 N
+ATOM 534 H LYS A 32 13.815 10.910 -11.151 1.00 0.00 H
+ATOM 535 HA LYS A 32 15.308 13.039 -12.519 1.00 0.00 H
+ATOM 536 1HB LYS A 32 12.688 13.031 -10.989 1.00 0.00 H
+ATOM 537 2HB LYS A 32 13.394 14.473 -11.706 1.00 0.00 H
+ATOM 538 1HG LYS A 32 13.260 13.449 -13.938 1.00 0.00 H
+ATOM 539 2HG LYS A 32 12.580 11.979 -13.227 1.00 0.00 H
+ATOM 540 1HD LYS A 32 10.658 13.287 -12.369 1.00 0.00 H
+ATOM 541 2HD LYS A 32 11.336 14.751 -13.096 1.00 0.00 H
+ATOM 542 1HE LYS A 32 11.165 13.739 -15.334 1.00 0.00 H
+ATOM 543 2HE LYS A 32 10.536 12.249 -14.628 1.00 0.00 H
+ATOM 544 1HZ LYS A 32 8.786 13.636 -15.464 1.00 0.00 H
+ATOM 545 2HZ LYS A 32 8.648 13.493 -13.826 1.00 0.00 H
+ATOM 546 3HZ LYS A 32 9.235 14.886 -14.487 1.00 0.00 H
+ATOM 547 N ALA A 33 15.254 12.736 -9.263 1.00 0.00 N
+ATOM 548 CA ALA A 33 15.792 13.249 -8.009 1.00 0.00 C
+ATOM 549 C ALA A 33 17.311 13.143 -7.976 1.00 0.00 C
+ATOM 550 O ALA A 33 17.991 14.007 -7.423 1.00 0.00 O
+ATOM 551 CB ALA A 33 15.184 12.505 -6.829 1.00 0.00 C
+ATOM 552 H ALA A 33 14.742 11.866 -9.260 1.00 0.00 H
+ATOM 553 HA ALA A 33 15.512 14.299 -7.916 1.00 0.00 H
+ATOM 554 1HB ALA A 33 15.595 12.899 -5.899 1.00 0.00 H
+ATOM 555 2HB ALA A 33 14.102 12.638 -6.832 1.00 0.00 H
+ATOM 556 3HB ALA A 33 15.419 11.444 -6.908 1.00 0.00 H
+ATOM 557 N LYS A 34 17.838 12.079 -8.572 1.00 0.00 N
+ATOM 558 CA LYS A 34 19.277 11.844 -8.589 1.00 0.00 C
+ATOM 559 C LYS A 34 19.981 12.808 -9.535 1.00 0.00 C
+ATOM 560 O LYS A 34 19.407 13.246 -10.532 1.00 0.00 O
+ATOM 561 OXT LYS A 34 21.110 13.150 -9.312 1.00 0.00 O
+ATOM 562 CB LYS A 34 19.579 10.400 -8.989 1.00 0.00 C
+ATOM 563 CG LYS A 34 19.181 9.362 -7.948 1.00 0.00 C
+ATOM 564 CD LYS A 34 19.512 7.953 -8.417 1.00 0.00 C
+ATOM 565 CE LYS A 34 19.098 6.914 -7.386 1.00 0.00 C
+ATOM 566 NZ LYS A 34 19.414 5.530 -7.833 1.00 0.00 N
+ATOM 567 H LYS A 34 17.226 11.416 -9.025 1.00 0.00 H
+ATOM 568 HA LYS A 34 19.664 11.998 -7.581 1.00 0.00 H
+ATOM 569 1HB LYS A 34 19.056 10.162 -9.916 1.00 0.00 H
+ATOM 570 2HB LYS A 34 20.647 10.290 -9.179 1.00 0.00 H
+ATOM 571 1HG LYS A 34 19.711 9.559 -7.016 1.00 0.00 H
+ATOM 572 2HG LYS A 34 18.110 9.430 -7.758 1.00 0.00 H
+ATOM 573 1HD LYS A 34 18.992 7.750 -9.355 1.00 0.00 H
+ATOM 574 2HD LYS A 34 20.585 7.870 -8.592 1.00 0.00 H
+ATOM 575 1HE LYS A 34 19.616 7.106 -6.448 1.00 0.00 H
+ATOM 576 2HE LYS A 34 18.026 6.987 -7.205 1.00 0.00 H
+ATOM 577 1HZ LYS A 34 19.124 4.872 -7.123 1.00 0.00 H
+ATOM 578 2HZ LYS A 34 18.923 5.333 -8.694 1.00 0.00 H
+ATOM 579 3HZ LYS A 34 20.408 5.443 -7.985 1.00 0.00 H
+TER
+REMARK PDBinfo-LABEL: 18 DISULFIDIZE
+REMARK PDBinfo-LABEL: 20 DISULFIDIZE
+
+# All scores below are weighted scores, not raw scores.
+#BEGIN_POSE_ENERGIES_TABLE /home/job/save/disulfided_eeh_6.2.6.3.15_6_3_20200725010502.pdb
+label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro total
+weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1.25 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 NA
+pose -172.284 17.4977 141.059 -12.2557 4.698 8.32904 74.4262 -72.6715 -0.19868 -1.35339 -72.3032 -8.929 0 -16.2352 -8.28464 -0.75756 -9.29355 -0.03623 0.34649 2.45607 30.3399 27.3457 -6.91537 4.75186 -18.0535 -2.29104 -90.6121
+THR:NtermProteinFull_1 -3.19952 0.09824 3.26638 -0.18321 0.13061 0.06742 2.75201 -1.69068 -0.02173 -0.18117 -3.61958 -1.06691 0 0 0 0 -0.4045 0 -0.03959 0.00443 0.06876 0 0 2.42352 -1.0874 0 -2.6829
+THR_2 -3.62916 0.36987 1.58215 -0.17306 0.11754 0.06398 0.53275 -1.11282 -0.00792 -0.06357 -0.9388 0.40093 0 0 0 0 0 0 0.06417 0.002 0.14788 0 -0.119 2.32834 -1.0874 0.00238 -1.51974
+LEU_3 -6.31629 0.53308 2.97589 -0.48061 0.35523 0.09789 2.30165 -2.07755 -0.0039 -0.015 -2.40293 0.09869 0 0 0 0 0 0 -0.00593 0.16851 0.6787 0 -0.21793 0 0.18072 -0.15281 -4.28259
+ARG_4 -4.41588 0.42243 4.30986 -0.60699 0.08554 0.36194 2.02579 -1.84903 -0.00192 -0.00521 -3.13466 0.20944 0 0 0 -0.37878 -0.8753 0 0.00663 0.23414 2.57434 0 -0.13585 0 -1.2888 -0.20332 -2.66563
+ARG_5 -6.14042 0.75745 5.35209 -0.95466 0.38597 0.68564 3.15371 -2.37176 -0.00192 -0.00521 -2.66329 0.02609 0 0 0 -0.37878 0 0 -0.00822 0.0319 1.7941 0 -0.2316 0 -1.2888 -0.2204 -2.07812
+ARG_6 -4.58451 0.55051 3.55486 -0.71327 0.13178 0.46832 0.81432 -1.57121 -0 -0 -1.30922 0.44542 0 0 0 0 -0.45972 0 -0.02377 0.04188 2.30303 0 0.03773 0 -1.2888 -0.09408 -1.69674
+ILE_7 -7.37532 1.27911 2.97824 -0.48441 0.75023 0.10486 2.21807 -2.33377 -0.0033 -0.03162 -0.91983 -0.01957 0 0 0 0 0 0 -0.05256 0.11256 0.26675 0 -0.57223 0 0.73287 0.06496 -3.28497
+ASN_8 -2.21768 0.38178 2.06476 -0.19176 0.0393 0.32719 0.79136 -1.0984 -0.0177 -0.09116 -0.02077 -1.0055 0 0 0 0 0 0 0.23063 0.01252 0 1.86288 -0.98177 0 -0.93687 -0.26693 -1.11813
+GLY_9 -1.59012 0.20715 1.76826 -7e-05 0 0 0.29294 -0.84542 -0 -0 0.12008 -0.40554 0 0 0 0 0 0 -0.13654 0 0 0 -1.50325 0 0.83697 -0.6564 -1.91194
+GLU_10 -4.6807 0.65981 5.50616 -0.33071 0.08382 0.43976 2.78045 -2.50335 -0.00893 -0.0517 -3.28503 -0.40588 0 0 0 0 -0.45252 0 -0.0494 0.0689 0 3.06843 0.25331 0 -2.7348 -0.4406 -2.08296
+GLU_11 -4.3626 0.35033 4.55475 -0.28526 0.06313 0.33989 1.81216 -1.86257 -0 -0 -3.23637 -0.26471 0 0 0 0 -1.33503 0 0.14128 0.00965 0 3.04638 0.21926 0 -2.7348 -0.08002 -3.62452
+ILE_12 -6.61509 1.03182 2.32971 -0.5685 0.75022 0.11765 2.11453 -1.87775 -0.00562 -0.02008 -1.9097 0.07838 0 0 0 0 0 0 0.26892 0.05285 1.26531 0 -0.45769 0 0.73287 -0.11956 -2.83172
+GLU_13 -4.29381 0.24925 3.46284 -0.30297 0.06037 0.3537 1.30242 -1.517 -0.01028 -0.03838 -2.18271 -0.3379 0 0 0 0 -1.07617 0 0.02369 0.08599 0 3.40511 0.36131 0 -2.7348 -0.02589 -3.21524
+VAL_14 -7.07112 0.71628 2.36419 -0.27621 0.20546 0.06053 2.58392 -2.17094 -0 -0 -2.31247 -0.25048 0 0 0 0 0 0 -0.05874 0.03458 0.24672 0 -0.77346 0 1.9342 -0.19366 -4.9612
+ARG_15 -3.39073 0.23362 2.92809 -0.43771 0.06777 0.23295 1.53391 -1.31138 -0.01028 -0.03838 -2.41656 0.11979 0 0 0 0 -1.07617 0 0.05738 0.25645 2.44715 0 0.0035 0 -1.2888 -0.36209 -2.45151
+ALA_16 -3.49613 0.40979 2.34742 -0.01969 0 0 2.36888 -1.68117 -0.00991 -0.1026 -1.23517 -0.39633 0 0 0 0 0 0 0.01384 0 0 0 -0.52847 0 1.8394 -0.14 -0.63014
+ASP_17 -1.60514 0.11495 3.04195 -0.2292 0.03979 0.78118 1.44098 -1.21146 -0 -0 -2.70889 -2.81462 0 0 0 0 -0.54464 0 0.05633 0.48483 0 3.11291 -0.43402 0 -2.3716 -0.32366 -3.1703
+CYS:disulfide_18 -4.98839 0.6251 4.62938 -0.05791 0.00013 0.04115 2.52725 -2.30903 -0 -0 -1.27413 -0.48851 0 0 0 0 0 -0.01812 0.05799 8e-05 0.28574 0 -0.22012 0 3.6196 -0.26271 2.1675
+ASP_19 -3.859 0.19814 4.15587 -0.11494 0.01513 0.35677 2.04453 -1.96651 -0 -0 -2.56126 -0.30399 0 0 0 0 -0.4045 0 0.06349 0.05725 0 1.71162 0.03887 0 -2.3716 0.07334 -2.86679
+CYS:disulfide_20 -3.80376 0.7158 3.68249 -0.05009 0 0.02912 1.67183 -1.78424 -0 -0 -1.00738 -0.48053 0 0 0 0 0 -0.01812 0.00968 0.00317 2.12257 0 0.25117 0 3.6196 0.62475 5.58606
+LYS_21 -6.53698 0.66454 6.55469 -0.46569 0.17033 0.23662 3.48892 -3.016 -1e-05 -9e-05 -3.6176 0.10253 0 0 0 0 -0.54464 0 -0.02845 0.06164 2.7763 0 -0.07425 0 -1.5107 0.54096 -1.19789
+ALA_22 -5.87589 0.39698 3.24478 -0.02142 0 0 2.32227 -2.56198 -0 -0 -1.96643 -0.35182 0 0 0 0 0 0 -0.02592 0 0 0 -0.18237 0 1.8394 -0.01928 -3.20169
+LYS_23 -4.91536 0.30749 5.39169 -0.30336 0.02749 0.1351 2.53449 -2.52759 -0 -0 -2.57606 -0.03882 0 0 0 0 0 0 -0.01163 0.03339 1.834 0 -0.06234 0 -1.5107 -0.02037 -1.70258
+GLU_24 -5.09955 0.23469 6.33087 -0.33201 0.06508 0.38829 3.19978 -2.73679 -0 -0 -2.80773 -0.58934 0 0 0 0 -0.83392 0 -0.02175 0.00227 0 3.23025 -0.11481 0 -2.7348 -0.07833 -1.89781
+ILE_25 -5.71404 0.42233 4.11292 -0.51088 0.55705 0.10042 2.12134 -2.35964 -0 -0 -1.81983 0.0946 0 0 0 0 0 0 -0.06121 0.11203 0.54521 0 -0.47339 0 0.73287 0.16544 -1.97478
+MET_26 -10.4041 1.14297 5.72706 -0.67395 0.15738 0.36427 2.61297 -3.15563 -1e-05 -9e-05 -1.93392 -0.09861 0 0 0 0 0 0 -0.04365 0.13228 1.8588 0 0.03598 0 0.60916 0.34813 -3.321
+LYS_27 -5.4259 0.46753 7.55128 -0.49406 0.0919 0.37485 3.61128 -3.21362 -0.0171 -0.15092 -4.40505 0.19099 0 0 0 0 0 0 -0.00228 0.009 2.36483 0 0.05565 0 -1.5107 0.2388 -0.26352
+ARG_28 -5.34809 0.28019 6.60835 -0.62004 0.16472 0.34705 3.04265 -2.81499 -0.0212 -0.15587 -2.94104 0.28583 0 0 0 0 -0.83392 0 0.12147 0.17293 2.50765 0 -0.10534 0 -1.2888 0.11861 -0.47984
+TRP_29 -12.3885 1.67263 5.65831 -1.28326 0.06541 0.51433 3.74057 -3.93133 -4e-05 -0.00028 -3.7377 -0.36009 0 0 0 0 -0.45252 0 -0.02297 0.12606 0 1.78793 -0.26249 0 1.6906 0.16778 -7.01552
+GLU_30 -7.70017 0.8509 7.27826 -0.21478 0.02452 0.29028 3.25461 -3.37212 -0.0171 -0.15092 -2.72938 -0.5803 0 0 0 0 0 0 -0.03311 0.05927 0 3.06197 -0.20833 0 -2.7348 0.03055 -2.89062
+GLU_31 -4.24645 0.33866 6.20258 -0.21773 0.03099 0.31218 2.56986 -2.58181 -0.02162 -0.15779 -2.83825 -0.61727 0 0 0 0 0 0 -0.05629 0.02696 0 3.05823 -0.3078 0 -2.7348 -0.32718 -1.56751
+LYS_32 -2.98956 0.16104 3.78552 -0.30656 0.03183 0.14706 1.64207 -1.73548 -0 -0 -0.2137 -0.108 0 0 0 0 0 0 -0.04912 0.01636 1.99056 0 -0.16783 0 -1.5107 -0.30331 0.39018
+ALA_33 -4.42441 0.29529 2.01132 -0.0226 0 0 1.82012 -1.84901 -0 -0 -1.28684 -0.3617 0 0 0 0 0 0 -0.03791 0 0 0 -0.03782 0 1.8394 -0.22799 -2.28215
+LYS:CtermProteinFull_34 -3.57941 0.35794 3.7463 -0.32812 0.02928 0.18867 1.40178 -1.66948 -0.01817 -0.09335 -0.411 0.36477 0 0 0 0 0 0 0 0.04219 2.26152 0 0 0 -1.5107 -0.14817 0.63404
+#END_POSE_ENERGIES_TABLE /home/job/save/disulfided_eeh_6.2.6.3.15_6_3_20200725010502.pdb
+
+DisulfideBondEnergys -0.018115163726408617
+PHI 0.0,-116.63821011374696,-114.83732730021535,-134.1031005392073,-139.09371229478626,-127.54602543936112,-128.81433097959203,56.2451431378202,91.37997178656948,-94.86130929263787,-105.84772066812778,-127.00127105323052,-115.22846217305556,-117.64860832967956,-121.47627914339884,-156.20487916243798,-89.09876771814602,-142.0360155782893,-59.32541184333163,-57.58002352822367,-71.20814658332765,-61.28993194494623,-70.48449465275183,-61.29255116254377,-66.26121836552132,-64.31491453626067,-60.226911169060585,-59.89424172135268,-62.299111135225,-57.670532039696205,-62.12877210371428,-85.36526913232228,-70.6107366119782,-72.78514467128561
+PSI 122.75693841811994,126.63273074167982,143.70261051697346,131.42591958290086,147.40983282668452,120.2303507371417,123.2362255613792,35.68517029820566,-10.8144326286175,119.77964758467039,136.82129957646433,142.3878301907941,124.87919844923799,125.58486498318973,137.91707368759072,161.2577182163082,7.596673687426253,135.2623959214876,-33.97625448194287,-49.55239682391827,-41.01644682870198,-42.65422875218411,-41.35362801345881,-44.624322347398774,-46.55895940298892,-41.25690123521038,-46.41859582135083,-41.68632349562879,-46.91635418667933,-40.57342268087235,-37.18783609549461,-31.652595476897798,-35.481488737991704,0.0
+SSE LEEEEEELLEEEEEELLLHHHHHHHHHHHHHHHL
+AlaCount 3
+AverageDegree 12.5882
+BuriedUnsatHbond 1
+Buried_non_polar_SASA_per_res 41.3777
+CavityVolume 0
+CoreAverageDegree 16.0833
+CoreResidueCount 12
+ExposeCoreHydrophobicsPerCoreResidue 26.579
+ExposeCoreHydrophobicsSASA 318.943
+ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent 22.526
+ExposedHydrophobics_on_TotalSASAPercent 11.061
+HasCoreResidueNum 6
+PackStat 0.708799
+Rg 9.709
+SSShapeComplementarity 0.756724
+ScorePerResFilter -2.66506
+deltaS_conf_folding 2.76418
+driftRMSD 0.972025
+frac_helix 44.1176
+frac_loop 20.5882
+frac_sheet 35.2941
+n_hydrophobic 10
+netcharge 2
+nres_helix 15
+nres_loop 7
+nres_sheet 12
+nres_total 34
+ss_mismatch_probability 0.356122
+
diff --git a/8_Filter/data/ref_pose.pdb b/8_Filter/data/ref_pose.pdb
new file mode 100644
index 0000000..95c8416
--- /dev/null
+++ b/8_Filter/data/ref_pose.pdb
@@ -0,0 +1,636 @@
+HEADER 25-JUL-20 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 25-JUL-20
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2019.50+release.91b7a94
+SSBOND CYS A 3 CYS A 23 2.09
+SSBOND CYS A 18 CYS A 20 2.15
+ATOM 1 N GLY A 1 0.000 0.000 0.000 1.00 0.00 N
+ATOM 2 CA GLY A 1 1.458 0.000 0.000 1.00 0.00 C
+ATOM 3 C GLY A 1 2.009 1.420 0.000 1.00 0.00 C
+ATOM 4 O GLY A 1 1.484 2.300 -0.683 1.00 0.00 O
+ATOM 5 1H GLY A 1 -0.334 -0.943 -0.000 1.00 0.00 H
+ATOM 6 2H GLY A 1 -0.334 0.471 0.816 1.00 0.00 H
+ATOM 7 3H GLY A 1 -0.334 0.471 -0.816 1.00 0.00 H
+ATOM 8 1HA GLY A 1 1.822 -0.535 0.877 1.00 0.00 H
+ATOM 9 2HA GLY A 1 1.822 -0.535 -0.876 1.00 0.00 H
+ATOM 10 N GLU A 2 3.069 1.638 0.770 1.00 0.00 N
+ATOM 11 CA GLU A 2 3.722 2.940 0.824 1.00 0.00 C
+ATOM 12 C GLU A 2 5.235 2.804 0.700 1.00 0.00 C
+ATOM 13 O GLU A 2 5.834 1.891 1.269 1.00 0.00 O
+ATOM 14 CB GLU A 2 3.371 3.660 2.128 1.00 0.00 C
+ATOM 15 CG GLU A 2 3.965 5.056 2.256 1.00 0.00 C
+ATOM 16 CD GLU A 2 3.481 5.788 3.477 1.00 0.00 C
+ATOM 17 OE1 GLU A 2 2.680 5.240 4.196 1.00 0.00 O
+ATOM 18 OE2 GLU A 2 3.912 6.896 3.690 1.00 0.00 O
+ATOM 19 H GLU A 2 3.432 0.882 1.333 1.00 0.00 H
+ATOM 20 HA GLU A 2 3.357 3.546 -0.006 1.00 0.00 H
+ATOM 21 1HB GLU A 2 2.288 3.748 2.214 1.00 0.00 H
+ATOM 22 2HB GLU A 2 3.719 3.069 2.975 1.00 0.00 H
+ATOM 23 1HG GLU A 2 5.051 4.974 2.302 1.00 0.00 H
+ATOM 24 2HG GLU A 2 3.709 5.631 1.368 1.00 0.00 H
+ATOM 25 N CYS A 3 5.847 3.717 -0.047 1.00 0.00 N
+ATOM 26 CA CYS A 3 7.294 3.718 -0.221 1.00 0.00 C
+ATOM 27 C CYS A 3 7.862 5.126 -0.098 1.00 0.00 C
+ATOM 28 O CYS A 3 7.304 6.080 -0.641 1.00 0.00 O
+ATOM 29 CB CYS A 3 7.673 3.138 -1.584 1.00 0.00 C
+ATOM 30 SG CYS A 3 9.453 2.948 -1.837 1.00 0.00 S
+ATOM 31 H CYS A 3 5.295 4.427 -0.505 1.00 0.00 H
+ATOM 32 HA CYS A 3 7.737 3.096 0.557 1.00 0.00 H
+ATOM 33 1HB CYS A 3 7.208 2.160 -1.705 1.00 0.00 H
+ATOM 34 2HB CYS A 3 7.287 3.783 -2.373 1.00 0.00 H
+ATOM 35 N GLU A 4 8.975 5.250 0.617 1.00 0.00 N
+ATOM 36 CA GLU A 4 9.591 6.550 0.857 1.00 0.00 C
+ATOM 37 C GLU A 4 11.071 6.533 0.494 1.00 0.00 C
+ATOM 38 O GLU A 4 11.824 5.679 0.961 1.00 0.00 O
+ATOM 39 CB GLU A 4 9.420 6.960 2.321 1.00 0.00 C
+ATOM 40 CG GLU A 4 9.979 8.335 2.658 1.00 0.00 C
+ATOM 41 CD GLU A 4 9.797 8.702 4.105 1.00 0.00 C
+ATOM 42 OE1 GLU A 4 9.324 7.879 4.852 1.00 0.00 O
+ATOM 43 OE2 GLU A 4 10.131 9.806 4.463 1.00 0.00 O
+ATOM 44 H GLU A 4 9.404 4.423 1.006 1.00 0.00 H
+ATOM 45 HA GLU A 4 9.087 7.291 0.236 1.00 0.00 H
+ATOM 46 1HB GLU A 4 8.361 6.957 2.578 1.00 0.00 H
+ATOM 47 2HB GLU A 4 9.915 6.231 2.963 1.00 0.00 H
+ATOM 48 1HG GLU A 4 11.042 8.351 2.422 1.00 0.00 H
+ATOM 49 2HG GLU A 4 9.485 9.079 2.035 1.00 0.00 H
+ATOM 50 N ILE A 5 11.481 7.480 -0.342 1.00 0.00 N
+ATOM 51 CA ILE A 5 12.883 7.619 -0.714 1.00 0.00 C
+ATOM 52 C ILE A 5 13.421 8.993 -0.335 1.00 0.00 C
+ATOM 53 O ILE A 5 12.843 10.018 -0.697 1.00 0.00 O
+ATOM 54 CB ILE A 5 13.076 7.391 -2.225 1.00 0.00 C
+ATOM 55 CG1 ILE A 5 12.657 5.969 -2.608 1.00 0.00 C
+ATOM 56 CG2 ILE A 5 14.521 7.649 -2.622 1.00 0.00 C
+ATOM 57 CD1 ILE A 5 12.643 5.717 -4.098 1.00 0.00 C
+ATOM 58 H ILE A 5 10.803 8.121 -0.730 1.00 0.00 H
+ATOM 59 HA ILE A 5 13.459 6.860 -0.184 1.00 0.00 H
+ATOM 60 HB ILE A 5 12.430 8.070 -2.780 1.00 0.00 H
+ATOM 61 1HG1 ILE A 5 13.338 5.254 -2.147 1.00 0.00 H
+ATOM 62 2HG1 ILE A 5 11.659 5.767 -2.219 1.00 0.00 H
+ATOM 63 1HG2 ILE A 5 14.640 7.483 -3.692 1.00 0.00 H
+ATOM 64 2HG2 ILE A 5 14.785 8.679 -2.383 1.00 0.00 H
+ATOM 65 3HG2 ILE A 5 15.176 6.971 -2.075 1.00 0.00 H
+ATOM 66 1HD1 ILE A 5 12.336 4.689 -4.291 1.00 0.00 H
+ATOM 67 2HD1 ILE A 5 11.940 6.401 -4.576 1.00 0.00 H
+ATOM 68 3HD1 ILE A 5 13.641 5.880 -4.504 1.00 0.00 H
+ATOM 69 N ARG A 6 14.530 9.008 0.396 1.00 0.00 N
+ATOM 70 CA ARG A 6 15.132 10.256 0.850 1.00 0.00 C
+ATOM 71 C ARG A 6 16.512 10.457 0.236 1.00 0.00 C
+ATOM 72 O ARG A 6 17.488 9.839 0.663 1.00 0.00 O
+ATOM 73 CB ARG A 6 15.247 10.274 2.367 1.00 0.00 C
+ATOM 74 CG ARG A 6 13.922 10.213 3.110 1.00 0.00 C
+ATOM 75 CD ARG A 6 14.112 10.309 4.580 1.00 0.00 C
+ATOM 76 NE ARG A 6 12.847 10.244 5.295 1.00 0.00 N
+ATOM 77 CZ ARG A 6 12.718 10.353 6.631 1.00 0.00 C
+ATOM 78 NH1 ARG A 6 13.782 10.530 7.383 1.00 0.00 N
+ATOM 79 NH2 ARG A 6 11.521 10.280 7.188 1.00 0.00 N
+ATOM 80 H ARG A 6 14.968 8.132 0.643 1.00 0.00 H
+ATOM 81 HA ARG A 6 14.489 11.082 0.543 1.00 0.00 H
+ATOM 82 1HB ARG A 6 15.849 9.428 2.696 1.00 0.00 H
+ATOM 83 2HB ARG A 6 15.761 11.182 2.682 1.00 0.00 H
+ATOM 84 1HG ARG A 6 13.288 11.041 2.791 1.00 0.00 H
+ATOM 85 2HG ARG A 6 13.424 9.269 2.889 1.00 0.00 H
+ATOM 86 1HD ARG A 6 14.738 9.485 4.920 1.00 0.00 H
+ATOM 87 2HD ARG A 6 14.593 11.255 4.824 1.00 0.00 H
+ATOM 88 HE ARG A 6 12.006 10.108 4.751 1.00 0.00 H
+ATOM 89 1HH1 ARG A 6 14.697 10.585 6.957 1.00 0.00 H
+ATOM 90 2HH1 ARG A 6 13.685 10.612 8.384 1.00 0.00 H
+ATOM 91 1HH2 ARG A 6 10.703 10.144 6.610 1.00 0.00 H
+ATOM 92 2HH2 ARG A 6 11.424 10.362 8.189 1.00 0.00 H
+ATOM 93 N ARG A 7 16.587 11.324 -0.767 1.00 0.00 N
+ATOM 94 CA ARG A 7 17.815 11.506 -1.533 1.00 0.00 C
+ATOM 95 C ARG A 7 18.017 12.967 -1.910 1.00 0.00 C
+ATOM 96 O ARG A 7 17.059 13.679 -2.211 1.00 0.00 O
+ATOM 97 CB ARG A 7 17.789 10.658 -2.796 1.00 0.00 C
+ATOM 98 CG ARG A 7 17.796 9.156 -2.558 1.00 0.00 C
+ATOM 99 CD ARG A 7 19.114 8.685 -2.062 1.00 0.00 C
+ATOM 100 NE ARG A 7 19.169 7.235 -1.960 1.00 0.00 N
+ATOM 101 CZ ARG A 7 18.743 6.527 -0.896 1.00 0.00 C
+ATOM 102 NH1 ARG A 7 18.235 7.147 0.146 1.00 0.00 N
+ATOM 103 NH2 ARG A 7 18.835 5.208 -0.900 1.00 0.00 N
+ATOM 104 H ARG A 7 15.773 11.872 -1.006 1.00 0.00 H
+ATOM 105 HA ARG A 7 18.656 11.183 -0.919 1.00 0.00 H
+ATOM 106 1HB ARG A 7 16.898 10.895 -3.375 1.00 0.00 H
+ATOM 107 2HB ARG A 7 18.654 10.898 -3.413 1.00 0.00 H
+ATOM 108 1HG ARG A 7 17.039 8.901 -1.816 1.00 0.00 H
+ATOM 109 2HG ARG A 7 17.576 8.638 -3.493 1.00 0.00 H
+ATOM 110 1HD ARG A 7 19.897 9.008 -2.748 1.00 0.00 H
+ATOM 111 2HD ARG A 7 19.302 9.103 -1.074 1.00 0.00 H
+ATOM 112 HE ARG A 7 19.553 6.723 -2.743 1.00 0.00 H
+ATOM 113 1HH1 ARG A 7 18.164 8.155 0.149 1.00 0.00 H
+ATOM 114 2HH1 ARG A 7 17.916 6.616 0.943 1.00 0.00 H
+ATOM 115 1HH2 ARG A 7 19.226 4.731 -1.702 1.00 0.00 H
+ATOM 116 2HH2 ARG A 7 18.516 4.678 -0.103 1.00 0.00 H
+ATOM 117 N LYS A 8 19.270 13.410 -1.892 1.00 0.00 N
+ATOM 118 CA LYS A 8 19.613 14.757 -2.333 1.00 0.00 C
+ATOM 119 C LYS A 8 18.934 15.809 -1.466 1.00 0.00 C
+ATOM 120 O LYS A 8 18.684 16.929 -1.914 1.00 0.00 O
+ATOM 121 CB LYS A 8 19.229 14.955 -3.800 1.00 0.00 C
+ATOM 122 CG LYS A 8 19.811 13.916 -4.749 1.00 0.00 C
+ATOM 123 CD LYS A 8 19.564 14.294 -6.201 1.00 0.00 C
+ATOM 124 CE LYS A 8 20.041 13.202 -7.147 1.00 0.00 C
+ATOM 125 NZ LYS A 8 19.933 13.614 -8.573 1.00 0.00 N
+ATOM 126 H LYS A 8 20.003 12.797 -1.565 1.00 0.00 H
+ATOM 127 HA LYS A 8 20.694 14.882 -2.253 1.00 0.00 H
+ATOM 128 1HB LYS A 8 18.143 14.928 -3.898 1.00 0.00 H
+ATOM 129 2HB LYS A 8 19.563 15.938 -4.134 1.00 0.00 H
+ATOM 130 1HG LYS A 8 20.885 13.831 -4.581 1.00 0.00 H
+ATOM 131 2HG LYS A 8 19.353 12.947 -4.552 1.00 0.00 H
+ATOM 132 1HD LYS A 8 18.498 14.460 -6.359 1.00 0.00 H
+ATOM 133 2HD LYS A 8 20.095 15.218 -6.432 1.00 0.00 H
+ATOM 134 1HE LYS A 8 21.080 12.961 -6.930 1.00 0.00 H
+ATOM 135 2HE LYS A 8 19.443 12.303 -6.996 1.00 0.00 H
+ATOM 136 1HZ LYS A 8 20.257 12.864 -9.167 1.00 0.00 H
+ATOM 137 2HZ LYS A 8 18.968 13.823 -8.792 1.00 0.00 H
+ATOM 138 3HZ LYS A 8 20.498 14.436 -8.730 1.00 0.00 H
+ATOM 139 N GLY A 9 18.637 15.444 -0.224 1.00 0.00 N
+ATOM 140 CA GLY A 9 18.100 16.391 0.746 1.00 0.00 C
+ATOM 141 C GLY A 9 16.587 16.514 0.617 1.00 0.00 C
+ATOM 142 O GLY A 9 15.954 17.287 1.335 1.00 0.00 O
+ATOM 143 H GLY A 9 18.787 14.485 0.056 1.00 0.00 H
+ATOM 144 1HA GLY A 9 18.358 16.066 1.754 1.00 0.00 H
+ATOM 145 2HA GLY A 9 18.562 17.367 0.595 1.00 0.00 H
+ATOM 146 N MET A 10 16.013 15.746 -0.303 1.00 0.00 N
+ATOM 147 CA MET A 10 14.581 15.809 -0.568 1.00 0.00 C
+ATOM 148 C MET A 10 13.901 14.486 -0.241 1.00 0.00 C
+ATOM 149 O MET A 10 14.448 13.415 -0.502 1.00 0.00 O
+ATOM 150 CB MET A 10 14.331 16.191 -2.026 1.00 0.00 C
+ATOM 151 CG MET A 10 14.879 17.555 -2.422 1.00 0.00 C
+ATOM 152 SD MET A 10 14.660 17.908 -4.178 1.00 0.00 S
+ATOM 153 CE MET A 10 15.925 16.862 -4.894 1.00 0.00 C
+ATOM 154 H MET A 10 16.583 15.101 -0.832 1.00 0.00 H
+ATOM 155 HA MET A 10 14.147 16.589 0.058 1.00 0.00 H
+ATOM 156 1HB MET A 10 14.783 15.447 -2.679 1.00 0.00 H
+ATOM 157 2HB MET A 10 13.258 16.192 -2.223 1.00 0.00 H
+ATOM 158 1HG MET A 10 14.374 18.331 -1.849 1.00 0.00 H
+ATOM 159 2HG MET A 10 15.943 17.600 -2.192 1.00 0.00 H
+ATOM 160 1HE MET A 10 15.915 16.970 -5.978 1.00 0.00 H
+ATOM 161 2HE MET A 10 16.902 17.156 -4.507 1.00 0.00 H
+ATOM 162 3HE MET A 10 15.729 15.822 -4.631 1.00 0.00 H
+ATOM 163 N THR A 11 12.704 14.567 0.331 1.00 0.00 N
+ATOM 164 CA THR A 11 11.927 13.376 0.653 1.00 0.00 C
+ATOM 165 C THR A 11 10.770 13.194 -0.321 1.00 0.00 C
+ATOM 166 O THR A 11 9.937 14.086 -0.483 1.00 0.00 O
+ATOM 167 CB THR A 11 11.386 13.440 2.093 1.00 0.00 C
+ATOM 168 OG1 THR A 11 12.481 13.504 3.016 1.00 0.00 O
+ATOM 169 CG2 THR A 11 10.541 12.213 2.400 1.00 0.00 C
+ATOM 170 H THR A 11 12.324 15.477 0.549 1.00 0.00 H
+ATOM 171 HA THR A 11 12.581 12.506 0.584 1.00 0.00 H
+ATOM 172 HB THR A 11 10.775 14.334 2.213 1.00 0.00 H
+ATOM 173 HG1 THR A 11 12.927 14.349 2.924 1.00 0.00 H
+ATOM 174 1HG2 THR A 11 10.167 12.275 3.422 1.00 0.00 H
+ATOM 175 2HG2 THR A 11 9.700 12.168 1.708 1.00 0.00 H
+ATOM 176 3HG2 THR A 11 11.149 11.316 2.291 1.00 0.00 H
+ATOM 177 N PHE A 12 10.723 12.034 -0.967 1.00 0.00 N
+ATOM 178 CA PHE A 12 9.650 11.721 -1.903 1.00 0.00 C
+ATOM 179 C PHE A 12 8.926 10.442 -1.504 1.00 0.00 C
+ATOM 180 O PHE A 12 9.512 9.359 -1.507 1.00 0.00 O
+ATOM 181 CB PHE A 12 10.205 11.578 -3.322 1.00 0.00 C
+ATOM 182 CG PHE A 12 10.845 12.829 -3.852 1.00 0.00 C
+ATOM 183 CD1 PHE A 12 12.215 13.018 -3.756 1.00 0.00 C
+ATOM 184 CD2 PHE A 12 10.078 13.820 -4.447 1.00 0.00 C
+ATOM 185 CE1 PHE A 12 12.805 14.169 -4.243 1.00 0.00 C
+ATOM 186 CE2 PHE A 12 10.665 14.970 -4.936 1.00 0.00 C
+ATOM 187 CZ PHE A 12 12.031 15.145 -4.833 1.00 0.00 C
+ATOM 188 H PHE A 12 11.450 11.351 -0.805 1.00 0.00 H
+ATOM 189 HA PHE A 12 8.935 12.544 -1.898 1.00 0.00 H
+ATOM 190 1HB PHE A 12 10.947 10.781 -3.343 1.00 0.00 H
+ATOM 191 2HB PHE A 12 9.400 11.294 -3.999 1.00 0.00 H
+ATOM 192 HD1 PHE A 12 12.828 12.246 -3.290 1.00 0.00 H
+ATOM 193 HD2 PHE A 12 8.999 13.681 -4.527 1.00 0.00 H
+ATOM 194 HE1 PHE A 12 13.883 14.305 -4.161 1.00 0.00 H
+ATOM 195 HE2 PHE A 12 10.051 15.741 -5.402 1.00 0.00 H
+ATOM 196 HZ PHE A 12 12.495 16.053 -5.216 1.00 0.00 H
+ATOM 197 N ARG A 13 7.650 10.573 -1.160 1.00 0.00 N
+ATOM 198 CA ARG A 13 6.840 9.427 -0.765 1.00 0.00 C
+ATOM 199 C ARG A 13 5.641 9.255 -1.688 1.00 0.00 C
+ATOM 200 O ARG A 13 5.141 10.224 -2.259 1.00 0.00 O
+ATOM 201 CB ARG A 13 6.355 9.582 0.668 1.00 0.00 C
+ATOM 202 CG ARG A 13 5.427 10.763 0.905 1.00 0.00 C
+ATOM 203 CD ARG A 13 5.003 10.852 2.325 1.00 0.00 C
+ATOM 204 NE ARG A 13 4.057 9.806 2.676 1.00 0.00 N
+ATOM 205 CZ ARG A 13 2.724 9.886 2.494 1.00 0.00 C
+ATOM 206 NH1 ARG A 13 2.197 10.968 1.965 1.00 0.00 N
+ATOM 207 NH2 ARG A 13 1.947 8.877 2.847 1.00 0.00 N
+ATOM 208 H ARG A 13 7.229 11.491 -1.173 1.00 0.00 H
+ATOM 209 HA ARG A 13 7.459 8.530 -0.824 1.00 0.00 H
+ATOM 210 1HB ARG A 13 5.826 8.680 0.973 1.00 0.00 H
+ATOM 211 2HB ARG A 13 7.212 9.698 1.332 1.00 0.00 H
+ATOM 212 1HG ARG A 13 5.940 11.688 0.641 1.00 0.00 H
+ATOM 213 2HG ARG A 13 4.534 10.654 0.287 1.00 0.00 H
+ATOM 214 1HD ARG A 13 5.874 10.754 2.972 1.00 0.00 H
+ATOM 215 2HD ARG A 13 4.526 11.816 2.503 1.00 0.00 H
+ATOM 216 HE ARG A 13 4.424 8.957 3.086 1.00 0.00 H
+ATOM 217 1HH1 ARG A 13 2.792 11.739 1.695 1.00 0.00 H
+ATOM 218 2HH1 ARG A 13 1.199 11.029 1.828 1.00 0.00 H
+ATOM 219 1HH2 ARG A 13 2.352 8.045 3.254 1.00 0.00 H
+ATOM 220 2HH2 ARG A 13 0.949 8.938 2.710 1.00 0.00 H
+ATOM 221 N PHE A 14 5.184 8.015 -1.831 1.00 0.00 N
+ATOM 222 CA PHE A 14 4.020 7.719 -2.658 1.00 0.00 C
+ATOM 223 C PHE A 14 3.229 6.545 -2.095 1.00 0.00 C
+ATOM 224 O PHE A 14 3.800 5.616 -1.523 1.00 0.00 O
+ATOM 225 CB PHE A 14 4.449 7.409 -4.093 1.00 0.00 C
+ATOM 226 CG PHE A 14 3.347 7.566 -5.102 1.00 0.00 C
+ATOM 227 CD1 PHE A 14 3.110 8.792 -5.706 1.00 0.00 C
+ATOM 228 CD2 PHE A 14 2.545 6.490 -5.449 1.00 0.00 C
+ATOM 229 CE1 PHE A 14 2.096 8.938 -6.635 1.00 0.00 C
+ATOM 230 CE2 PHE A 14 1.532 6.632 -6.377 1.00 0.00 C
+ATOM 231 CZ PHE A 14 1.308 7.859 -6.970 1.00 0.00 C
+ATOM 232 H PHE A 14 5.655 7.259 -1.355 1.00 0.00 H
+ATOM 233 HA PHE A 14 3.375 8.598 -2.676 1.00 0.00 H
+ATOM 234 1HB PHE A 14 5.268 8.068 -4.378 1.00 0.00 H
+ATOM 235 2HB PHE A 14 4.818 6.386 -4.150 1.00 0.00 H
+ATOM 236 HD1 PHE A 14 3.734 9.646 -5.441 1.00 0.00 H
+ATOM 237 HD2 PHE A 14 2.722 5.521 -4.980 1.00 0.00 H
+ATOM 238 HE1 PHE A 14 1.921 9.907 -7.101 1.00 0.00 H
+ATOM 239 HE2 PHE A 14 0.909 5.778 -6.642 1.00 0.00 H
+ATOM 240 HZ PHE A 14 0.508 7.973 -7.701 1.00 0.00 H
+ATOM 241 N THR A 15 1.911 6.593 -2.259 1.00 0.00 N
+ATOM 242 CA THR A 15 1.048 5.491 -1.852 1.00 0.00 C
+ATOM 243 C THR A 15 0.358 4.858 -3.053 1.00 0.00 C
+ATOM 244 O THR A 15 -0.129 5.558 -3.941 1.00 0.00 O
+ATOM 245 CB THR A 15 -0.010 5.962 -0.837 1.00 0.00 C
+ATOM 246 OG1 THR A 15 -0.794 7.014 -1.413 1.00 0.00 O
+ATOM 247 CG2 THR A 15 0.657 6.468 0.433 1.00 0.00 C
+ATOM 248 H THR A 15 1.497 7.414 -2.677 1.00 0.00 H
+ATOM 249 HA THR A 15 1.661 4.734 -1.362 1.00 0.00 H
+ATOM 250 HB THR A 15 -0.670 5.131 -0.587 1.00 0.00 H
+ATOM 251 HG1 THR A 15 -1.308 6.666 -2.146 1.00 0.00 H
+ATOM 252 1HG2 THR A 15 -0.106 6.796 1.139 1.00 0.00 H
+ATOM 253 2HG2 THR A 15 1.244 5.666 0.880 1.00 0.00 H
+ATOM 254 3HG2 THR A 15 1.311 7.305 0.191 1.00 0.00 H
+ATOM 255 N ALA A 16 0.320 3.530 -3.076 1.00 0.00 N
+ATOM 256 CA ALA A 16 -0.215 2.798 -4.218 1.00 0.00 C
+ATOM 257 C ALA A 16 -0.723 1.424 -3.802 1.00 0.00 C
+ATOM 258 O ALA A 16 -0.518 0.993 -2.667 1.00 0.00 O
+ATOM 259 CB ALA A 16 0.841 2.665 -5.304 1.00 0.00 C
+ATOM 260 H ALA A 16 0.670 3.014 -2.281 1.00 0.00 H
+ATOM 261 HA ALA A 16 -1.061 3.361 -4.614 1.00 0.00 H
+ATOM 262 1HB ALA A 16 0.427 2.117 -6.150 1.00 0.00 H
+ATOM 263 2HB ALA A 16 1.153 3.657 -5.633 1.00 0.00 H
+ATOM 264 3HB ALA A 16 1.702 2.127 -4.910 1.00 0.00 H
+ATOM 265 N GLU A 17 -1.388 0.739 -4.727 1.00 0.00 N
+ATOM 266 CA GLU A 17 -1.826 -0.632 -4.498 1.00 0.00 C
+ATOM 267 C GLU A 17 -0.638 -1.578 -4.379 1.00 0.00 C
+ATOM 268 O GLU A 17 -0.777 -2.710 -3.915 1.00 0.00 O
+ATOM 269 CB GLU A 17 -2.746 -1.094 -5.630 1.00 0.00 C
+ATOM 270 CG GLU A 17 -2.057 -1.245 -6.979 1.00 0.00 C
+ATOM 271 CD GLU A 17 -2.022 0.037 -7.764 1.00 0.00 C
+ATOM 272 OE1 GLU A 17 -2.153 1.080 -7.169 1.00 0.00 O
+ATOM 273 OE2 GLU A 17 -1.864 -0.027 -8.960 1.00 0.00 O
+ATOM 274 H GLU A 17 -1.594 1.181 -5.612 1.00 0.00 H
+ATOM 275 HA GLU A 17 -2.393 -0.663 -3.566 1.00 0.00 H
+ATOM 276 1HB GLU A 17 -3.187 -2.057 -5.370 1.00 0.00 H
+ATOM 277 2HB GLU A 17 -3.563 -0.382 -5.749 1.00 0.00 H
+ATOM 278 1HG GLU A 17 -1.035 -1.586 -6.817 1.00 0.00 H
+ATOM 279 2HG GLU A 17 -2.577 -2.006 -7.558 1.00 0.00 H
+ATOM 280 N CYS A 18 0.531 -1.106 -4.799 1.00 0.00 N
+ATOM 281 CA CYS A 18 1.752 -1.900 -4.716 1.00 0.00 C
+ATOM 282 C CYS A 18 2.949 -1.031 -4.352 1.00 0.00 C
+ATOM 283 O CYS A 18 3.127 0.058 -4.898 1.00 0.00 O
+ATOM 284 CB CYS A 18 2.026 -2.606 -6.044 1.00 0.00 C
+ATOM 285 SG CYS A 18 3.524 -3.620 -6.046 1.00 0.00 S
+ATOM 286 H CYS A 18 0.575 -0.175 -5.187 1.00 0.00 H
+ATOM 287 HA CYS A 18 1.621 -2.655 -3.941 1.00 0.00 H
+ATOM 288 1HB CYS A 18 1.183 -3.250 -6.294 1.00 0.00 H
+ATOM 289 2HB CYS A 18 2.119 -1.865 -6.838 1.00 0.00 H
+ATOM 290 N GLU A 19 3.768 -1.520 -3.427 1.00 0.00 N
+ATOM 291 CA GLU A 19 4.998 -0.832 -3.052 1.00 0.00 C
+ATOM 292 C GLU A 19 5.924 -0.668 -4.251 1.00 0.00 C
+ATOM 293 O GLU A 19 6.609 0.346 -4.384 1.00 0.00 O
+ATOM 294 CB GLU A 19 5.719 -1.596 -1.939 1.00 0.00 C
+ATOM 295 CG GLU A 19 5.008 -1.566 -0.594 1.00 0.00 C
+ATOM 296 CD GLU A 19 3.852 -2.525 -0.522 1.00 0.00 C
+ATOM 297 OE1 GLU A 19 3.648 -3.252 -1.464 1.00 0.00 O
+ATOM 298 OE2 GLU A 19 3.172 -2.530 0.477 1.00 0.00 O
+ATOM 299 H GLU A 19 3.533 -2.390 -2.971 1.00 0.00 H
+ATOM 300 HA GLU A 19 4.740 0.157 -2.672 1.00 0.00 H
+ATOM 301 1HB GLU A 19 5.837 -2.639 -2.232 1.00 0.00 H
+ATOM 302 2HB GLU A 19 6.717 -1.180 -1.799 1.00 0.00 H
+ATOM 303 1HG GLU A 19 5.723 -1.817 0.189 1.00 0.00 H
+ATOM 304 2HG GLU A 19 4.647 -0.555 -0.408 1.00 0.00 H
+ATOM 305 N CYS A 20 5.941 -1.672 -5.121 1.00 0.00 N
+ATOM 306 CA CYS A 20 6.727 -1.610 -6.347 1.00 0.00 C
+ATOM 307 C CYS A 20 6.433 -0.334 -7.126 1.00 0.00 C
+ATOM 308 O CYS A 20 7.347 0.338 -7.603 1.00 0.00 O
+ATOM 309 CB CYS A 20 6.437 -2.821 -7.234 1.00 0.00 C
+ATOM 310 SG CYS A 20 4.703 -2.979 -7.725 1.00 0.00 S
+ATOM 311 H CYS A 20 5.396 -2.500 -4.928 1.00 0.00 H
+ATOM 312 HA CYS A 20 7.784 -1.619 -6.082 1.00 0.00 H
+ATOM 313 1HB CYS A 20 7.040 -2.761 -8.141 1.00 0.00 H
+ATOM 314 2HB CYS A 20 6.723 -3.733 -6.710 1.00 0.00 H
+ATOM 315 N LYS A 21 5.151 -0.007 -7.252 1.00 0.00 N
+ATOM 316 CA LYS A 21 4.733 1.180 -7.989 1.00 0.00 C
+ATOM 317 C LYS A 21 5.021 2.450 -7.199 1.00 0.00 C
+ATOM 318 O LYS A 21 5.425 3.466 -7.764 1.00 0.00 O
+ATOM 319 CB LYS A 21 3.244 1.100 -8.332 1.00 0.00 C
+ATOM 320 CG LYS A 21 2.894 0.047 -9.375 1.00 0.00 C
+ATOM 321 CD LYS A 21 1.414 0.087 -9.725 1.00 0.00 C
+ATOM 322 CE LYS A 21 1.032 -1.059 -10.650 1.00 0.00 C
+ATOM 323 NZ LYS A 21 -0.391 -0.979 -11.077 1.00 0.00 N
+ATOM 324 H LYS A 21 4.449 -0.594 -6.826 1.00 0.00 H
+ATOM 325 HA LYS A 21 5.288 1.218 -8.927 1.00 0.00 H
+ATOM 326 1HB LYS A 21 2.674 0.879 -7.429 1.00 0.00 H
+ATOM 327 2HB LYS A 21 2.904 2.066 -8.705 1.00 0.00 H
+ATOM 328 1HG LYS A 21 3.478 0.222 -10.279 1.00 0.00 H
+ATOM 329 2HG LYS A 21 3.140 -0.942 -8.990 1.00 0.00 H
+ATOM 330 1HD LYS A 21 0.821 0.020 -8.812 1.00 0.00 H
+ATOM 331 2HD LYS A 21 1.183 1.031 -10.219 1.00 0.00 H
+ATOM 332 1HE LYS A 21 1.666 -1.040 -11.535 1.00 0.00 H
+ATOM 333 2HE LYS A 21 1.191 -2.008 -10.137 1.00 0.00 H
+ATOM 334 1HZ LYS A 21 -0.604 -1.756 -11.687 1.00 0.00 H
+ATOM 335 2HZ LYS A 21 -0.990 -1.016 -10.264 1.00 0.00 H
+ATOM 336 3HZ LYS A 21 -0.547 -0.112 -11.570 1.00 0.00 H
+ATOM 337 N ALA A 22 4.811 2.385 -5.888 1.00 0.00 N
+ATOM 338 CA ALA A 22 5.045 3.531 -5.018 1.00 0.00 C
+ATOM 339 C ALA A 22 6.508 3.955 -5.047 1.00 0.00 C
+ATOM 340 O ALA A 22 6.819 5.146 -5.073 1.00 0.00 O
+ATOM 341 CB ALA A 22 4.615 3.212 -3.594 1.00 0.00 C
+ATOM 342 H ALA A 22 4.481 1.520 -5.485 1.00 0.00 H
+ATOM 343 HA ALA A 22 4.433 4.363 -5.369 1.00 0.00 H
+ATOM 344 1HB ALA A 22 4.796 4.077 -2.956 1.00 0.00 H
+ATOM 345 2HB ALA A 22 3.553 2.967 -3.581 1.00 0.00 H
+ATOM 346 3HB ALA A 22 5.187 2.362 -3.223 1.00 0.00 H
+ATOM 347 N CYS A 23 7.403 2.973 -5.042 1.00 0.00 N
+ATOM 348 CA CYS A 23 8.836 3.242 -5.085 1.00 0.00 C
+ATOM 349 C CYS A 23 9.244 3.843 -6.423 1.00 0.00 C
+ATOM 350 O CYS A 23 10.062 4.761 -6.479 1.00 0.00 O
+ATOM 351 CB CYS A 23 9.631 1.959 -4.845 1.00 0.00 C
+ATOM 352 SG CYS A 23 9.521 1.327 -3.153 1.00 0.00 S
+ATOM 353 H CYS A 23 7.083 2.016 -5.007 1.00 0.00 H
+ATOM 354 HA CYS A 23 9.078 3.954 -4.295 1.00 0.00 H
+ATOM 355 1HB CYS A 23 9.278 1.179 -5.520 1.00 0.00 H
+ATOM 356 2HB CYS A 23 10.683 2.135 -5.071 1.00 0.00 H
+ATOM 357 N GLU A 24 8.668 3.321 -7.501 1.00 0.00 N
+ATOM 358 CA GLU A 24 8.916 3.852 -8.836 1.00 0.00 C
+ATOM 359 C GLU A 24 8.460 5.301 -8.946 1.00 0.00 C
+ATOM 360 O GLU A 24 9.157 6.139 -9.517 1.00 0.00 O
+ATOM 361 CB GLU A 24 8.204 3.001 -9.889 1.00 0.00 C
+ATOM 362 CG GLU A 24 8.335 3.522 -11.313 1.00 0.00 C
+ATOM 363 CD GLU A 24 9.744 3.451 -11.834 1.00 0.00 C
+ATOM 364 OE1 GLU A 24 10.515 2.687 -11.306 1.00 0.00 O
+ATOM 365 OE2 GLU A 24 10.049 4.162 -12.763 1.00 0.00 O
+ATOM 366 H GLU A 24 8.042 2.535 -7.392 1.00 0.00 H
+ATOM 367 HA GLU A 24 9.988 3.807 -9.032 1.00 0.00 H
+ATOM 368 1HB GLU A 24 8.601 1.986 -9.867 1.00 0.00 H
+ATOM 369 2HB GLU A 24 7.141 2.942 -9.652 1.00 0.00 H
+ATOM 370 1HG GLU A 24 7.689 2.936 -11.965 1.00 0.00 H
+ATOM 371 2HG GLU A 24 7.994 4.556 -11.343 1.00 0.00 H
+ATOM 372 N ALA A 25 7.285 5.589 -8.396 1.00 0.00 N
+ATOM 373 CA ALA A 25 6.755 6.947 -8.391 1.00 0.00 C
+ATOM 374 C ALA A 25 7.661 7.889 -7.607 1.00 0.00 C
+ATOM 375 O ALA A 25 7.910 9.019 -8.028 1.00 0.00 O
+ATOM 376 CB ALA A 25 5.348 6.964 -7.812 1.00 0.00 C
+ATOM 377 H ALA A 25 6.746 4.849 -7.971 1.00 0.00 H
+ATOM 378 HA ALA A 25 6.693 7.299 -9.421 1.00 0.00 H
+ATOM 379 1HB ALA A 25 4.966 7.985 -7.815 1.00 0.00 H
+ATOM 380 2HB ALA A 25 4.698 6.332 -8.418 1.00 0.00 H
+ATOM 381 3HB ALA A 25 5.370 6.588 -6.791 1.00 0.00 H
+ATOM 382 N ALA A 26 8.150 7.417 -6.466 1.00 0.00 N
+ATOM 383 CA ALA A 26 9.066 8.199 -5.644 1.00 0.00 C
+ATOM 384 C ALA A 26 10.369 8.477 -6.382 1.00 0.00 C
+ATOM 385 O ALA A 26 10.923 9.573 -6.295 1.00 0.00 O
+ATOM 386 CB ALA A 26 9.345 7.482 -4.331 1.00 0.00 C
+ATOM 387 H ALA A 26 7.881 6.493 -6.159 1.00 0.00 H
+ATOM 388 HA ALA A 26 8.590 9.151 -5.405 1.00 0.00 H
+ATOM 389 1HB ALA A 26 10.030 8.078 -3.729 1.00 0.00 H
+ATOM 390 2HB ALA A 26 8.410 7.342 -3.787 1.00 0.00 H
+ATOM 391 3HB ALA A 26 9.793 6.511 -4.536 1.00 0.00 H
+ATOM 392 N ARG A 27 10.856 7.477 -7.110 1.00 0.00 N
+ATOM 393 CA ARG A 27 12.078 7.621 -7.892 1.00 0.00 C
+ATOM 394 C ARG A 27 11.895 8.632 -9.017 1.00 0.00 C
+ATOM 395 O ARG A 27 12.773 9.456 -9.272 1.00 0.00 O
+ATOM 396 CB ARG A 27 12.499 6.283 -8.479 1.00 0.00 C
+ATOM 397 CG ARG A 27 13.165 5.334 -7.496 1.00 0.00 C
+ATOM 398 CD ARG A 27 13.836 4.205 -8.191 1.00 0.00 C
+ATOM 399 NE ARG A 27 12.877 3.292 -8.793 1.00 0.00 N
+ATOM 400 CZ ARG A 27 12.378 2.198 -8.187 1.00 0.00 C
+ATOM 401 NH1 ARG A 27 12.754 1.893 -6.965 1.00 0.00 N
+ATOM 402 NH2 ARG A 27 11.509 1.430 -8.822 1.00 0.00 N
+ATOM 403 H ARG A 27 10.366 6.593 -7.121 1.00 0.00 H
+ATOM 404 HA ARG A 27 12.871 7.973 -7.231 1.00 0.00 H
+ATOM 405 1HB ARG A 27 11.627 5.775 -8.889 1.00 0.00 H
+ATOM 406 2HB ARG A 27 13.196 6.449 -9.301 1.00 0.00 H
+ATOM 407 1HG ARG A 27 13.915 5.875 -6.919 1.00 0.00 H
+ATOM 408 2HG ARG A 27 12.414 4.923 -6.821 1.00 0.00 H
+ATOM 409 1HD ARG A 27 14.479 4.594 -8.980 1.00 0.00 H
+ATOM 410 2HD ARG A 27 14.437 3.644 -7.476 1.00 0.00 H
+ATOM 411 HE ARG A 27 12.564 3.494 -9.734 1.00 0.00 H
+ATOM 412 1HH1 ARG A 27 13.419 2.480 -6.480 1.00 0.00 H
+ATOM 413 2HH1 ARG A 27 12.380 1.073 -6.511 1.00 0.00 H
+ATOM 414 1HH2 ARG A 27 11.219 1.664 -9.761 1.00 0.00 H
+ATOM 415 2HH2 ARG A 27 11.135 0.610 -8.368 1.00 0.00 H
+ATOM 416 N ARG A 28 10.750 8.563 -9.687 1.00 0.00 N
+ATOM 417 CA ARG A 28 10.462 9.453 -10.806 1.00 0.00 C
+ATOM 418 C ARG A 28 10.416 10.907 -10.355 1.00 0.00 C
+ATOM 419 O ARG A 28 10.942 11.793 -11.030 1.00 0.00 O
+ATOM 420 CB ARG A 28 9.137 9.084 -11.455 1.00 0.00 C
+ATOM 421 CG ARG A 28 9.162 7.808 -12.281 1.00 0.00 C
+ATOM 422 CD ARG A 28 7.817 7.471 -12.812 1.00 0.00 C
+ATOM 423 NE ARG A 28 7.822 6.214 -13.545 1.00 0.00 N
+ATOM 424 CZ ARG A 28 6.774 5.728 -14.237 1.00 0.00 C
+ATOM 425 NH1 ARG A 28 5.646 6.402 -14.282 1.00 0.00 N
+ATOM 426 NH2 ARG A 28 6.879 4.573 -14.871 1.00 0.00 N
+ATOM 427 H ARG A 28 10.061 7.877 -9.414 1.00 0.00 H
+ATOM 428 HA ARG A 28 11.253 9.342 -11.548 1.00 0.00 H
+ATOM 429 1HB ARG A 28 8.376 8.964 -10.686 1.00 0.00 H
+ATOM 430 2HB ARG A 28 8.815 9.895 -12.110 1.00 0.00 H
+ATOM 431 1HG ARG A 28 9.842 7.934 -13.124 1.00 0.00 H
+ATOM 432 2HG ARG A 28 9.503 6.979 -11.660 1.00 0.00 H
+ATOM 433 1HD ARG A 28 7.112 7.381 -11.987 1.00 0.00 H
+ATOM 434 2HD ARG A 28 7.485 8.258 -13.489 1.00 0.00 H
+ATOM 435 HE ARG A 28 8.672 5.667 -13.533 1.00 0.00 H
+ATOM 436 1HH1 ARG A 28 5.565 7.285 -13.798 1.00 0.00 H
+ATOM 437 2HH1 ARG A 28 4.860 6.038 -14.802 1.00 0.00 H
+ATOM 438 1HH2 ARG A 28 7.746 4.055 -14.836 1.00 0.00 H
+ATOM 439 2HH2 ARG A 28 6.094 4.209 -15.390 1.00 0.00 H
+ATOM 440 N MET A 29 9.785 11.147 -9.211 1.00 0.00 N
+ATOM 441 CA MET A 29 9.710 12.489 -8.644 1.00 0.00 C
+ATOM 442 C MET A 29 11.091 13.004 -8.262 1.00 0.00 C
+ATOM 443 O MET A 29 11.395 14.184 -8.439 1.00 0.00 O
+ATOM 444 CB MET A 29 8.782 12.498 -7.431 1.00 0.00 C
+ATOM 445 CG MET A 29 7.308 12.321 -7.764 1.00 0.00 C
+ATOM 446 SD MET A 29 6.236 12.591 -6.338 1.00 0.00 S
+ATOM 447 CE MET A 29 6.485 11.067 -5.433 1.00 0.00 C
+ATOM 448 H MET A 29 9.347 10.381 -8.720 1.00 0.00 H
+ATOM 449 HA MET A 29 9.282 13.157 -9.393 1.00 0.00 H
+ATOM 450 1HB MET A 29 9.069 11.698 -6.749 1.00 0.00 H
+ATOM 451 2HB MET A 29 8.893 13.441 -6.895 1.00 0.00 H
+ATOM 452 1HG MET A 29 7.024 13.023 -8.546 1.00 0.00 H
+ATOM 453 2HG MET A 29 7.137 11.310 -8.135 1.00 0.00 H
+ATOM 454 1HE MET A 29 5.886 11.083 -4.522 1.00 0.00 H
+ATOM 455 2HE MET A 29 6.183 10.222 -6.052 1.00 0.00 H
+ATOM 456 3HE MET A 29 7.539 10.967 -5.172 1.00 0.00 H
+ATOM 457 N LEU A 30 11.925 12.113 -7.737 1.00 0.00 N
+ATOM 458 CA LEU A 30 13.300 12.458 -7.396 1.00 0.00 C
+ATOM 459 C LEU A 30 14.092 12.854 -8.636 1.00 0.00 C
+ATOM 460 O LEU A 30 14.759 13.888 -8.655 1.00 0.00 O
+ATOM 461 CB LEU A 30 13.986 11.277 -6.699 1.00 0.00 C
+ATOM 462 CG LEU A 30 15.486 11.446 -6.424 1.00 0.00 C
+ATOM 463 CD1 LEU A 30 15.698 12.603 -5.458 1.00 0.00 C
+ATOM 464 CD2 LEU A 30 16.047 10.151 -5.858 1.00 0.00 C
+ATOM 465 H LEU A 30 11.598 11.173 -7.568 1.00 0.00 H
+ATOM 466 HA LEU A 30 13.284 13.303 -6.707 1.00 0.00 H
+ATOM 467 1HB LEU A 30 13.492 11.102 -5.745 1.00 0.00 H
+ATOM 468 2HB LEU A 30 13.861 10.388 -7.318 1.00 0.00 H
+ATOM 469 HG LEU A 30 16.001 11.689 -7.354 1.00 0.00 H
+ATOM 470 1HD1 LEU A 30 16.763 12.724 -5.263 1.00 0.00 H
+ATOM 471 2HD1 LEU A 30 15.304 13.520 -5.897 1.00 0.00 H
+ATOM 472 3HD1 LEU A 30 15.179 12.396 -4.523 1.00 0.00 H
+ATOM 473 1HD2 LEU A 30 17.114 10.271 -5.663 1.00 0.00 H
+ATOM 474 2HD2 LEU A 30 15.534 9.907 -4.927 1.00 0.00 H
+ATOM 475 3HD2 LEU A 30 15.898 9.344 -6.576 1.00 0.00 H
+ATOM 476 N GLU A 31 14.013 12.024 -9.671 1.00 0.00 N
+ATOM 477 CA GLU A 31 14.793 12.238 -10.885 1.00 0.00 C
+ATOM 478 C GLU A 31 14.422 13.555 -11.553 1.00 0.00 C
+ATOM 479 O GLU A 31 15.284 14.258 -12.082 1.00 0.00 O
+ATOM 480 CB GLU A 31 14.583 11.081 -11.864 1.00 0.00 C
+ATOM 481 CG GLU A 31 15.236 9.773 -11.442 1.00 0.00 C
+ATOM 482 CD GLU A 31 14.880 8.623 -12.343 1.00 0.00 C
+ATOM 483 OE1 GLU A 31 14.049 8.801 -13.201 1.00 0.00 O
+ATOM 484 OE2 GLU A 31 15.439 7.565 -12.172 1.00 0.00 O
+ATOM 485 H GLU A 31 13.397 11.226 -9.616 1.00 0.00 H
+ATOM 486 HA GLU A 31 15.850 12.267 -10.616 1.00 0.00 H
+ATOM 487 1HB GLU A 31 13.515 10.897 -11.987 1.00 0.00 H
+ATOM 488 2HB GLU A 31 14.982 11.354 -12.841 1.00 0.00 H
+ATOM 489 1HG GLU A 31 16.318 9.901 -11.446 1.00 0.00 H
+ATOM 490 2HG GLU A 31 14.930 9.538 -10.423 1.00 0.00 H
+ATOM 491 N LYS A 32 13.136 13.885 -11.527 1.00 0.00 N
+ATOM 492 CA LYS A 32 12.654 15.137 -12.098 1.00 0.00 C
+ATOM 493 C LYS A 32 13.101 16.331 -11.264 1.00 0.00 C
+ATOM 494 O LYS A 32 13.441 17.384 -11.803 1.00 0.00 O
+ATOM 495 CB LYS A 32 11.129 15.120 -12.217 1.00 0.00 C
+ATOM 496 CG LYS A 32 10.593 14.191 -13.298 1.00 0.00 C
+ATOM 497 CD LYS A 32 9.072 14.203 -13.332 1.00 0.00 C
+ATOM 498 CE LYS A 32 8.534 13.276 -14.412 1.00 0.00 C
+ATOM 499 NZ LYS A 32 7.046 13.270 -14.451 1.00 0.00 N
+ATOM 500 H LYS A 32 12.474 13.252 -11.100 1.00 0.00 H
+ATOM 501 HA LYS A 32 13.064 15.239 -13.103 1.00 0.00 H
+ATOM 502 1HB LYS A 32 10.693 14.813 -11.265 1.00 0.00 H
+ATOM 503 2HB LYS A 32 10.769 16.126 -12.431 1.00 0.00 H
+ATOM 504 1HG LYS A 32 10.972 14.507 -14.270 1.00 0.00 H
+ATOM 505 2HG LYS A 32 10.935 13.175 -13.107 1.00 0.00 H
+ATOM 506 1HD LYS A 32 8.683 13.884 -12.364 1.00 0.00 H
+ATOM 507 2HD LYS A 32 8.720 15.216 -13.529 1.00 0.00 H
+ATOM 508 1HE LYS A 32 8.910 13.593 -15.384 1.00 0.00 H
+ATOM 509 2HE LYS A 32 8.883 12.260 -14.226 1.00 0.00 H
+ATOM 510 1HZ LYS A 32 6.731 12.644 -15.178 1.00 0.00 H
+ATOM 511 2HZ LYS A 32 6.687 12.959 -13.559 1.00 0.00 H
+ATOM 512 3HZ LYS A 32 6.711 14.203 -14.642 1.00 0.00 H
+ATOM 513 N ALA A 33 13.097 16.161 -9.947 1.00 0.00 N
+ATOM 514 CA ALA A 33 13.405 17.254 -9.032 1.00 0.00 C
+ATOM 515 C ALA A 33 14.839 17.735 -9.211 1.00 0.00 C
+ATOM 516 O ALA A 33 15.106 18.936 -9.210 1.00 0.00 O
+ATOM 517 CB ALA A 33 13.167 16.823 -7.592 1.00 0.00 C
+ATOM 518 H ALA A 33 12.876 15.251 -9.569 1.00 0.00 H
+ATOM 519 HA ALA A 33 12.729 18.083 -9.244 1.00 0.00 H
+ATOM 520 1HB ALA A 33 13.401 17.649 -6.921 1.00 0.00 H
+ATOM 521 2HB ALA A 33 12.123 16.537 -7.466 1.00 0.00 H
+ATOM 522 3HB ALA A 33 13.806 15.973 -7.357 1.00 0.00 H
+ATOM 523 N LYS A 34 15.760 16.789 -9.363 1.00 0.00 N
+ATOM 524 CA LYS A 34 17.175 17.113 -9.503 1.00 0.00 C
+ATOM 525 C LYS A 34 17.992 15.874 -9.846 1.00 0.00 C
+ATOM 526 O LYS A 34 17.641 14.760 -9.459 1.00 0.00 O
+ATOM 527 OXT LYS A 34 18.992 15.978 -10.502 1.00 0.00 O
+ATOM 528 CB LYS A 34 17.707 17.756 -8.221 1.00 0.00 C
+ATOM 529 CG LYS A 34 19.157 18.214 -8.302 1.00 0.00 C
+ATOM 530 CD LYS A 34 19.587 18.914 -7.022 1.00 0.00 C
+ATOM 531 CE LYS A 34 21.045 19.345 -7.089 1.00 0.00 C
+ATOM 532 NZ LYS A 34 21.484 20.021 -5.838 1.00 0.00 N
+ATOM 533 H LYS A 34 15.473 15.821 -9.383 1.00 0.00 H
+ATOM 534 HA LYS A 34 17.285 17.839 -10.310 1.00 0.00 H
+ATOM 535 1HB LYS A 34 17.096 18.623 -7.968 1.00 0.00 H
+ATOM 536 2HB LYS A 34 17.625 17.046 -7.398 1.00 0.00 H
+ATOM 537 1HG LYS A 34 19.802 17.350 -8.469 1.00 0.00 H
+ATOM 538 2HG LYS A 34 19.275 18.901 -9.139 1.00 0.00 H
+ATOM 539 1HD LYS A 34 18.963 19.794 -6.860 1.00 0.00 H
+ATOM 540 2HD LYS A 34 19.458 18.238 -6.177 1.00 0.00 H
+ATOM 541 1HE LYS A 34 21.675 18.473 -7.257 1.00 0.00 H
+ATOM 542 2HE LYS A 34 21.183 20.031 -7.925 1.00 0.00 H
+ATOM 543 1HZ LYS A 34 22.453 20.291 -5.923 1.00 0.00 H
+ATOM 544 2HZ LYS A 34 20.918 20.843 -5.682 1.00 0.00 H
+ATOM 545 3HZ LYS A 34 21.379 19.388 -5.059 1.00 0.00 H
+TER
+REMARK PDBinfo-LABEL: 3 DISULFIDIZE
+REMARK PDBinfo-LABEL: 18 DISULFIDIZE
+REMARK PDBinfo-LABEL: 20 DISULFIDIZE
+REMARK PDBinfo-LABEL: 23 DISULFIDIZE
+
+# All scores below are weighted scores, not raw scores.
+#BEGIN_POSE_ENERGIES_TABLE /home/job/save/disulfided_eeh_6.2.6.3.15_6_3_20200725003010.pdb
+label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro total
+weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1.25 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 NA
+pose -170.055 17.7309 137.275 -11.2983 3.8376 9.7245 71.4758 -73.7168 -0.18427 -1.07923 -67.7326 -13.0528 0 -17.1703 -7.77467 -1.87383 -6.3717 -0.89085 1.30522 2.86584 26.3339 25.1997 -5.06175 4.6384 -1.50875 1.13657 -76.2469
+GLY:NtermProteinFull_1 -2.87655 0.20716 3.39225 -0.00152 0 0 2.33588 -1.73048 -0 -0 -3.72923 0.09927 0 0 0 0 0 0 0.03478 0 0 0 0 0 0.83697 0 -1.43146
+GLU_2 -3.51228 0.17809 3.24202 -0.27324 0.05461 0.31207 1.0224 -1.43743 -0.01614 -0.06409 -2.27741 -0.22814 0 0 0 0 -0.57746 0 -0.00499 0.05117 0 3.34566 -0.00968 0 -2.7348 0.0077 -2.92196
+CYS:disulfide_3 -4.71072 0.68027 3.30373 -0.0548 0.00022 0.03811 1.91903 -1.78714 -0 -0 -1.4535 -0.47788 0 0 0 0 0 -0.38599 0.10671 0.09493 0.4845 0 -0.03785 0 3.6196 -0.05173 1.28748
+GLU_4 -3.9822 0.21391 3.3412 -0.30681 0.06669 0.38753 1.17787 -1.42243 -0 -0 -1.90673 -0.31551 0 0 0 0 -0.90306 0 0.06197 0.0184 0 3.0681 0.19567 0 -2.7348 0.0758 -2.9644
+ILE_5 -6.1511 0.56082 2.77957 -0.48284 0.73071 0.10057 2.24125 -1.98019 -0.00292 -0.0089 -1.96595 0.05682 0 0 0 0 0 0 -0.06373 0.03728 0.33595 0 -0.75385 0 0.73287 -0.07489 -3.90854
+ARG_6 -4.3683 0.49492 4.33509 -0.45777 0.06273 0.26702 1.84457 -1.82147 -0 -0 -2.7107 0.04927 0 0 0 -0.3809 -0.90306 0 -0.01733 0.01884 2.332 0 0.04853 0 -1.2888 -0.01957 -2.51494
+ARG_7 -5.2595 0.97927 4.7006 -0.95029 0.39887 0.67146 2.69307 -2.31608 -0.00292 -0.0089 -1.54121 0.02329 0 0 0 -0.3809 0 0 0.0186 0.03934 1.73405 0 -0.2267 0 -1.2888 0.10413 -0.61265
+LYS_8 -3.88582 0.47725 4.02872 -0.33024 0.04748 0.212 1.45212 -1.57233 -0 -0 -2.57766 -0.41725 0 0 0 -0.55602 0 0 0.11289 0.32375 1.50269 0 -0.00595 0 -1.5107 0.1971 -2.50198
+GLY_9 -1.14742 0.27462 1.44082 -6e-05 0 0 0.21845 -0.68752 -0 -0 0.12924 -0.41214 0 0 0 0 0 0 -0.14948 0 0 0 -1.46448 0 0.83697 -0.20001 -1.16102
+MET_10 -6.15673 0.74142 3.34247 -0.38458 0.21829 0.13467 2.4976 -2.10231 -0.0086 -0.02699 -1.47097 -0.23531 0 0 0 0 0 0 -0.02202 0.02561 1.61235 0 0.09924 0 0.60916 -0.63361 -1.76032
+THR_11 -3.47363 0.26214 1.87149 -0.17926 0.12763 0.06655 0.71918 -1.17242 -0 -0 -0.30562 -0.26303 0 0 0 0 0 0 0.00086 0.00216 0.10265 0 -0.0081 2.30776 -1.0874 -0.14092 -1.16995
+PHE_12 -8.901 1.28871 2.61632 -0.60177 0.03517 0.33608 2.29872 -2.36135 -0.0086 -0.02699 -2.29173 0.0598 0 0 0 0 0 0 -0.02165 0.01165 0 2.34722 -0.17487 0 1.0402 0.10059 -4.25351
+ARG_13 -3.73082 0.22886 3.01131 -1.01802 0.2863 0.69966 1.10281 -1.49903 -0 -0 -2.3209 0.26731 0 0 0 0 -0.57746 0 0.00891 0.03944 3.39272 0 -0.14967 0 -1.2888 -0.05452 -1.6019
+PHE_14 -6.55104 0.89448 2.61589 -0.61221 0.03507 -0.009 2.17702 -2.27348 -0 -0 -2.07163 -0.43069 0 0 0 0 0 0 -0.00531 0.80452 0 2.67586 -0.12875 0 1.0402 -0.04164 -1.8807
+THR_15 -3.33743 0.28588 1.52276 -0.12874 0.04479 0.09696 0.47088 -1.19516 -0 -0 -0.84983 -0.92243 0 0 0 0 0 0 0.24413 0.00584 1.3458 0 -0.21921 2.33063 -1.0874 0.11742 -1.27511
+ALA_16 -4.02966 0.4428 2.86258 -0.01778 0 0 2.57959 -2.02186 -0 -0 -1.8505 -0.37038 0 0 0 0 0 0 0.07876 0 0 0 -0.30121 0 1.8394 0.30375 -0.48451
+GLU_17 -2.27212 0.20528 3.27063 -0.58697 0.38961 1.56801 1.15481 -1.28257 -0.00037 -0.00596 -2.3108 -3.10012 0 0 0 0 -0.37455 0 -0.04229 0.01449 0 3.21905 -0.2052 0 -2.7348 0.21448 -2.87937
+CYS:disulfide_18 -5.38337 0.88417 4.75616 -0.05891 7e-05 0.04213 2.50773 -2.4391 -0 -0 -1.61083 -0.48987 0 0 0 0 0 -0.05943 0.0343 0.0197 0.28286 0 -0.22435 0 3.6196 -0.03569 1.84519
+GLU_19 -5.19103 0.40171 4.85603 -0.46453 0.24421 1.45056 2.0595 -2.49139 -0.04444 -0.23247 -2.3608 -2.91681 0 0 0 0 0 0 0.18068 0.07643 0 3.97595 -0.30712 0 -2.7348 -0.14458 -3.64287
+CYS:disulfide_20 -3.76049 0.61971 3.53444 -0.05171 0 0.03001 1.45224 -1.73982 -0.05199 -0.30291 -1.02926 -0.48566 0 0 0 0 0 -0.05943 -0.02626 0.00605 1.69906 0 0.23881 0 3.6196 0.4151 4.10749
+LYS_21 -5.85134 0.48221 6.1322 -0.30446 0.02694 0.14054 3.24824 -2.77135 -0 -0 -3.25926 -0.04381 0 0 0 0 -0.37455 0 0.00749 0.23164 1.8954 0 -0.11831 0 -1.5107 0.54271 -1.52642
+ALA_22 -7.22677 0.70475 3.65248 -0.0217 0 0 2.87342 -3.17025 -0 -0 -1.81934 -0.35543 0 0 0 0 0 0 0.01525 0 0 0 -0.21843 0 1.8394 -0.09771 -3.82433
+CYS:disulfide_23 -6.36518 0.7211 5.8292 -0.03932 0 0.01665 2.94713 -3.09023 -0 -0 -2.57987 -0.34491 0 0 0 0 0 -0.38599 0.20721 0.0007 0.28154 0 0.29788 0 3.6196 0.31867 1.43418
+GLU_24 -6.81601 0.47094 8.509 -0.66376 0.18645 1.22536 3.97451 -3.66688 -0 -0 -4.14863 -0.58465 0 0 0 0 -1.33079 0 0.0948 0.07739 0 3.56293 -0.15517 0 -2.7348 0.26873 -1.73059
+ALA_25 -5.61248 0.45872 3.81917 -0.02152 0 0 2.59299 -2.55985 -0 -0 -2.18108 -0.35229 0 0 0 0 0 0 0.09347 0 0 0 -0.18068 0 1.8394 -0.08724 -2.1914
+ALA_26 -6.56627 0.55461 3.88573 -0.02192 0 0 2.64682 -2.85753 -0 -0 -2.08556 -0.35735 0 0 0 0 0 0 0.05654 0 0 0 -0.21428 0 1.8394 -0.08607 -3.20591
+ARG_27 -7.69061 0.6843 8.51056 -0.74761 0.21189 0.47597 3.79045 -3.92864 -0.02406 -0.14049 -3.51256 0.41539 0 0 0 0 -0.5406 0 -0.03539 0.4775 1.44844 0 -0.04941 0 -1.2888 -0.07599 -2.01966
+ARG_28 -6.27188 0.43334 7.47057 -0.44141 0.05352 0.21829 3.34647 -3.13511 -0.01212 -0.13076 -3.2804 0.39189 0 0 0 0 -0.79019 0 0.09506 0.21887 2.0898 0 -0.06554 0 -1.2888 0.03721 -1.06119
+MET_29 -7.18712 0.67398 4.09091 -0.3468 0.10094 0.10298 2.27643 -2.70687 -0 -0 -1.96964 -0.02975 0 0 0 0 0 0 0.20704 0.01244 1.75694 0 -0.02399 0 0.60916 0.10517 -2.32819
+LEU_30 -8.06506 0.8887 4.85352 -0.70808 0.3654 0.26636 3.09392 -3.05979 -0 -0 -1.2789 0.17937 0 0 0 0 0 0 0.0251 0.17701 0.78347 0 -0.19544 0 0.18072 0.40382 -2.08989
+GLU_31 -4.00397 0.18096 5.15318 -0.21708 0.03272 0.31137 1.67791 -2.3197 -0.01212 -0.13076 -0.54808 -0.60521 0 0 0 0 0 0 0.05741 0.05273 0 3.00488 -0.2871 0 -2.7348 0.11004 -0.27764
+LYS_32 -3.10089 0.21499 3.74395 -0.30506 0.0278 0.13777 1.29332 -1.70495 -0 -0 -0.46598 -0.04434 0 0 0 0 0 0 -0.00687 0.02088 1.8327 0 -0.07874 0 -1.5107 -0.34938 -0.29549
+ALA_33 -3.3152 0.5333 1.72584 -0.02148 0 0 1.65063 -1.39514 -0 -0 -1.10282 -0.34991 0 0 0 0 0 0 -0.04143 0 0 0 -0.13777 0 1.8394 -0.11444 -0.72901
+LYS:CtermProteinFull_34 -3.30057 0.4075 5.07493 -0.4761 0.0895 0.4248 2.13884 -2.01688 -0 -0 -2.99441 -0.46237 0 0 0 -0.55602 0 0 0 0.00708 1.42096 0 0 0 -1.5107 0.02216 -1.73128
+#END_POSE_ENERGIES_TABLE /home/job/save/disulfided_eeh_6.2.6.3.15_6_3_20200725003010.pdb
+
+DisulfideBondEnergys -0.3859923452533682, -0.059434062977247806
+PHI 0.0,-132.92943237915765,-136.10219330173697,-128.5106881162641,-120.75099867529168,-115.88614849802029,-142.71780269760472,61.96411097519306,84.96937640690365,-116.70850212878638,-105.44348266675473,-123.028144698773,-120.17056001338905,-147.30173808915478,-115.50861686965074,-154.6587028528634,-66.61146552704896,-142.34312941750505,-59.51191139525495,-51.810279945963906,-74.18984252333696,-61.88849393920982,-67.41655203082195,-61.720321189217124,-62.3288134635097,-63.346819032890515,-65.5225577979518,-62.79763191185042,-64.35952519951205,-63.02372374389715,-61.90912816879368,-70.20965149975315,-63.880275645513144,-172.51935136307495
+PSI 139.74434155415014,139.87069186161065,136.56137711621656,126.99326683730659,127.07643007714044,102.93099066462312,143.06038159665013,26.506756394508947,1.4040995435332526,140.86815860855998,123.7526138093518,115.48547053168912,151.5970283016247,146.15186287208,136.63491153261066,171.64387995665064,-15.157137930507016,135.45524991435624,-36.37287672195918,-45.21533337882406,-38.77044406009899,-41.14077311525353,-40.72499806067717,-43.165781727495265,-42.0615925517685,-39.86411938115058,-42.4879631634811,-42.52153445313923,-38.376767032772335,-49.35041577041225,-38.122856512749685,-38.19584805193469,-42.26556218992961,0.0
+SSE LEEEEEELLEEEEEELLLHHHHHHHHHHHHHHHL
+AlaCount 5
+AverageDegree 14.4706
+BuriedUnsatHbond 1
+Buried_non_polar_SASA_per_res 42.3199
+CavityVolume 0
+CoreAverageDegree 16.9286
+CoreResidueCount 14
+ExposeCoreHydrophobicsPerCoreResidue 30.676
+ExposeCoreHydrophobicsSASA 429.462
+ExposedCoreHydrophobics_on_TotalHydrophobicsSASAPercent 29.609
+ExposedHydrophobics_on_TotalSASAPercent 15.901
+HasCoreResidueNum 7
+PackStat 0.701859
+Rg 9.406
+SSShapeComplementarity 0.704662
+ScorePerResFilter -2.24255
+deltaS_conf_folding 8.82419
+driftRMSD 0.725588
+frac_helix 44.1176
+frac_loop 20.5882
+frac_sheet 35.2941
+n_hydrophobic 11
+netcharge 3
+nres_helix 15
+nres_loop 7
+nres_sheet 12
+nres_total 34
+ss_mismatch_probability 0.387248
+
diff --git a/8_Filter/data/t6c.40.92.pdb b/8_Filter/data/t6c.40.92.pdb
new file mode 100644
index 0000000..182f9a7
--- /dev/null
+++ b/8_Filter/data/t6c.40.92.pdb
@@ -0,0 +1,222 @@
+ATOM 1 N DSE A 1 4.608 4.460 -11.125 1.00 0.00 N
+ATOM 2 CA DSE A 1 5.156 5.741 -11.555 1.00 0.00 C
+ATOM 3 C DSE A 1 6.670 5.775 -11.395 1.00 0.00 C
+ATOM 4 O DSE A 1 7.287 6.839 -11.458 1.00 0.00 O
+ATOM 5 CB DSE A 1 4.786 6.008 -13.001 1.00 0.00 C
+ATOM 6 OG DSE A 1 5.471 5.142 -13.863 1.00 0.00 O
+ATOM 7 H DSE A 1 4.607 3.684 -11.771 1.00 0.00 H
+ATOM 8 HA DSE A 1 4.728 6.527 -10.931 1.00 0.00 H
+ATOM 9 1HB DSE A 1 5.025 7.041 -13.253 1.00 0.00 H
+ATOM 10 2HB DSE A 1 3.712 5.880 -13.131 1.00 0.00 H
+ATOM 11 HG DSE A 1 4.963 5.123 -14.678 1.00 0.00 H
+ATOM 12 N TYR A 2 7.264 4.605 -11.188 1.00 0.00 N
+ATOM 13 CA TYR A 2 8.716 4.484 -11.117 1.00 0.00 C
+ATOM 14 C TYR A 2 9.278 3.854 -12.384 1.00 0.00 C
+ATOM 15 O TYR A 2 10.422 3.398 -12.408 1.00 0.00 O
+ATOM 16 CB TYR A 2 9.125 3.665 -9.891 1.00 0.00 C
+ATOM 17 CG TYR A 2 8.846 4.355 -8.574 1.00 0.00 C
+ATOM 18 CD1 TYR A 2 7.599 4.233 -7.978 1.00 0.00 C
+ATOM 19 CD2 TYR A 2 9.836 5.110 -7.963 1.00 0.00 C
+ATOM 20 CE1 TYR A 2 7.344 4.864 -6.776 1.00 0.00 C
+ATOM 21 CE2 TYR A 2 9.580 5.740 -6.761 1.00 0.00 C
+ATOM 22 CZ TYR A 2 8.340 5.619 -6.168 1.00 0.00 C
+ATOM 23 OH TYR A 2 8.086 6.247 -4.970 1.00 0.00 O
+ATOM 24 H TYR A 2 6.696 3.777 -11.077 1.00 0.00 H
+ATOM 25 HA TYR A 2 9.142 5.483 -11.012 1.00 0.00 H
+ATOM 26 1HB TYR A 2 8.594 2.712 -9.895 1.00 0.00 H
+ATOM 27 2HB TYR A 2 10.192 3.445 -9.940 1.00 0.00 H
+ATOM 28 HD1 TYR A 2 6.821 3.640 -8.459 1.00 0.00 H
+ATOM 29 HD2 TYR A 2 10.815 5.206 -8.432 1.00 0.00 H
+ATOM 30 HE1 TYR A 2 6.364 4.768 -6.308 1.00 0.00 H
+ATOM 31 HE2 TYR A 2 10.359 6.334 -6.281 1.00 0.00 H
+ATOM 32 HH TYR A 2 8.869 6.726 -4.689 1.00 0.00 H
+ATOM 33 N DGN A 3 8.469 3.830 -13.438 1.00 0.00 N
+ATOM 34 CA DGN A 3 8.908 3.319 -14.730 1.00 0.00 C
+ATOM 35 C DGN A 3 9.428 1.892 -14.611 1.00 0.00 C
+ATOM 36 O DGN A 3 8.743 1.013 -14.088 1.00 0.00 O
+ATOM 37 CB DGN A 3 7.763 3.373 -15.745 1.00 0.00 C
+ATOM 38 CG DGN A 3 8.137 2.881 -17.133 1.00 0.00 C
+ATOM 39 CD DGN A 3 9.102 3.816 -17.837 1.00 0.00 C
+ATOM 40 OE1 DGN A 3 8.863 5.023 -17.932 1.00 0.00 O
+ATOM 41 NE2 DGN A 3 10.201 3.262 -18.337 1.00 0.00 N
+ATOM 42 H DGN A 3 7.525 4.174 -13.340 1.00 0.00 H
+ATOM 43 HA DGN A 3 9.724 3.945 -15.091 1.00 0.00 H
+ATOM 44 1HB DGN A 3 7.406 4.399 -15.837 1.00 0.00 H
+ATOM 45 2HB DGN A 3 6.930 2.768 -15.387 1.00 0.00 H
+ATOM 46 1HG DGN A 3 7.232 2.806 -17.736 1.00 0.00 H
+ATOM 47 2HG DGN A 3 8.610 1.903 -17.045 1.00 0.00 H
+ATOM 48 1HE2 DGN A 3 10.875 3.829 -18.813 1.00 0.00 H
+ATOM 49 2HE2 DGN A 3 10.356 2.279 -18.238 1.00 0.00 H
+ATOM 50 N ASP A 4 10.643 1.669 -15.099 1.00 0.00 N
+ATOM 51 CA ASP A 4 11.183 0.320 -15.222 1.00 0.00 C
+ATOM 52 C ASP A 4 11.423 -0.306 -13.854 1.00 0.00 C
+ATOM 53 O ASP A 4 11.633 -1.513 -13.741 1.00 0.00 O
+ATOM 54 CB ASP A 4 12.490 0.336 -16.019 1.00 0.00 C
+ATOM 55 CG ASP A 4 12.281 0.653 -17.494 1.00 0.00 C
+ATOM 56 OD1 ASP A 4 11.160 0.594 -17.941 1.00 0.00 O
+ATOM 57 OD2 ASP A 4 13.244 0.951 -18.159 1.00 0.00 O
+ATOM 58 H ASP A 4 11.208 2.453 -15.392 1.00 0.00 H
+ATOM 59 HA ASP A 4 10.487 -0.296 -15.811 1.00 0.00 H
+ATOM 60 1HB ASP A 4 13.165 1.080 -15.595 1.00 0.00 H
+ATOM 61 2HB ASP A 4 12.978 -0.635 -15.937 1.00 0.00 H
+ATOM 62 N ASN A 5 11.390 0.524 -12.817 1.00 0.00 N
+ATOM 63 CA ASN A 5 11.699 0.072 -11.465 1.00 0.00 C
+ATOM 64 C ASN A 5 10.455 -0.455 -10.762 1.00 0.00 C
+ATOM 65 O ASN A 5 10.537 -1.001 -9.663 1.00 0.00 O
+ATOM 66 CB ASN A 5 12.333 1.192 -10.659 1.00 0.00 C
+ATOM 67 CG ASN A 5 13.713 1.542 -11.143 1.00 0.00 C
+ATOM 68 OD1 ASN A 5 14.456 0.675 -11.618 1.00 0.00 O
+ATOM 69 ND2 ASN A 5 14.070 2.796 -11.032 1.00 0.00 N
+ATOM 70 H ASN A 5 11.145 1.492 -12.968 1.00 0.00 H
+ATOM 71 HA ASN A 5 12.409 -0.754 -11.530 1.00 0.00 H
+ATOM 72 1HB ASN A 5 11.704 2.081 -10.715 1.00 0.00 H
+ATOM 73 2HB ASN A 5 12.392 0.898 -9.611 1.00 0.00 H
+ATOM 74 1HD2 ASN A 5 14.977 3.087 -11.337 1.00 0.00 H
+ATOM 75 2HD2 ASN A 5 13.436 3.463 -10.641 1.00 0.00 H
+ATOM 76 N DAL A 6 9.304 -0.288 -11.404 1.00 0.00 N
+ATOM 77 CA DAL A 6 8.039 -0.742 -10.838 1.00 0.00 C
+ATOM 78 C DAL A 6 7.647 0.091 -9.625 1.00 0.00 C
+ATOM 79 O DAL A 6 6.750 0.932 -9.702 1.00 0.00 O
+ATOM 80 CB DAL A 6 6.940 -0.693 -11.890 1.00 0.00 C
+ATOM 81 H DAL A 6 9.305 0.166 -12.306 1.00 0.00 H
+ATOM 82 HA DAL A 6 8.166 -1.773 -10.508 1.00 0.00 H
+ATOM 83 1HB DAL A 6 6.002 -1.035 -11.452 1.00 0.00 H
+ATOM 84 2HB DAL A 6 7.207 -1.340 -12.725 1.00 0.00 H
+ATOM 85 3HB DAL A 6 6.822 0.329 -12.246 1.00 0.00 H
+ATOM 86 N DIL A 7 8.323 -0.145 -8.507 1.00 0.00 N
+ATOM 87 CA DIL A 7 8.081 0.619 -7.289 1.00 0.00 C
+ATOM 88 C DIL A 7 6.623 0.517 -6.856 1.00 0.00 C
+ATOM 89 O DIL A 7 6.054 -0.574 -6.808 1.00 0.00 O
+ATOM 90 CB DIL A 7 8.992 0.134 -6.146 1.00 0.00 C
+ATOM 91 CG1 DIL A 7 10.464 0.302 -6.529 1.00 0.00 C
+ATOM 92 CG2 DIL A 7 8.682 0.888 -4.862 1.00 0.00 C
+ATOM 93 CD1 DIL A 7 10.852 1.728 -6.851 1.00 0.00 C
+ATOM 94 H DIL A 7 9.023 -0.873 -8.500 1.00 0.00 H
+ATOM 95 HA DIL A 7 8.293 1.669 -7.491 1.00 0.00 H
+ATOM 96 HB DIL A 7 8.830 -0.931 -5.979 1.00 0.00 H
+ATOM 97 1HG1 DIL A 7 10.687 -0.316 -7.397 1.00 0.00 H
+ATOM 98 2HG1 DIL A 7 11.095 -0.045 -5.710 1.00 0.00 H
+ATOM 99 1HG2 DIL A 7 9.335 0.534 -4.065 1.00 0.00 H
+ATOM 100 2HG2 DIL A 7 7.643 0.719 -4.582 1.00 0.00 H
+ATOM 101 3HG2 DIL A 7 8.847 1.955 -5.018 1.00 0.00 H
+ATOM 102 1HD1 DIL A 7 11.910 1.767 -7.112 1.00 0.00 H
+ATOM 103 2HD1 DIL A 7 10.670 2.360 -5.981 1.00 0.00 H
+ATOM 104 3HD1 DIL A 7 10.258 2.085 -7.691 1.00 0.00 H
+ATOM 105 N ASN A 8 6.024 1.660 -6.541 1.00 0.00 N
+ATOM 106 CA ASN A 8 4.624 1.705 -6.137 1.00 0.00 C
+ATOM 107 C ASN A 8 3.753 2.298 -7.237 1.00 0.00 C
+ATOM 108 O ASN A 8 2.564 2.545 -7.036 1.00 0.00 O
+ATOM 109 CB ASN A 8 4.465 2.490 -4.848 1.00 0.00 C
+ATOM 110 CG ASN A 8 5.105 1.805 -3.672 1.00 0.00 C
+ATOM 111 OD1 ASN A 8 4.897 0.607 -3.447 1.00 0.00 O
+ATOM 112 ND2 ASN A 8 5.879 2.542 -2.918 1.00 0.00 N
+ATOM 113 H ASN A 8 6.552 2.520 -6.581 1.00 0.00 H
+ATOM 114 HA ASN A 8 4.280 0.683 -5.967 1.00 0.00 H
+ATOM 115 1HB ASN A 8 4.912 3.478 -4.966 1.00 0.00 H
+ATOM 116 2HB ASN A 8 3.405 2.633 -4.637 1.00 0.00 H
+ATOM 117 1HD2 ASN A 8 6.332 2.140 -2.121 1.00 0.00 H
+ATOM 118 2HD2 ASN A 8 6.019 3.507 -3.137 1.00 0.00 H
+ATOM 119 N DTH A 9 4.274 2.304 -8.459 1.00 0.00 N
+ATOM 120 CA DTH A 9 3.571 2.898 -9.589 1.00 0.00 C
+ATOM 121 C DTH A 9 4.110 4.288 -9.905 1.00 0.00 C
+ATOM 122 O DTH A 9 4.075 5.184 -9.062 1.00 0.00 O
+ATOM 123 CB DTH A 9 3.677 2.005 -10.839 1.00 0.00 C
+ATOM 124 OG1 DTH A 9 5.025 2.020 -11.327 1.00 0.00 O
+ATOM 125 CG2 DTH A 9 3.276 0.576 -10.510 1.00 0.00 C
+ATOM 126 H DTH A 9 5.181 1.886 -8.609 1.00 0.00 H
+ATOM 127 HA DTH A 9 2.515 2.992 -9.330 1.00 0.00 H
+ATOM 128 HB DTH A 9 3.020 2.391 -11.619 1.00 0.00 H
+ATOM 129 HG1 DTH A 9 5.561 1.419 -10.802 1.00 0.00 H
+ATOM 130 1HG2 DTH A 9 3.357 -0.040 -11.405 1.00 0.00 H
+ATOM 131 2HG2 DTH A 9 2.248 0.560 -10.150 1.00 0.00 H
+ATOM 132 3HG2 DTH A 9 3.936 0.182 -9.738 1.00 0.00 H
+TER
+CONECT 2 1
+CONECT 3 2
+CONECT 4 3
+CONECT 5 2
+CONECT 6 5
+CONECT 7 1
+CONECT 8 2
+CONECT 9 5
+CONECT 10 5
+CONECT 11 6
+CONECT 12 3
+CONECT 33 14
+CONECT 34 33
+CONECT 35 34
+CONECT 36 35
+CONECT 37 34
+CONECT 38 37
+CONECT 39 38
+CONECT 40 39
+CONECT 41 39
+CONECT 42 33
+CONECT 43 34
+CONECT 44 37
+CONECT 45 37
+CONECT 46 38
+CONECT 47 38
+CONECT 48 41
+CONECT 49 41
+CONECT 50 35
+CONECT 76 64
+CONECT 77 76
+CONECT 78 77
+CONECT 79 78
+CONECT 80 77
+CONECT 81 76
+CONECT 82 77
+CONECT 83 80
+CONECT 84 80
+CONECT 85 80
+CONECT 86 78
+CONECT 87 86
+CONECT 88 87
+CONECT 89 88
+CONECT 90 87
+CONECT 91 90
+CONECT 92 90
+CONECT 93 91
+CONECT 94 86
+CONECT 95 87
+CONECT 96 90
+CONECT 97 91
+CONECT 98 91
+CONECT 99 92
+CONECT 100 92
+CONECT 101 92
+CONECT 102 93
+CONECT 103 93
+CONECT 104 93
+CONECT 105 88
+CONECT 119 107
+CONECT 120 119
+CONECT 121 1 120
+CONECT 122 121
+CONECT 123 120
+CONECT 124 123
+CONECT 125 123
+CONECT 126 119
+CONECT 127 120
+CONECT 128 123
+CONECT 129 124
+CONECT 130 125
+CONECT 131 125
+CONECT 132 125
+# All scores below are weighted scores, not raw scores.
+#BEGIN_POSE_ENERGIES_TABLE t6c.40.92_0001.pdb
+label fa_atr fa_rep fa_sol fa_intra_rep fa_intra_sol_xover4 lk_ball_wtd fa_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun p_aa_pp yhh_planarity ref rama_prepro total
+weights 1 0.55 1 0.005 1 1 1 1.25 1 1 1 1 1.25 0.4 0.7 0.6 0.625 1 0.45 NA
+pose -32.3047 3.85173 24.5058 0.09902 1.81687 -1.6925 -12.1602 0 -4.71574 0 -2.46249 -1.00126 0 0.6051 10.7702 -0.98883 1e-05 -1.2045 2.50699 -12.3745
+DSER_1 -1.89029 0.1459 2.00424 0.00187 0.05882 -0.19466 -0.2903 0 0 0 -0.72503 0 0 -0.01423 0.34273 -0.14589 0 -0.28969 1.90022 0.90368
+TYR_2 -6.7303 0.71916 3.1918 0.02278 0.27065 -0.36206 -1.49755 0 0 0 -0.50622 0 0 0.026 2.02084 -0.27407 1e-05 0.58223 -0.27169 -2.80841
+DGLN_3 -3.28359 0.48096 4.33055 0.01131 0.4569 -0.13367 -2.06669 0 0 0 -0.72503 -0.50063 0 0.66961 2.03361 0.11933 0 -1.45095 -0.31192 -0.3702
+ASP_4 -2.2848 0.15651 2.80351 0.00484 0.3281 -0.07285 -1.29483 0 0 0 0 -0.50063 0 0.04837 1.62142 -0.07175 0 -2.14574 -0.22241 -1.63025
+ASN_5 -3.35489 0.84447 2.78332 0.00592 0.28423 -0.1633 -1.66154 0 0 0 0 0 0 -0.02772 1.42879 -0.07364 0 -1.34026 -0.33066 -1.6053
+DALA_6 -4.03386 0.24312 3.37 0.003 0 0.01967 -2.93634 0 0 0 0 0 0 -0.02543 0 -0.08957 0 1.32468 0.24837 -1.87636
+DILE_7 -4.58195 0.77667 1.14152 0.03524 0.08041 -0.41811 -0.52021 0 0 0 0 0 0 -0.09652 1.04124 0.02835 0 2.30374 0.2636 0.05396
+ASN_8 -2.61697 0.29195 1.52344 0.00581 0.29435 -0.30655 0.07275 0 0 0 0 0 0 0.01437 1.73551 -0.6082 0 -1.34026 -0.47893 -1.41272
+DTHR_9 -3.52801 0.19299 3.35741 0.00824 0.0434 -0.06096 -1.96551 0 0 0 -0.50622 0 0 0.01064 0.54605 0.12661 0 1.15175 1.71041 1.08681
+#END_POSE_ENERGIES_TABLE t6c.40.92_0001.pdb
+
diff --git a/9_xmlObject_RosettaScript/.ipynb_checkpoints/9_1_RS_basis-checkpoint.ipynb b/9_XmlObject/.ipynb_checkpoints/9_1_RS_basis-checkpoint.ipynb
similarity index 55%
rename from 9_xmlObject_RosettaScript/.ipynb_checkpoints/9_1_RS_basis-checkpoint.ipynb
rename to 9_XmlObject/.ipynb_checkpoints/9_1_RS_basis-checkpoint.ipynb
index 7e871a2..0a2fcee 100644
--- a/9_xmlObject_RosettaScript/.ipynb_checkpoints/9_1_RS_basis-checkpoint.ipynb
+++ b/9_XmlObject/.ipynb_checkpoints/9_1_RS_basis-checkpoint.ipynb
@@ -4,7 +4,7 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "# xmlObject and Rosetta Script in PyRosetta\n",
+ "# Rosetta Script in PyRosetta\n",
"\n",
"@Author:Jian Huang\n",
"\n",
@@ -22,14 +22,14 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "在rosetta软件开始发展的初期，其功能是以单个单个的应用提交给用户使用的，例如我们经常使用的socre，relax等。作为开发者和设计者，当然不会满足于这些没办法定制自己独有设计过程的程序。Rosetta基于不同用户有的不同需求，给定用户更高的自由度——直接使用比应用更底层的功能进行组装，形成自己的“应用”或Protocol。因此Rosetta Script诞生了，后续简称RS。"
+ "在Rosetta软件开始发展的初期，其功能是以单个的应用提交给用户使用的，例如我们经常使用的socre，relax等。作为开发者和设计者，当然不会满足于这些没办法定制自己独有设计过程的程序。Rosetta为了适应用户的不同需求，给定用户更高的自由度——直接使用比应用更底层的功能进行组装，形成自己的“应用”或Protocol。因此Rosetta Script诞生了，后续简称RS。"
]
},
{
"cell_type": "markdown",
"metadata": {},
"source": [
- "首先观察一下Rosetta Script的标准框架：\n",
+ "首先观察以下Rosetta Script的标准框架：\n",
"\n",
"```\n",
"\n",
@@ -157,8 +157,8 @@
"\n",
"```\n",
"\n",
- "上面RS示例中的 tag中展示了如何定义不同的能量函数。在这里定义了两个能量函数，第一个能量函数在rosetta里面调用的名字叫mm_std_fa_elec_dslf_fa13，第二个能量函数就是我们常用的ref2015，但这里又对ref2015中的某些能量项进行权重的修改：pro_close设定为0和cart_bonded设定为0.625。（之前我们也介绍过如何使用patch 文件，修改rosetta中内置能量函数的权重）。\n",
- "注意，虽然molmech能量函数被定义，但是在后面的tag之中从来没有被使用。这在rosetta中也是允许的。修改权重后的ref2015能量函数，在这里被实例化成“r15_cart”，在 tag中被调用，这也就是告诉rosetta去使用实例化后的r15_cart对pose进行打分的意思。\n",
+ "上面RS示例中的`` tag中展示了如何定义不同的能量函数。在这里定义了两个能量函数，第一个能量函数在rosetta里面调用的名字叫mm_std_fa_elec_dslf_fa13，第二个能量函数就是我们常用的ref2015，但这里又对ref2015中的某些能量项进行权重的修改：pro_close设定为0和cart_bonded设定为0.625。（之前我们也介绍过如何使用patch 文件，修改rosetta中内置能量函数的权重）。\n",
+ "注意，虽然molmech能量函数被定义，但是在后面的tag之中从来没有被使用。这在rosetta中也是允许的。修改权重后的ref2015能量函数，在这里被实例化成“r15_cart”，在`` tag中被调用，这也就是告诉rosetta去使用实例化后的r15_cart对pose进行打分的意思。\n",
" "
]
},
@@ -180,7 +180,7 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "在RS框架中存在 tag，这个tag可以允许我们像以前使用rosetta的flag文件一样，设置输出选项来控制输出； tag允许我们使用其他的一些能量函数。"
+ "在RS框架中存在`` tag，这个tag可以允许我们像以前使用rosetta的flag文件一样，设置输出选项来控制输出；`` tag允许我们使用其他的一些能量函数。"
]
},
{
@@ -222,8 +222,8 @@
"```\n",
"\n",
" \n",
- "上面RS示例中的 tag中展示了如何定义不同的能量函数。在这里定义了两个能量函数，第一个能量函数在rosetta里面调用的名字叫mm_std_fa_elec_dslf_fa13，第二个能量函数就是我们常用的ref2015，但这里又对ref2015中的某些能量项进行权重的修改：pro_close设定为0和cart_bonded设定为0.625。（之前我们也介绍过如何使用patch 文件，修改rosetta中内置能量函数的权重）。\n",
- "注意，虽然molmech能量函数被定义，但是在后面的tag之中从来没有被使用。这在rosetta中也是允许的。修改权重后的ref2015能量函数，在这里被实例化成“r15_cart”，在 tag中被调用，这也就是告诉rosetta去使用实例化后的r15_cart对pose进行打分的意思。"
+ "上面RS示例中的`` tag中展示了如何定义不同的能量函数。在这里定义了两个能量函数，第一个能量函数在rosetta里面调用的名字叫mm_std_fa_elec_dslf_fa13，第二个能量函数就是我们常用的ref2015，但这里又对ref2015中的某些能量项进行权重的修改：pro_close设定为0和cart_bonded设定为0.625。（之前我们也介绍过如何使用patch 文件，修改rosetta中内置能量函数的权重）。\n",
+ "注意，虽然molmech能量函数被定义，但是在后面的tag之中从来没有被使用。这在rosetta中也是允许的。修改权重后的ref2015能量函数，在这里被实例化成“r15_cart”，在`` tag中被调用，这也就是告诉rosetta去使用实例化后的r15_cart对pose进行打分的意思。"
]
},
{
@@ -235,13 +235,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.Release.python36.ubuntu 2020.28+release.8ecab77aa50ac1301efe53641e07e09ac91fee3b 2020-07-07T16:41:06] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.31+release.c7009b3115c22daa9efe2805d9d1ebba08426a54 2021-08-07T10:04:12] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
- "\u001b[0mcore.init: \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: \u001b[0mRosetta version: PyRosetta4.Release.python36.ubuntu r260 2020.28+release.8ecab77aa50 8ecab77aa50ac1301efe53641e07e09ac91fee3b http://www.pyrosetta.org 2020-07-07T16:41:06\n",
- "\u001b[0mcore.init: \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=506649970 seed_offset=0 real_seed=506649970\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0mRandomGenerator:init: Normal mode, seed=506649970 RG_type=mt19937\n"
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r292 2021.31+release.c7009b3115c c7009b3115c22daa9efe2805d9d1ebba08426a54 http://www.pyrosetta.org 2021-08-07T10:04:12\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-53983269 seed_offset=0 real_seed=-53983269 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-53983269 RG_type=mt19937\n"
]
}
],
@@ -261,19 +261,19 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mFinished initializing fa_standard residue type set. Created 981 residue types\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mTotal time to initialize 0.828125 seconds.\n",
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile 'data/my_ab.pdb' automatically determined to be of type PDB\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mFound disulfide between residues 771 845\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 771 CYS\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 845 CYS\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 771 CYD\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 845 CYD\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mFound disulfide between residues 891 956\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 891 CYS\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 956 CYS\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 891 CYD\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 956 CYD\n"
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 983 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.685656 seconds.\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile 'data/my_ab.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 771 845\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 771 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 845 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 771 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 845 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 891 956\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 891 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 956 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 891 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 956 CYD\n"
]
}
],
@@ -302,13 +302,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -325,57 +325,73 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mStarting energy table calculation\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mFinished calculating energy tables.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
- "\u001b[0mcore.scoring.P_AA: \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mStarting energy table calculation\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mFinished calculating energy tables.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
- "\u001b[0mcore.scoring.ramachandran: \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
- "\u001b[0mcore.mm.MMLJLibrary: \u001b[0mMM lj sets added: 105\n",
- "\u001b[0mcore.mm.MMTorsionLibrary: \u001b[0mMM torsion sets added fully assigned: 1028; wildcard: 48 and 1 virtual parameter.\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0m setting r15_cart weight pro_close to 0\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mInitializing IdealParametersDatabase with default Ks=300 , 80 , 80 , 10 , 80\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-lengths.txt\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mRead 759 bb-independent lengths.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-angles.txt\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mRead 1434 bb-independent angles.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-torsions.txt\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mRead 1 bb-independent torsions.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-improper.txt\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mRead 2202 bb-independent improper tors.\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n"
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama_str.dat.\n",
+ "\u001b[0mcore.mm.MMLJLibrary: {0} \u001b[0mMM lj sets added: 105\n",
+ "\u001b[0mcore.mm.MMTorsionLibrary: {0} \u001b[0mMM torsion sets added fully assigned: 1039; wildcard: 48 and 1 virtual parameter.\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight pro_close to 0\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mInitializing IdealParametersDatabase with default Ks=300 , 80 , 80 , 10 , 80\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-lengths.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 759 bb-independent lengths.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-angles.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1434 bb-independent angles.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-torsions.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1 bb-independent torsions.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-improper.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 529 bb-independent improper tors.\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n"
]
}
],
@@ -417,20 +433,20 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mCreating new peptide-bonded energy container (975)\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
- "\u001b[0mcore.scoring.elec.util: \u001b[0mRead 40 countpair representative atoms\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mBinary rotamer library selected: /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mUsing Dunbrack library binary file '/home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mDunbrack 2010 library took 0.21875 seconds to load from binary\n"
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mCreating new peptide-bonded energy container (975)\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.16608 seconds to load from binary\n"
]
},
{
"data": {
"text/plain": [
- "16135.774462142144"
+ "16135.774462142173"
]
},
"execution_count": 6,
@@ -453,7 +469,7 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.scoring.ScoreFunction: \u001b[0m\n",
+ "\u001b[0mcore.scoring.ScoreFunction: {0} \u001b[0m\n",
"------------------------------------------------------------\n",
" Scores Weight Raw Score Wghtd.Score\n",
"------------------------------------------------------------\n",
@@ -535,10 +551,14 @@
" bondangle=\"(&bool;)\" bondlength=\"(&bool;)\" />\n",
" \n",
"\n",
- "```\n",
- "\n",
- " \n",
- "该MinMover的作用是用来进行侧链或骨架的能量最小化过程（调整二面角）。可以发现在MinMover中亚标签``````中可以让我们定义minimization的自由度，如chi，bb等参数设置。一个MinMover中有很多的选项让我们可以精确控制该Mover的行为，这也是RS中强大的一点。注意，大多数选项平常应用的时候本身都存在默认值，不需要修改，除非作为用户我们有修改的理由或明白我们在进行什么操作。\n",
+ "```"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "该MinMover的作用是用来进行侧链或骨架的能量最小化过程（调整二面角）。可以发现在MinMover中亚标签``中可以让我们定义minimization的自由度，如chi，bb等参数设置。一个MinMover中有很多的选项让我们可以精确控制该Mover的行为，这也是RS中强大的一点。注意，大多数选项平常应用的时候本身都存在默认值，不需要修改，除非作为用户我们有修改的理由或明白我们在进行什么操作。\n",
"\n",
"\n",
"在写mover的时候，用户需要给每个mover都写上一个独特的名字（name关键字），作为其实例化的名字。比如，我可以使用MinMover（相当于一个MinMover类），可以实例化各种不同名字的MinMover，并改变他们的属性，有些我可能想固定BB，有些我想固定CHI等等...可以发现这种类似于类实例化的方法，让我们有更高的自由度去操纵MinMover（其他Mover也是类似的）。"
@@ -590,13 +610,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -618,17 +638,17 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0m setting r15_cart weight pro_close to 0\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
- "\u001b[0mprotocols.minimization_packing.MinMover: \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
- "\u001b[0mprotocols.minimization_packing.MinMover: \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"min_cart\" of type MinMover\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"min_cart\" with filter \"true_filter\"\n"
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight pro_close to 0\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_cart\" of type MinMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"min_cart\"\n"
]
}
],
@@ -649,13 +669,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER MinMover - min_cart=======================\n",
- "\u001b[0mcore.pose.util: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 771 BRANCH 1\n",
- "\u001b[0mcore.pose.util: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 845 BRANCH 1\n",
- "\u001b[0mcore.pose.util: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 891 BRANCH 1\n",
- "\u001b[0mcore.pose.util: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 956 BRANCH 1\n",
- "\u001b[0mcore.optimization.Minimizer: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m LBFGS MAX CYCLES 200 EXCEEDED, BUT FUNC NOT CONVERGED!\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0msetting status to success\n"
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER MinMover - min_cart=======================\n",
+ "\u001b[0mcore.pose.util: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 771 BRANCH 1\n",
+ "\u001b[0mcore.pose.util: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 845 BRANCH 1\n",
+ "\u001b[0mcore.pose.util: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 891 BRANCH 1\n",
+ "\u001b[0mcore.pose.util: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 956 BRANCH 1\n",
+ "\u001b[0mcore.optimization.Minimizer: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m LBFGS MAX CYCLES 200 EXCEEDED, BUT FUNC NOT CONVERGED!\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0msetting status to success\n"
]
},
{
@@ -728,7 +748,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/9_xmlObject_RosettaScript/.ipynb_checkpoints/9_2_RS_advanced-checkpoint.ipynb b/9_XmlObject/.ipynb_checkpoints/9_2_RS_advanced-checkpoint.ipynb
similarity index 66%
rename from 9_xmlObject_RosettaScript/.ipynb_checkpoints/9_2_RS_advanced-checkpoint.ipynb
rename to 9_XmlObject/.ipynb_checkpoints/9_2_RS_advanced-checkpoint.ipynb
index 13e25d2..2110955 100644
--- a/9_xmlObject_RosettaScript/.ipynb_checkpoints/9_2_RS_advanced-checkpoint.ipynb
+++ b/9_XmlObject/.ipynb_checkpoints/9_2_RS_advanced-checkpoint.ipynb
@@ -88,7 +88,7 @@
"3. 最后限制5~10号残基的BB不运动、CHI可以运动。\n",
"\n",
"NOTE: \n",
- "这里先定义了一个很宽的范围1 - 999，注意在rosetta中及时我们现在正在模拟的蛋白长度没有这么多，也是允许的！只是其他的限制仍然还是在输入构象基础上进行限制的（比如1 - 50，5 - 10）。（假定我们模拟的蛋白长度是76，我们知道MoveMap遵循依次定义限制的规则，一个残基的自由度由最后一次出现它定义的地方指定，比如5 - 10号残基先是禁止所有运动，而后开放了CHI和BB的运动，最后又限制了BB运动，开放CHI运动——最终的结果就是5 - 10号允许CHI运动、不允许BB运动；而1 - 4和11 - 50具有BB和CHI自由度；51 - 76不允许任何移动）"
+ "这里先定义了一个很宽的范围1 - 999，注意在Rosetta中即使我们现在正在模拟的蛋白长度没有这么多，也是允许的！只是其他的限制仍然还是在输入构象基础上进行限制的（比如1 - 50，5 - 10）。（假定我们模拟的蛋白长度是76，我们知道MoveMap遵循依次定义限制的规则，一个残基的自由度由最后一次出现它定义的地方指定，比如5 - 10号残基先是禁止所有运动，而后开放了CHI和BB的运动，最后又限制了BB运动，开放CHI运动——最终的结果就是5 - 10号允许CHI运动、不允许BB运动；而1 - 4和11 - 50具有BB和CHI自由度；51 - 76不允许任何移动）"
]
},
{
@@ -100,13 +100,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.Release.python36.ubuntu 2020.28+release.8ecab77aa50ac1301efe53641e07e09ac91fee3b 2020-07-07T16:41:06] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.31+release.c7009b3115c22daa9efe2805d9d1ebba08426a54 2021-08-07T10:04:12] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
- "\u001b[0mcore.init: \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: \u001b[0mRosetta version: PyRosetta4.Release.python36.ubuntu r260 2020.28+release.8ecab77aa50 8ecab77aa50ac1301efe53641e07e09ac91fee3b http://www.pyrosetta.org 2020-07-07T16:41:06\n",
- "\u001b[0mcore.init: \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-1528970483 seed_offset=0 real_seed=-1528970483\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0mRandomGenerator:init: Normal mode, seed=-1528970483 RG_type=mt19937\n"
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r292 2021.31+release.c7009b3115c c7009b3115c22daa9efe2805d9d1ebba08426a54 http://www.pyrosetta.org 2021-08-07T10:04:12\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-1031901739 seed_offset=0 real_seed=-1031901739 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-1031901739 RG_type=mt19937\n"
]
}
],
@@ -125,21 +125,21 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mFinished initializing fa_standard residue type set. Created 981 residue types\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mTotal time to initialize 1 seconds.\n",
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 983 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.67358 seconds.\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
]
}
],
"source": [
- "# 读入初始pose，并深拷贝一份\n",
+ "# 读入初始pose，并且拷贝一份\n",
"original_pose = pose_from_pdb(\"./data/1ubq_clean.pdb\")\n",
"pose = original_pose.clone()"
]
},
{
"cell_type": "code",
- "execution_count": 7,
+ "execution_count": 3,
"metadata": {},
"outputs": [],
"source": [
@@ -179,20 +179,20 @@
},
{
"cell_type": "code",
- "execution_count": 8,
+ "execution_count": 4,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -215,12 +215,62 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"ref_2015\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.minimization_packing.MinMover: \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"min_torsion\" with filter \"true_filter\"\n"
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama_str.dat.\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"ref_2015\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"min_torsion\"\n"
]
}
],
@@ -231,23 +281,23 @@
},
{
"cell_type": "code",
- "execution_count": 28,
+ "execution_count": 5,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER MinMover - min_torsion=======================\n",
- "\u001b[0mcore.select.residue_selector.ResidueSpanSelector: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Residue span end designation 'Residue 999' is outside the Pose!\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
- "\u001b[0mcore.scoring.elec.util: \u001b[0mRead 40 countpair representative atoms\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mBinary rotamer library selected: /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mUsing Dunbrack library binary file '/home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mDunbrack 2010 library took 0.265625 seconds to load from binary\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0msetting status to success\n"
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER MinMover - min_torsion=======================\n",
+ "\u001b[0mcore.select.residue_selector.ResidueSpanSelector: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Residue span end designation 'Residue 999' is outside the Pose!\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.168718 seconds to load from binary\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0msetting status to success\n"
]
}
],
@@ -340,7 +390,7 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "除此之外，TaskOperations还会控制侧链如何被采样的具体过程，rosetta中默认是基于rotamer的采样，但常常可能希望加入一些额外的rotamer的采样。例如，添加一些偏移偏移标准rotamer库的因子，ExtraRotamersGeneric的TaskOperations允许我们控制rotamer采样的级别，一般来说在CHI1和CHI2中加入一些额外的采样比较有效，虽然可能会花费更长的时间进行packing。此外InitializeFromCommandline也允许使用-ex1 -ex2的选项进行rotamer的采样控制。\n",
+ "除此之外，TaskOperations还会控制侧链如何被采样的具体过程，rosetta中默认是基于rotamer的采样，但常常可能希望加入一些额外的rotamer的采样。例如，添加一些偏移标准rotamer库的因子，ExtraRotamersGeneric的TaskOperations允许我们控制rotamer采样的级别，一般来说在CHI1和CHI2中加入一些额外的采样比较有效，虽然可能会花费更长的时间进行packing。此外InitializeFromCommandline也允许使用-ex1 -ex2的选项进行rotamer的采样控制。\n",
"\n",
"```\n",
"\n",
@@ -357,7 +407,7 @@
},
{
"cell_type": "code",
- "execution_count": 29,
+ "execution_count": 6,
"metadata": {},
"outputs": [],
"source": [
@@ -394,20 +444,20 @@
},
{
"cell_type": "code",
- "execution_count": 30,
+ "execution_count": 7,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -427,19 +477,23 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"r15\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: \u001b[0mDefined TaskOperation named \"no_design\" of type RestrictToRepacking\n",
- "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: \u001b[0mDefined TaskOperation named \"extrachi\" of type ExtraRotamersGeneric\n",
- "\u001b[0mcore.pack.task.xml_util: \u001b[0mObject pack1 reading the following task_operations: Adding the following task operations\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"r15\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: {0} \u001b[0mDefined TaskOperation named \"no_design\" of type RestrictToRepacking\n",
+ "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: {0} \u001b[0mDefined TaskOperation named \"extrachi\" of type ExtraRotamersGeneric\n",
+ "\u001b[0mcore.pack.task.xml_util: {0} \u001b[0mObject pack1 reading the following task_operations: Adding the following task operations\n",
"no_design extrachi\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"pack1\" of type PackRotamersMover\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"pack1\" with filter \"true_filter\"\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER PackRotamersMover - pack1=======================\n",
- "\u001b[0mcore.pack.pack_rotamers: \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
- "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: \u001b[0mInstantiating DensePDInteractionGraph\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0msetting status to success\n"
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"pack1\" of type PackRotamersMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"pack1\"\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER PackRotamersMover - pack1=======================\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
+ "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadManager: {?} \u001b[0mCreating a thread pool of 1 threads.\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadPool: {?} \u001b[0mLaunched 0 new threads.\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0msetting status to success\n"
]
}
],
@@ -487,20 +541,20 @@
},
{
"cell_type": "code",
- "execution_count": 72,
+ "execution_count": 8,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -528,24 +582,26 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"ref_2015\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: \u001b[0mDefined TaskOperation named \"no_design\" of type RestrictToRepacking\n",
- "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: \u001b[0mDefined TaskOperation named \"extrachi\" of type ExtraRotamersGeneric\n",
- "\u001b[0mprotocols.minimization_packing.MinMover: \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
- "\u001b[0mcore.pack.task.xml_util: \u001b[0mObject pack1 reading the following task_operations: Adding the following task operations\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"ref_2015\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: {0} \u001b[0mDefined TaskOperation named \"no_design\" of type RestrictToRepacking\n",
+ "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: {0} \u001b[0mDefined TaskOperation named \"extrachi\" of type ExtraRotamersGeneric\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
+ "\u001b[0mcore.pack.task.xml_util: {0} \u001b[0mObject pack1 reading the following task_operations: Adding the following task operations\n",
"no_design extrachi\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"pack1\" of type PackRotamersMover\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"pack1\" with filter \"true_filter\"\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"min_torsion\" with filter \"true_filter\"\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER PackRotamersMover - pack1=======================\n",
- "\u001b[0mcore.pack.pack_rotamers: \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
- "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: \u001b[0mInstantiating DensePDInteractionGraph\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER MinMover - min_torsion=======================\n",
- "\u001b[0mcore.select.residue_selector.ResidueSpanSelector: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Residue span end designation 'Residue 999' is outside the Pose!\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0msetting status to success\n"
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"pack1\" of type PackRotamersMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"pack1\"\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"min_torsion\"\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER PackRotamersMover - pack1=======================\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
+ "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER MinMover - min_torsion=======================\n",
+ "\u001b[0mcore.select.residue_selector.ResidueSpanSelector: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Residue span end designation 'Residue 999' is outside the Pose!\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0msetting status to success\n"
]
}
],
@@ -604,14 +660,14 @@
},
{
"cell_type": "code",
- "execution_count": 73,
+ "execution_count": 9,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "32.66393846891525 -198.97754213624194\n"
+ "32.66393846892796 -204.98731243884194\n"
]
}
],
@@ -632,9 +688,18 @@
},
{
"cell_type": "code",
- "execution_count": 55,
+ "execution_count": 10,
"metadata": {},
- "outputs": [],
+ "outputs": [
+ {
+ "name": "stderr",
+ "output_type": "stream",
+ "text": [
+ "/opt/miniconda3/lib/python3.7/site-packages/ipykernel_launcher.py:6: UserWarning: Import of 'rosetta' as a top-level module is deprecated and may be removed in 2018, import via 'pyrosetta.rosetta'.\n",
+ " \n"
+ ]
+ }
+ ],
"source": [
"#Python\n",
"from pyrosetta import *\n",
@@ -654,20 +719,20 @@
},
{
"cell_type": "code",
- "execution_count": 32,
+ "execution_count": 11,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.Release.python36.ubuntu 2020.28+release.8ecab77aa50ac1301efe53641e07e09ac91fee3b 2020-07-07T16:41:06] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.31+release.c7009b3115c22daa9efe2805d9d1ebba08426a54 2021-08-07T10:04:12] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
- "\u001b[0mcore.init: \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: \u001b[0mRosetta version: PyRosetta4.Release.python36.ubuntu r260 2020.28+release.8ecab77aa50 8ecab77aa50ac1301efe53641e07e09ac91fee3b http://www.pyrosetta.org 2020-07-07T16:41:06\n",
- "\u001b[0mcore.init: \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-546848207 seed_offset=0 real_seed=-546848207\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0mRandomGenerator:init: Normal mode, seed=-546848207 RG_type=mt19937\n"
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r292 2021.31+release.c7009b3115c c7009b3115c22daa9efe2805d9d1ebba08426a54 http://www.pyrosetta.org 2021-08-07T10:04:12\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-208345754 seed_offset=0 real_seed=-208345754 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-208345754 RG_type=mt19937\n"
]
}
],
@@ -677,7 +742,7 @@
},
{
"cell_type": "code",
- "execution_count": 75,
+ "execution_count": 12,
"metadata": {},
"outputs": [
{
@@ -700,7 +765,7 @@
},
{
"cell_type": "code",
- "execution_count": 70,
+ "execution_count": 13,
"metadata": {},
"outputs": [],
"source": [
@@ -721,7 +786,7 @@
},
{
"cell_type": "code",
- "execution_count": 49,
+ "execution_count": 14,
"metadata": {},
"outputs": [],
"source": [
@@ -732,7 +797,7 @@
},
{
"cell_type": "code",
- "execution_count": 50,
+ "execution_count": 15,
"metadata": {},
"outputs": [
{
@@ -753,7 +818,7 @@
},
{
"cell_type": "code",
- "execution_count": 52,
+ "execution_count": 16,
"metadata": {},
"outputs": [
{
@@ -904,17 +969,19 @@
},
{
"cell_type": "code",
- "execution_count": 76,
+ "execution_count": 17,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.pack.task: \u001b[0mPacker task: initialize from command line()\n",
- "\u001b[0mcore.pack.pack_rotamers: \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
- "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: \u001b[0mInstantiating DensePDInteractionGraph\n",
- "32.66393846891525 -180.55738641185718\n"
+ "\u001b[0mcore.pack.task: {0} \u001b[0mPacker task: initialize from command line()\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
+ "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
+ "32.66393846892796 -208.75941216807576\n"
]
}
],
@@ -922,17 +989,20 @@
"# run protocol as follows:\n",
"scorefxn = create_score_function( \"ref2015\" )\n",
"\n",
+ "# 首先进行packing -- 对应于pack1\n",
"packer = pack_min.PackRotamersMover()\n",
"packer.score_function(scorefxn)\n",
"packer.task_factory(tf)\n",
"packer.apply(pose_4)\n",
"\n",
+ "# 再进行minimization -- 对应于min_torsion\n",
"minimizer = pack_min.MinMover()\n",
"minimizer.score_function(scorefxn)\n",
"minimizer.cartesian(False)\n",
"minimizer.set_movemap(mm)\n",
"minimizer.apply(pose_4)\n",
"\n",
+ "# calculate scores\n",
"before = scorefxn.score(original_pose)\n",
"after = scorefxn.score(pose_4)\n",
"print(before, after)"
@@ -949,19 +1019,14 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "## 小结\n",
+ "## 小结与练习\n",
"\n",
"在RS中进行的定义可以与Pyrosetta的python版本一一对应。\n",
"\n",
- "对比两种方式，各有什么优缺点？你会选择什么方式定制自己的protocol呢？"
+ "1. 对比两种方式，各有什么优缺点？你会选择什么方式定制自己的protocol呢？\n",
+ "\n",
+ "2. 请将./data/Example2-MinMover.xml改为python script，并尝试在两个MinMover中设置不同的MoveMap。"
]
- },
- {
- "cell_type": "code",
- "execution_count": null,
- "metadata": {},
- "outputs": [],
- "source": []
}
],
"metadata": {
@@ -980,7 +1045,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.10"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/9_XmlObject/.ipynb_checkpoints/9_3_XmlObject-checkpoint.ipynb b/9_XmlObject/.ipynb_checkpoints/9_3_XmlObject-checkpoint.ipynb
new file mode 100644
index 0000000..1231ebe
--- /dev/null
+++ b/9_XmlObject/.ipynb_checkpoints/9_3_XmlObject-checkpoint.ipynb
@@ -0,0 +1,374 @@
+{
+ "cells": [
+ {
+ "cell_type": "markdown",
+ "id": "4d50c9fa-0422-4c70-b5c5-49a90edbffe7",
+ "metadata": {},
+ "source": [
+ "# XmlObjects的基本用法\n",
+ "\n",
+ "@Author: 吴炜坤\n",
+ "\n",
+ "@E-mail: weikun.wu@xtalpi.com"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "71494982-1f97-412d-87ed-3a7150d91cb3",
+ "metadata": {},
+ "source": [
+ "### 1. 为什么有XmlObject？\n",
+ "在最早期，Rosetta的mover、filter等都没有为python api流程参数控制的接口，导致部分的组件无法直接调用，只能通过xml脚本读取参数，然后生成对应的对象。\n",
+ "\n",
+ "XmlObjects是在PyRosetta中直接使用xml脚本最直接的方法，特别是某些Mover没有做好Pyrosetta接口时特别有用。但是缺点是加载XmlObjects的速度并不理想，比纯粹的PyRosetta脚本启动要慢。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "06da9647-eda0-4cbc-80a5-fb0ce6704f13",
+ "metadata": {},
+ "source": [
+ "### 2. 如何使用XmlObject?\n",
+ "最方便的方法有两种调用方式:\n",
+ "1. create_from_string\n",
+ "2. create_from_file"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "647d98fd-e38e-4c68-8843-8cd41ec39f26",
+ "metadata": {},
+ "source": [
+ "#### 2.1 create_from_string\n",
+ "从字符串文本中提取信息，返回XmlObjects"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 3,
+ "id": "0743b33d-8a9b-441a-9d3b-db8f052fe7cc",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-2025690693 seed_offset=0 real_seed=-2025690693 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-2025690693 RG_type=mt19937\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\t\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 984 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.682139 seconds.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama_str.dat.\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"sfxn1\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"setTorsion\" of type SetTorsion\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "from pyrosetta import init\n",
+ "\n",
+ "# 初始化脚本:\n",
+ "init()\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ " \n",
+ "\t \n",
+ "\t\t \n",
+ "\t\t \n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "''')"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "837479ff-3402-4018-b646-0b94dcf4902e",
+ "metadata": {},
+ "source": [
+ "**提取Filter、Mover、Selector、SimpleMetric、TaskOperation的语法语句**"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 9,
+ "id": "5f7fa7a8-13fb-4286-99f9-848277443082",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ ""
+ ]
+ },
+ "execution_count": 9,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# get a mover:\n",
+ "mover_ = xml.get_mover(\"setTorsion\")\n",
+ "mover_\n",
+ "\n",
+ "# 如此类推:\n",
+ "# filter_ = xml.get_filter(name)\n",
+ "# selector_ = xml.get_residue_selector(name)\n",
+ "# score_ = xml.get_score_function(name)\n",
+ "# sm_ = xml.get_simple_metric(name)\n",
+ "# tf_ = xml.get_task_operation(name)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 10,
+ "id": "ea7c9597-8eaf-4964-9404-f3f5001cc26c",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "vector1_std_string[ParsedProtocol, null, setTorsion]"
+ ]
+ },
+ "execution_count": 10,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "#列表式所选内容。\n",
+ "xml.list_movers()\n",
+ "\n",
+ "# 如此类推:\n",
+ "# xml.list_filters()\n",
+ "# xml.list_residue_selectors()\n",
+ "# xml.list_score_functions()\n",
+ "# xml.list_simple_metrics()\n",
+ "# xml.list_task_operations()"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "707259f6-6bef-416f-9fdf-20ea673f425a",
+ "metadata": {},
+ "source": [
+ "#### 2.2 create_from_file\n",
+ "从字符串文本中提取信息，返回XmlObjects"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 11,
+ "id": "b4e9c8e4-7d98-4a65-94a0-6ff971cfd88e",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\t\n",
+ "\t\t\t\n",
+ "\t\t\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.mm.MMLJLibrary: {0} \u001b[0mMM lj sets added: 105\n",
+ "\u001b[0mcore.mm.MMTorsionLibrary: {0} \u001b[0mMM torsion sets added fully assigned: 1039; wildcard: 48 and 1 virtual parameter.\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight pro_close to 0\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mInitializing IdealParametersDatabase with default Ks=300 , 80 , 80 , 10 , 80\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-lengths.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 759 bb-independent lengths.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-angles.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1434 bb-independent angles.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-torsions.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1 bb-independent torsions.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-improper.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 529 bb-independent improper tors.\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_cart\" of type MinMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"min_cart\"\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "xml = rosetta_scripts.XmlObjects.create_from_file('./data/Example2-MinMover.xml')"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "f4ab1ba4-c717-4a15-9b5c-579f02bd225c",
+ "metadata": {},
+ "source": [
+ "### 3. RosettaScript所有的API\n",
+ "\n",
+ "详见: https://new.rosettacommons.org/docs/latest/scripting_documentation/RosettaScripts/RosettaScripts"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "0c7b732c-36bd-45d7-9075-bf7614dcb043",
+ "metadata": {},
+ "source": [
+ "#### 结语: \n",
+ "RosettaScript大而全，Python API灵活速度快！"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "id": "6db9e0f5-c610-45eb-840d-499887a4ae37",
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ }
+ ],
+ "metadata": {
+ "kernelspec": {
+ "display_name": "Python 3",
+ "language": "python",
+ "name": "python3"
+ },
+ "language_info": {
+ "codemirror_mode": {
+ "name": "ipython",
+ "version": 3
+ },
+ "file_extension": ".py",
+ "mimetype": "text/x-python",
+ "name": "python",
+ "nbconvert_exporter": "python",
+ "pygments_lexer": "ipython3",
+ "version": "3.7.10"
+ }
+ },
+ "nbformat": 4,
+ "nbformat_minor": 5
+}
diff --git a/9_xmlObject_RosettaScript/9_1_RS_basis.ipynb b/9_XmlObject/9_1_RS_basis.ipynb
similarity index 55%
rename from 9_xmlObject_RosettaScript/9_1_RS_basis.ipynb
rename to 9_XmlObject/9_1_RS_basis.ipynb
index 7e871a2..0a2fcee 100644
--- a/9_xmlObject_RosettaScript/9_1_RS_basis.ipynb
+++ b/9_XmlObject/9_1_RS_basis.ipynb
@@ -4,7 +4,7 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "# xmlObject and Rosetta Script in PyRosetta\n",
+ "# Rosetta Script in PyRosetta\n",
"\n",
"@Author:Jian Huang\n",
"\n",
@@ -22,14 +22,14 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "在rosetta软件开始发展的初期，其功能是以单个单个的应用提交给用户使用的，例如我们经常使用的socre，relax等。作为开发者和设计者，当然不会满足于这些没办法定制自己独有设计过程的程序。Rosetta基于不同用户有的不同需求，给定用户更高的自由度——直接使用比应用更底层的功能进行组装，形成自己的“应用”或Protocol。因此Rosetta Script诞生了，后续简称RS。"
+ "在Rosetta软件开始发展的初期，其功能是以单个的应用提交给用户使用的，例如我们经常使用的socre，relax等。作为开发者和设计者，当然不会满足于这些没办法定制自己独有设计过程的程序。Rosetta为了适应用户的不同需求，给定用户更高的自由度——直接使用比应用更底层的功能进行组装，形成自己的“应用”或Protocol。因此Rosetta Script诞生了，后续简称RS。"
]
},
{
"cell_type": "markdown",
"metadata": {},
"source": [
- "首先观察一下Rosetta Script的标准框架：\n",
+ "首先观察以下Rosetta Script的标准框架：\n",
"\n",
"```\n",
"\n",
@@ -157,8 +157,8 @@
"\n",
"```\n",
"\n",
- "上面RS示例中的 tag中展示了如何定义不同的能量函数。在这里定义了两个能量函数，第一个能量函数在rosetta里面调用的名字叫mm_std_fa_elec_dslf_fa13，第二个能量函数就是我们常用的ref2015，但这里又对ref2015中的某些能量项进行权重的修改：pro_close设定为0和cart_bonded设定为0.625。（之前我们也介绍过如何使用patch 文件，修改rosetta中内置能量函数的权重）。\n",
- "注意，虽然molmech能量函数被定义，但是在后面的tag之中从来没有被使用。这在rosetta中也是允许的。修改权重后的ref2015能量函数，在这里被实例化成“r15_cart”，在 tag中被调用，这也就是告诉rosetta去使用实例化后的r15_cart对pose进行打分的意思。\n",
+ "上面RS示例中的`` tag中展示了如何定义不同的能量函数。在这里定义了两个能量函数，第一个能量函数在rosetta里面调用的名字叫mm_std_fa_elec_dslf_fa13，第二个能量函数就是我们常用的ref2015，但这里又对ref2015中的某些能量项进行权重的修改：pro_close设定为0和cart_bonded设定为0.625。（之前我们也介绍过如何使用patch 文件，修改rosetta中内置能量函数的权重）。\n",
+ "注意，虽然molmech能量函数被定义，但是在后面的tag之中从来没有被使用。这在rosetta中也是允许的。修改权重后的ref2015能量函数，在这里被实例化成“r15_cart”，在`` tag中被调用，这也就是告诉rosetta去使用实例化后的r15_cart对pose进行打分的意思。\n",
" "
]
},
@@ -180,7 +180,7 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "在RS框架中存在 tag，这个tag可以允许我们像以前使用rosetta的flag文件一样，设置输出选项来控制输出； tag允许我们使用其他的一些能量函数。"
+ "在RS框架中存在`` tag，这个tag可以允许我们像以前使用rosetta的flag文件一样，设置输出选项来控制输出；`` tag允许我们使用其他的一些能量函数。"
]
},
{
@@ -222,8 +222,8 @@
"```\n",
"\n",
" \n",
- "上面RS示例中的 tag中展示了如何定义不同的能量函数。在这里定义了两个能量函数，第一个能量函数在rosetta里面调用的名字叫mm_std_fa_elec_dslf_fa13，第二个能量函数就是我们常用的ref2015，但这里又对ref2015中的某些能量项进行权重的修改：pro_close设定为0和cart_bonded设定为0.625。（之前我们也介绍过如何使用patch 文件，修改rosetta中内置能量函数的权重）。\n",
- "注意，虽然molmech能量函数被定义，但是在后面的tag之中从来没有被使用。这在rosetta中也是允许的。修改权重后的ref2015能量函数，在这里被实例化成“r15_cart”，在 tag中被调用，这也就是告诉rosetta去使用实例化后的r15_cart对pose进行打分的意思。"
+ "上面RS示例中的`` tag中展示了如何定义不同的能量函数。在这里定义了两个能量函数，第一个能量函数在rosetta里面调用的名字叫mm_std_fa_elec_dslf_fa13，第二个能量函数就是我们常用的ref2015，但这里又对ref2015中的某些能量项进行权重的修改：pro_close设定为0和cart_bonded设定为0.625。（之前我们也介绍过如何使用patch 文件，修改rosetta中内置能量函数的权重）。\n",
+ "注意，虽然molmech能量函数被定义，但是在后面的tag之中从来没有被使用。这在rosetta中也是允许的。修改权重后的ref2015能量函数，在这里被实例化成“r15_cart”，在`` tag中被调用，这也就是告诉rosetta去使用实例化后的r15_cart对pose进行打分的意思。"
]
},
{
@@ -235,13 +235,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.Release.python36.ubuntu 2020.28+release.8ecab77aa50ac1301efe53641e07e09ac91fee3b 2020-07-07T16:41:06] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.31+release.c7009b3115c22daa9efe2805d9d1ebba08426a54 2021-08-07T10:04:12] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
- "\u001b[0mcore.init: \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: \u001b[0mRosetta version: PyRosetta4.Release.python36.ubuntu r260 2020.28+release.8ecab77aa50 8ecab77aa50ac1301efe53641e07e09ac91fee3b http://www.pyrosetta.org 2020-07-07T16:41:06\n",
- "\u001b[0mcore.init: \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=506649970 seed_offset=0 real_seed=506649970\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0mRandomGenerator:init: Normal mode, seed=506649970 RG_type=mt19937\n"
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r292 2021.31+release.c7009b3115c c7009b3115c22daa9efe2805d9d1ebba08426a54 http://www.pyrosetta.org 2021-08-07T10:04:12\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-53983269 seed_offset=0 real_seed=-53983269 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-53983269 RG_type=mt19937\n"
]
}
],
@@ -261,19 +261,19 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mFinished initializing fa_standard residue type set. Created 981 residue types\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mTotal time to initialize 0.828125 seconds.\n",
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile 'data/my_ab.pdb' automatically determined to be of type PDB\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mFound disulfide between residues 771 845\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 771 CYS\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 845 CYS\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 771 CYD\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 845 CYD\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mFound disulfide between residues 891 956\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 891 CYS\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 956 CYS\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 891 CYD\n",
- "\u001b[0mcore.conformation.Conformation: \u001b[0mcurrent variant for 956 CYD\n"
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 983 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.685656 seconds.\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile 'data/my_ab.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 771 845\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 771 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 845 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 771 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 845 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mFound disulfide between residues 891 956\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 891 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 956 CYS\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 891 CYD\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0mcurrent variant for 956 CYD\n"
]
}
],
@@ -302,13 +302,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -325,57 +325,73 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mStarting energy table calculation\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mFinished calculating energy tables.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
- "\u001b[0mcore.scoring.P_AA: \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mStarting energy table calculation\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
- "\u001b[0mcore.scoring.etable: \u001b[0mFinished calculating energy tables.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
- "\u001b[0mcore.scoring.ramachandran: \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
- "\u001b[0mcore.mm.MMLJLibrary: \u001b[0mMM lj sets added: 105\n",
- "\u001b[0mcore.mm.MMTorsionLibrary: \u001b[0mMM torsion sets added fully assigned: 1028; wildcard: 48 and 1 virtual parameter.\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0m setting r15_cart weight pro_close to 0\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mInitializing IdealParametersDatabase with default Ks=300 , 80 , 80 , 10 , 80\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-lengths.txt\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mRead 759 bb-independent lengths.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-angles.txt\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mRead 1434 bb-independent angles.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-torsions.txt\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mRead 1 bb-independent torsions.\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-improper.txt\n",
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mRead 2202 bb-independent improper tors.\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n"
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama_str.dat.\n",
+ "\u001b[0mcore.mm.MMLJLibrary: {0} \u001b[0mMM lj sets added: 105\n",
+ "\u001b[0mcore.mm.MMTorsionLibrary: {0} \u001b[0mMM torsion sets added fully assigned: 1039; wildcard: 48 and 1 virtual parameter.\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight pro_close to 0\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mInitializing IdealParametersDatabase with default Ks=300 , 80 , 80 , 10 , 80\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-lengths.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 759 bb-independent lengths.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-angles.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1434 bb-independent angles.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-torsions.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1 bb-independent torsions.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-improper.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 529 bb-independent improper tors.\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n"
]
}
],
@@ -417,20 +433,20 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.scoring.CartesianBondedEnergy: \u001b[0mCreating new peptide-bonded energy container (975)\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
- "\u001b[0mcore.scoring.elec.util: \u001b[0mRead 40 countpair representative atoms\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mBinary rotamer library selected: /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mUsing Dunbrack library binary file '/home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mDunbrack 2010 library took 0.21875 seconds to load from binary\n"
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mCreating new peptide-bonded energy container (975)\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.16608 seconds to load from binary\n"
]
},
{
"data": {
"text/plain": [
- "16135.774462142144"
+ "16135.774462142173"
]
},
"execution_count": 6,
@@ -453,7 +469,7 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.scoring.ScoreFunction: \u001b[0m\n",
+ "\u001b[0mcore.scoring.ScoreFunction: {0} \u001b[0m\n",
"------------------------------------------------------------\n",
" Scores Weight Raw Score Wghtd.Score\n",
"------------------------------------------------------------\n",
@@ -535,10 +551,14 @@
" bondangle=\"(&bool;)\" bondlength=\"(&bool;)\" />\n",
" \n",
"\n",
- "```\n",
- "\n",
- " \n",
- "该MinMover的作用是用来进行侧链或骨架的能量最小化过程（调整二面角）。可以发现在MinMover中亚标签``````中可以让我们定义minimization的自由度，如chi，bb等参数设置。一个MinMover中有很多的选项让我们可以精确控制该Mover的行为，这也是RS中强大的一点。注意，大多数选项平常应用的时候本身都存在默认值，不需要修改，除非作为用户我们有修改的理由或明白我们在进行什么操作。\n",
+ "```"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "该MinMover的作用是用来进行侧链或骨架的能量最小化过程（调整二面角）。可以发现在MinMover中亚标签``中可以让我们定义minimization的自由度，如chi，bb等参数设置。一个MinMover中有很多的选项让我们可以精确控制该Mover的行为，这也是RS中强大的一点。注意，大多数选项平常应用的时候本身都存在默认值，不需要修改，除非作为用户我们有修改的理由或明白我们在进行什么操作。\n",
"\n",
"\n",
"在写mover的时候，用户需要给每个mover都写上一个独特的名字（name关键字），作为其实例化的名字。比如，我可以使用MinMover（相当于一个MinMover类），可以实例化各种不同名字的MinMover，并改变他们的属性，有些我可能想固定BB，有些我想固定CHI等等...可以发现这种类似于类实例化的方法，让我们有更高的自由度去操纵MinMover（其他Mover也是类似的）。"
@@ -590,13 +610,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -618,17 +638,17 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0m setting r15_cart weight pro_close to 0\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
- "\u001b[0mprotocols.minimization_packing.MinMover: \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
- "\u001b[0mprotocols.minimization_packing.MinMover: \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"min_cart\" of type MinMover\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"min_cart\" with filter \"true_filter\"\n"
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight pro_close to 0\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_cart\" of type MinMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"min_cart\"\n"
]
}
],
@@ -649,13 +669,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER MinMover - min_cart=======================\n",
- "\u001b[0mcore.pose.util: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 771 BRANCH 1\n",
- "\u001b[0mcore.pose.util: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 845 BRANCH 1\n",
- "\u001b[0mcore.pose.util: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 891 BRANCH 1\n",
- "\u001b[0mcore.pose.util: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 956 BRANCH 1\n",
- "\u001b[0mcore.optimization.Minimizer: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m LBFGS MAX CYCLES 200 EXCEEDED, BUT FUNC NOT CONVERGED!\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0msetting status to success\n"
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER MinMover - min_cart=======================\n",
+ "\u001b[0mcore.pose.util: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 771 BRANCH 1\n",
+ "\u001b[0mcore.pose.util: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 845 BRANCH 1\n",
+ "\u001b[0mcore.pose.util: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 891 BRANCH 1\n",
+ "\u001b[0mcore.pose.util: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Unable to find atom_tree atom for this Rosetta branch connection angle: residue 956 BRANCH 1\n",
+ "\u001b[0mcore.optimization.Minimizer: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m LBFGS MAX CYCLES 200 EXCEEDED, BUT FUNC NOT CONVERGED!\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0msetting status to success\n"
]
},
{
@@ -728,7 +748,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/9_xmlObject_RosettaScript/9_2_RS_advanced.ipynb b/9_XmlObject/9_2_RS_advanced.ipynb
similarity index 67%
rename from 9_xmlObject_RosettaScript/9_2_RS_advanced.ipynb
rename to 9_XmlObject/9_2_RS_advanced.ipynb
index 4ea0555..2110955 100644
--- a/9_xmlObject_RosettaScript/9_2_RS_advanced.ipynb
+++ b/9_XmlObject/9_2_RS_advanced.ipynb
@@ -88,7 +88,7 @@
"3. 最后限制5~10号残基的BB不运动、CHI可以运动。\n",
"\n",
"NOTE: \n",
- "这里先定义了一个很宽的范围1 - 999，注意在rosetta中及时我们现在正在模拟的蛋白长度没有这么多，也是允许的！只是其他的限制仍然还是在输入构象基础上进行限制的（比如1 - 50，5 - 10）。（假定我们模拟的蛋白长度是76，我们知道MoveMap遵循依次定义限制的规则，一个残基的自由度由最后一次出现它定义的地方指定，比如5 - 10号残基先是禁止所有运动，而后开放了CHI和BB的运动，最后又限制了BB运动，开放CHI运动——最终的结果就是5 - 10号允许CHI运动、不允许BB运动；而1 - 4和11 - 50具有BB和CHI自由度；51 - 76不允许任何移动）"
+ "这里先定义了一个很宽的范围1 - 999，注意在Rosetta中即使我们现在正在模拟的蛋白长度没有这么多，也是允许的！只是其他的限制仍然还是在输入构象基础上进行限制的（比如1 - 50，5 - 10）。（假定我们模拟的蛋白长度是76，我们知道MoveMap遵循依次定义限制的规则，一个残基的自由度由最后一次出现它定义的地方指定，比如5 - 10号残基先是禁止所有运动，而后开放了CHI和BB的运动，最后又限制了BB运动，开放CHI运动——最终的结果就是5 - 10号允许CHI运动、不允许BB运动；而1 - 4和11 - 50具有BB和CHI自由度；51 - 76不允许任何移动）"
]
},
{
@@ -100,13 +100,13 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.Release.python36.ubuntu 2020.28+release.8ecab77aa50ac1301efe53641e07e09ac91fee3b 2020-07-07T16:41:06] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.31+release.c7009b3115c22daa9efe2805d9d1ebba08426a54 2021-08-07T10:04:12] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
- "\u001b[0mcore.init: \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: \u001b[0mRosetta version: PyRosetta4.Release.python36.ubuntu r260 2020.28+release.8ecab77aa50 8ecab77aa50ac1301efe53641e07e09ac91fee3b http://www.pyrosetta.org 2020-07-07T16:41:06\n",
- "\u001b[0mcore.init: \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-1528970483 seed_offset=0 real_seed=-1528970483\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0mRandomGenerator:init: Normal mode, seed=-1528970483 RG_type=mt19937\n"
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r292 2021.31+release.c7009b3115c c7009b3115c22daa9efe2805d9d1ebba08426a54 http://www.pyrosetta.org 2021-08-07T10:04:12\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-1031901739 seed_offset=0 real_seed=-1031901739 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-1031901739 RG_type=mt19937\n"
]
}
],
@@ -125,21 +125,21 @@
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mFinished initializing fa_standard residue type set. Created 981 residue types\n",
- "\u001b[0mcore.chemical.GlobalResidueTypeSet: \u001b[0mTotal time to initialize 1 seconds.\n",
- "\u001b[0mcore.import_pose.import_pose: \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 983 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.67358 seconds.\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1ubq_clean.pdb' automatically determined to be of type PDB\n"
]
}
],
"source": [
- "# 读入初始pose，并深拷贝一份\n",
+ "# 读入初始pose，并且拷贝一份\n",
"original_pose = pose_from_pdb(\"./data/1ubq_clean.pdb\")\n",
"pose = original_pose.clone()"
]
},
{
"cell_type": "code",
- "execution_count": 7,
+ "execution_count": 3,
"metadata": {},
"outputs": [],
"source": [
@@ -179,20 +179,20 @@
},
{
"cell_type": "code",
- "execution_count": 8,
+ "execution_count": 4,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -215,12 +215,62 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"ref_2015\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.minimization_packing.MinMover: \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"min_torsion\" with filter \"true_filter\"\n"
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama_str.dat.\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"ref_2015\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"min_torsion\"\n"
]
}
],
@@ -231,23 +281,23 @@
},
{
"cell_type": "code",
- "execution_count": 28,
+ "execution_count": 5,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER MinMover - min_torsion=======================\n",
- "\u001b[0mcore.select.residue_selector.ResidueSpanSelector: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Residue span end designation 'Residue 999' is outside the Pose!\n",
- "\u001b[0mbasic.io.database: \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
- "\u001b[0mcore.scoring.elec.util: \u001b[0mRead 40 countpair representative atoms\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mBinary rotamer library selected: /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mUsing Dunbrack library binary file '/home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
- "\u001b[0mcore.pack.dunbrack.RotamerLibrary: \u001b[0mDunbrack 2010 library took 0.265625 seconds to load from binary\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0msetting status to success\n"
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER MinMover - min_torsion=======================\n",
+ "\u001b[0mcore.select.residue_selector.ResidueSpanSelector: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Residue span end designation 'Residue 999' is outside the Pose!\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/elec_cp_reps.dat\n",
+ "\u001b[0mcore.scoring.elec.util: {0} \u001b[0mRead 40 countpair representative atoms\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib_fixes_enable option is true.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mshapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mBinary rotamer library selected: /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mUsing Dunbrack library binary file '/opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.\n",
+ "\u001b[0mcore.pack.dunbrack.RotamerLibrary: {0} \u001b[0mDunbrack 2010 library took 0.168718 seconds to load from binary\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0msetting status to success\n"
]
}
],
@@ -340,7 +390,7 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "除此之外，TaskOperations还会控制侧链如何被采样的具体过程，rosetta中默认是基于rotamer的采样，但常常可能希望加入一些额外的rotamer的采样。例如，添加一些偏移偏移标准rotamer库的因子，ExtraRotamersGeneric的TaskOperations允许我们控制rotamer采样的级别，一般来说在CHI1和CHI2中加入一些额外的采样比较有效，虽然可能会花费更长的时间进行packing。此外InitializeFromCommandline也允许使用-ex1 -ex2的选项进行rotamer的采样控制。\n",
+ "除此之外，TaskOperations还会控制侧链如何被采样的具体过程，rosetta中默认是基于rotamer的采样，但常常可能希望加入一些额外的rotamer的采样。例如，添加一些偏移标准rotamer库的因子，ExtraRotamersGeneric的TaskOperations允许我们控制rotamer采样的级别，一般来说在CHI1和CHI2中加入一些额外的采样比较有效，虽然可能会花费更长的时间进行packing。此外InitializeFromCommandline也允许使用-ex1 -ex2的选项进行rotamer的采样控制。\n",
"\n",
"```\n",
"\n",
@@ -357,7 +407,7 @@
},
{
"cell_type": "code",
- "execution_count": 29,
+ "execution_count": 6,
"metadata": {},
"outputs": [],
"source": [
@@ -394,20 +444,20 @@
},
{
"cell_type": "code",
- "execution_count": 30,
+ "execution_count": 7,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -427,19 +477,23 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"r15\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: \u001b[0mDefined TaskOperation named \"no_design\" of type RestrictToRepacking\n",
- "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: \u001b[0mDefined TaskOperation named \"extrachi\" of type ExtraRotamersGeneric\n",
- "\u001b[0mcore.pack.task.xml_util: \u001b[0mObject pack1 reading the following task_operations: Adding the following task operations\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"r15\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: {0} \u001b[0mDefined TaskOperation named \"no_design\" of type RestrictToRepacking\n",
+ "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: {0} \u001b[0mDefined TaskOperation named \"extrachi\" of type ExtraRotamersGeneric\n",
+ "\u001b[0mcore.pack.task.xml_util: {0} \u001b[0mObject pack1 reading the following task_operations: Adding the following task operations\n",
"no_design extrachi\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"pack1\" of type PackRotamersMover\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"pack1\" with filter \"true_filter\"\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER PackRotamersMover - pack1=======================\n",
- "\u001b[0mcore.pack.pack_rotamers: \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
- "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: \u001b[0mInstantiating DensePDInteractionGraph\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0msetting status to success\n"
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"pack1\" of type PackRotamersMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"pack1\"\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER PackRotamersMover - pack1=======================\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
+ "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadManager: {?} \u001b[0mCreating a thread pool of 1 threads.\n",
+ "\u001b[0mbasic.thread_manager.RosettaThreadPool: {?} \u001b[0mLaunched 0 new threads.\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0msetting status to success\n"
]
}
],
@@ -487,20 +541,20 @@
},
{
"cell_type": "code",
- "execution_count": 72,
+ "execution_count": 8,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mInitializing schema validator...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mValidating input script...\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0m...done\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mParsed script:\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
"\n",
"\t\n",
"\t\t\n",
@@ -528,24 +582,26 @@
"\t\n",
"\t\n",
- "\u001b[0mcore.scoring.ScoreFunctionFactory: \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
- "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: \u001b[0mdefined score function \"ref_2015\" with weights \"ref2015\"\n",
- "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: \u001b[0mDefined TaskOperation named \"no_design\" of type RestrictToRepacking\n",
- "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: \u001b[0mDefined TaskOperation named \"extrachi\" of type ExtraRotamersGeneric\n",
- "\u001b[0mprotocols.minimization_packing.MinMover: \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
- "\u001b[0mcore.pack.task.xml_util: \u001b[0mObject pack1 reading the following task_operations: Adding the following task operations\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"ref_2015\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: {0} \u001b[0mDefined TaskOperation named \"no_design\" of type RestrictToRepacking\n",
+ "\u001b[0mprotocols.jd2.parser.TaskOperationLoader: {0} \u001b[0mDefined TaskOperation named \"extrachi\" of type ExtraRotamersGeneric\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
+ "\u001b[0mcore.pack.task.xml_util: {0} \u001b[0mObject pack1 reading the following task_operations: Adding the following task operations\n",
"no_design extrachi\n",
- "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: \u001b[0mDefined mover named \"pack1\" of type PackRotamersMover\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0mParsedProtocol mover with the following movers and filters\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"pack1\" with filter \"true_filter\"\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0madded mover \"min_torsion\" with filter \"true_filter\"\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER PackRotamersMover - pack1=======================\n",
- "\u001b[0mcore.pack.pack_rotamers: \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
- "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: \u001b[0mInstantiating DensePDInteractionGraph\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0m=======================BEGIN MOVER MinMover - min_torsion=======================\n",
- "\u001b[0mcore.select.residue_selector.ResidueSpanSelector: \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Residue span end designation 'Residue 999' is outside the Pose!\n",
- "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: \u001b[0msetting status to success\n"
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"pack1\" of type PackRotamersMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"pack1\"\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"min_torsion\"\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER PackRotamersMover - pack1=======================\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
+ "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0m=======================BEGIN MOVER MinMover - min_torsion=======================\n",
+ "\u001b[0mcore.select.residue_selector.ResidueSpanSelector: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m Residue span end designation 'Residue 999' is outside the Pose!\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0msetting status to success\n"
]
}
],
@@ -604,14 +660,14 @@
},
{
"cell_type": "code",
- "execution_count": 73,
+ "execution_count": 9,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "32.66393846891525 -198.97754213624194\n"
+ "32.66393846892796 -204.98731243884194\n"
]
}
],
@@ -632,9 +688,18 @@
},
{
"cell_type": "code",
- "execution_count": 55,
+ "execution_count": 10,
"metadata": {},
- "outputs": [],
+ "outputs": [
+ {
+ "name": "stderr",
+ "output_type": "stream",
+ "text": [
+ "/opt/miniconda3/lib/python3.7/site-packages/ipykernel_launcher.py:6: UserWarning: Import of 'rosetta' as a top-level module is deprecated and may be removed in 2018, import via 'pyrosetta.rosetta'.\n",
+ " \n"
+ ]
+ }
+ ],
"source": [
"#Python\n",
"from pyrosetta import *\n",
@@ -654,20 +719,20 @@
},
{
"cell_type": "code",
- "execution_count": 32,
+ "execution_count": 11,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "PyRosetta-4 2020 [Rosetta PyRosetta4.Release.python36.ubuntu 2020.28+release.8ecab77aa50ac1301efe53641e07e09ac91fee3b 2020-07-07T16:41:06] retrieved from: http://www.pyrosetta.org\n",
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.31+release.c7009b3115c22daa9efe2805d9d1ebba08426a54 2021-08-07T10:04:12] retrieved from: http://www.pyrosetta.org\n",
"(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
- "\u001b[0mcore.init: \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
- "\u001b[0mcore.init: \u001b[0mRosetta version: PyRosetta4.Release.python36.ubuntu r260 2020.28+release.8ecab77aa50 8ecab77aa50ac1301efe53641e07e09ac91fee3b http://www.pyrosetta.org 2020-07-07T16:41:06\n",
- "\u001b[0mcore.init: \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /home/huangjian/miniconda3/envs/biodesign/lib/python3.6/site-packages/pyrosetta-2020.28+release.8ecab77aa50-py3.6-linux-x86_64.egg/pyrosetta/database\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-546848207 seed_offset=0 real_seed=-546848207\n",
- "\u001b[0mbasic.random.init_random_generator: \u001b[0mRandomGenerator:init: Normal mode, seed=-546848207 RG_type=mt19937\n"
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r292 2021.31+release.c7009b3115c c7009b3115c22daa9efe2805d9d1ebba08426a54 http://www.pyrosetta.org 2021-08-07T10:04:12\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-208345754 seed_offset=0 real_seed=-208345754 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-208345754 RG_type=mt19937\n"
]
}
],
@@ -677,7 +742,7 @@
},
{
"cell_type": "code",
- "execution_count": 75,
+ "execution_count": 12,
"metadata": {},
"outputs": [
{
@@ -700,7 +765,7 @@
},
{
"cell_type": "code",
- "execution_count": 70,
+ "execution_count": 13,
"metadata": {},
"outputs": [],
"source": [
@@ -721,7 +786,7 @@
},
{
"cell_type": "code",
- "execution_count": 49,
+ "execution_count": 14,
"metadata": {},
"outputs": [],
"source": [
@@ -732,7 +797,7 @@
},
{
"cell_type": "code",
- "execution_count": 50,
+ "execution_count": 15,
"metadata": {},
"outputs": [
{
@@ -753,7 +818,7 @@
},
{
"cell_type": "code",
- "execution_count": 52,
+ "execution_count": 16,
"metadata": {},
"outputs": [
{
@@ -904,17 +969,19 @@
},
{
"cell_type": "code",
- "execution_count": 76,
+ "execution_count": 17,
"metadata": {},
"outputs": [
{
"name": "stdout",
"output_type": "stream",
"text": [
- "\u001b[0mcore.pack.task: \u001b[0mPacker task: initialize from command line()\n",
- "\u001b[0mcore.pack.pack_rotamers: \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
- "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: \u001b[0mInstantiating DensePDInteractionGraph\n",
- "32.66393846891525 -180.55738641185718\n"
+ "\u001b[0mcore.pack.task: {0} \u001b[0mPacker task: initialize from command line()\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mbuilt 2246 rotamers at 76 positions.\n",
+ "\u001b[0mcore.pack.pack_rotamers: {0} \u001b[0mRequesting all available threads for interaction graph computation.\n",
+ "\u001b[0mcore.pack.interaction_graph.interaction_graph_factory: {0} \u001b[0mInstantiating DensePDInteractionGraph\n",
+ "\u001b[0mcore.pack.rotamer_set.RotamerSets: {0} \u001b[0mCompleted interaction graph pre-calculation in 1 available threads (1 had been requested).\n",
+ "32.66393846892796 -208.75941216807576\n"
]
}
],
@@ -978,7 +1045,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.10"
+ "version": "3.7.10"
}
},
"nbformat": 4,
diff --git a/9_XmlObject/9_3_XmlObject.ipynb b/9_XmlObject/9_3_XmlObject.ipynb
new file mode 100644
index 0000000..1231ebe
--- /dev/null
+++ b/9_XmlObject/9_3_XmlObject.ipynb
@@ -0,0 +1,374 @@
+{
+ "cells": [
+ {
+ "cell_type": "markdown",
+ "id": "4d50c9fa-0422-4c70-b5c5-49a90edbffe7",
+ "metadata": {},
+ "source": [
+ "# XmlObjects的基本用法\n",
+ "\n",
+ "@Author: 吴炜坤\n",
+ "\n",
+ "@E-mail: weikun.wu@xtalpi.com"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "71494982-1f97-412d-87ed-3a7150d91cb3",
+ "metadata": {},
+ "source": [
+ "### 1. 为什么有XmlObject？\n",
+ "在最早期，Rosetta的mover、filter等都没有为python api流程参数控制的接口，导致部分的组件无法直接调用，只能通过xml脚本读取参数，然后生成对应的对象。\n",
+ "\n",
+ "XmlObjects是在PyRosetta中直接使用xml脚本最直接的方法，特别是某些Mover没有做好Pyrosetta接口时特别有用。但是缺点是加载XmlObjects的速度并不理想，比纯粹的PyRosetta脚本启动要慢。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "06da9647-eda0-4cbc-80a5-fb0ce6704f13",
+ "metadata": {},
+ "source": [
+ "### 2. 如何使用XmlObject?\n",
+ "最方便的方法有两种调用方式:\n",
+ "1. create_from_string\n",
+ "2. create_from_file"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "647d98fd-e38e-4c68-8843-8cd41ec39f26",
+ "metadata": {},
+ "source": [
+ "#### 2.1 create_from_string\n",
+ "从字符串文本中提取信息，返回XmlObjects"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 3,
+ "id": "0743b33d-8a9b-441a-9d3b-db8f052fe7cc",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-2025690693 seed_offset=0 real_seed=-2025690693 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-2025690693 RG_type=mt19937\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\t\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 984 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.682139 seconds.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/fd/prepro.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.all.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.gly.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.pro.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/omega/omega_ppdep.valile.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/P_AA_n\n",
+ "\u001b[0mcore.scoring.P_AA: {0} \u001b[0mshapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mStarting energy table calculation\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: changing atr/rep split to bottom of energy well\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing lj etables (maxdis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0msmooth_etable: spline smoothing solvation etables (max_dis = 6)\n",
+ "\u001b[0mcore.scoring.etable: {0} \u001b[0mFinished calculating energy tables.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/PairEPotential/pdb_pair_stats_fine\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/InterchainPotential/interchain_pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/env_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/pair_log.txt\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mshapovalov_lib::shap_rama_smooth_level of 4( aka highest_smooth ) got activated.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/shapovalov/kappa25/all.ramaProb\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/avg_L_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/avg_L_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_all_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_all_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_G_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_G_rama_str.dat.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/rama/flat/sym_P_rama_str.dat\n",
+ "\u001b[0mcore.scoring.ramachandran: {0} \u001b[0mReading custom Ramachandran table from scoring/score_functions/rama/flat/sym_P_rama_str.dat.\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"sfxn1\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"setTorsion\" of type SetTorsion\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "from pyrosetta import init\n",
+ "\n",
+ "# 初始化脚本:\n",
+ "init()\n",
+ "xml = rosetta_scripts.XmlObjects.create_from_string('''\n",
+ "\n",
+ " \n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ " \n",
+ "\t \n",
+ "\t\t \n",
+ "\t\t \n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "\n",
+ "''')"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "837479ff-3402-4018-b646-0b94dcf4902e",
+ "metadata": {},
+ "source": [
+ "**提取Filter、Mover、Selector、SimpleMetric、TaskOperation的语法语句**"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 9,
+ "id": "5f7fa7a8-13fb-4286-99f9-848277443082",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ ""
+ ]
+ },
+ "execution_count": 9,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# get a mover:\n",
+ "mover_ = xml.get_mover(\"setTorsion\")\n",
+ "mover_\n",
+ "\n",
+ "# 如此类推:\n",
+ "# filter_ = xml.get_filter(name)\n",
+ "# selector_ = xml.get_residue_selector(name)\n",
+ "# score_ = xml.get_score_function(name)\n",
+ "# sm_ = xml.get_simple_metric(name)\n",
+ "# tf_ = xml.get_task_operation(name)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 10,
+ "id": "ea7c9597-8eaf-4964-9404-f3f5001cc26c",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "vector1_std_string[ParsedProtocol, null, setTorsion]"
+ ]
+ },
+ "execution_count": 10,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "#列表式所选内容。\n",
+ "xml.list_movers()\n",
+ "\n",
+ "# 如此类推:\n",
+ "# xml.list_filters()\n",
+ "# xml.list_residue_selectors()\n",
+ "# xml.list_score_functions()\n",
+ "# xml.list_simple_metrics()\n",
+ "# xml.list_task_operations()"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "707259f6-6bef-416f-9fdf-20ea673f425a",
+ "metadata": {},
+ "source": [
+ "#### 2.2 create_from_file\n",
+ "从字符串文本中提取信息，返回XmlObjects"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 11,
+ "id": "b4e9c8e4-7d98-4a65-94a0-6ff971cfd88e",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mGenerating XML Schema for rosetta_scripts...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mInitializing schema validator...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mValidating input script...\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0m...done\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mParsed script:\n",
+ "\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\t\n",
+ "\t\t\t\n",
+ "\t\t\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\n",
+ "\t\t\n",
+ "\t\n",
+ "\t\n",
+ "\u001b[0mcore.scoring.ScoreFunctionFactory: {0} \u001b[0mSCOREFUNCTION: \u001b[32mref2015\u001b[0m\n",
+ "\u001b[0mcore.mm.MMLJLibrary: {0} \u001b[0mMM lj sets added: 105\n",
+ "\u001b[0mcore.mm.MMTorsionLibrary: {0} \u001b[0mMM torsion sets added fully assigned: 1039; wildcard: 48 and 1 virtual parameter.\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"molmech\" with weights \"mm_std_fa_elec_dslf_fa13\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0mdefined score function \"r15_cart\" with weights \"ref2015\"\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight pro_close to 0\n",
+ "\u001b[0mprotocols.jd2.parser.ScoreFunctionLoader: {0} \u001b[0m setting r15_cart weight cart_bonded to 0.625\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mInitializing IdealParametersDatabase with default Ks=300 , 80 , 80 , 10 , 80\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-lengths.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 759 bb-independent lengths.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-angles.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1434 bb-independent angles.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-torsions.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 1 bb-independent torsions.\n",
+ "\u001b[0mbasic.io.database: {0} \u001b[0mDatabase file opened: scoring/score_functions/bondlength_bondangle/default-improper.txt\n",
+ "\u001b[0mcore.energy_methods.CartesianBondedEnergy: {0} \u001b[0mRead 529 bb-independent improper tors.\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_torsion\" of type MinMover\n",
+ "\u001b[0mprotocols.minimization_packing.MinMover: {0} \u001b[0mOptions chi, bb: 1, 1 omega: 1\n",
+ "\u001b[0mprotocols.rosetta_scripts.RosettaScriptsParser: {0} \u001b[0mDefined mover named \"min_cart\" of type MinMover\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mParsedProtocol mover with the following settings\n",
+ "\u001b[0mprotocols.rosetta_scripts.ParsedProtocol: {0} \u001b[0mAdded mover \"min_cart\"\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols import rosetta_scripts \n",
+ "xml = rosetta_scripts.XmlObjects.create_from_file('./data/Example2-MinMover.xml')"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "f4ab1ba4-c717-4a15-9b5c-579f02bd225c",
+ "metadata": {},
+ "source": [
+ "### 3. RosettaScript所有的API\n",
+ "\n",
+ "详见: https://new.rosettacommons.org/docs/latest/scripting_documentation/RosettaScripts/RosettaScripts"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "0c7b732c-36bd-45d7-9075-bf7614dcb043",
+ "metadata": {},
+ "source": [
+ "#### 结语: \n",
+ "RosettaScript大而全，Python API灵活速度快！"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "id": "6db9e0f5-c610-45eb-840d-499887a4ae37",
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ }
+ ],
+ "metadata": {
+ "kernelspec": {
+ "display_name": "Python 3",
+ "language": "python",
+ "name": "python3"
+ },
+ "language_info": {
+ "codemirror_mode": {
+ "name": "ipython",
+ "version": 3
+ },
+ "file_extension": ".py",
+ "mimetype": "text/x-python",
+ "name": "python",
+ "nbconvert_exporter": "python",
+ "pygments_lexer": "ipython3",
+ "version": "3.7.10"
+ }
+ },
+ "nbformat": 4,
+ "nbformat_minor": 5
+}
diff --git a/9_xmlObject_RosettaScript/data/.ipynb_checkpoints/Example-ScoreFunction-checkpoint.xml b/9_XmlObject/data/.ipynb_checkpoints/Example-ScoreFunction-checkpoint.xml
similarity index 100%
rename from 9_xmlObject_RosettaScript/data/.ipynb_checkpoints/Example-ScoreFunction-checkpoint.xml
rename to 9_XmlObject/data/.ipynb_checkpoints/Example-ScoreFunction-checkpoint.xml
diff --git a/9_xmlObject_RosettaScript/data/.ipynb_checkpoints/Example2-MinMover-checkpoint.xml b/9_XmlObject/data/.ipynb_checkpoints/Example2-MinMover-checkpoint.xml
similarity index 100%
rename from 9_xmlObject_RosettaScript/data/.ipynb_checkpoints/Example2-MinMover-checkpoint.xml
rename to 9_XmlObject/data/.ipynb_checkpoints/Example2-MinMover-checkpoint.xml
diff --git a/9_xmlObject_RosettaScript/data/.ipynb_checkpoints/min_L1-checkpoint.xml b/9_XmlObject/data/.ipynb_checkpoints/min_L1-checkpoint.xml
similarity index 100%
rename from 9_xmlObject_RosettaScript/data/.ipynb_checkpoints/min_L1-checkpoint.xml
rename to 9_XmlObject/data/.ipynb_checkpoints/min_L1-checkpoint.xml
diff --git a/9_xmlObject_RosettaScript/data/1ubq_clean.pdb b/9_XmlObject/data/1ubq_clean.pdb
similarity index 100%
rename from 9_xmlObject_RosettaScript/data/1ubq_clean.pdb
rename to 9_XmlObject/data/1ubq_clean.pdb
diff --git a/9_xmlObject_RosettaScript/data/Example-ScoreFunction.xml b/9_XmlObject/data/Example-ScoreFunction.xml
similarity index 100%
rename from 9_xmlObject_RosettaScript/data/Example-ScoreFunction.xml
rename to 9_XmlObject/data/Example-ScoreFunction.xml
diff --git a/9_xmlObject_RosettaScript/data/Example2-MinMover.xml b/9_XmlObject/data/Example2-MinMover.xml
similarity index 100%
rename from 9_xmlObject_RosettaScript/data/Example2-MinMover.xml
rename to 9_XmlObject/data/Example2-MinMover.xml
diff --git a/9_xmlObject_RosettaScript/data/min_L1.xml b/9_XmlObject/data/min_L1.xml
similarity index 100%
rename from 9_xmlObject_RosettaScript/data/min_L1.xml
rename to 9_XmlObject/data/min_L1.xml
diff --git a/9_xmlObject_RosettaScript/data/my_ab.pdb b/9_XmlObject/data/my_ab.pdb
similarity index 100%
rename from 9_xmlObject_RosettaScript/data/my_ab.pdb
rename to 9_XmlObject/data/my_ab.pdb
diff --git a/9_XmlObject/data/my_lab_test.pdb b/9_XmlObject/data/my_lab_test.pdb
new file mode 100644
index 0000000..39a81f7
--- /dev/null
+++ b/9_XmlObject/data/my_lab_test.pdb
@@ -0,0 +1,16165 @@
+HEADER 31-AUG-21 XXXX
+EXPDTA THEORETICAL MODEL
+REMARK 220
+REMARK 220 EXPERIMENTAL DETAILS
+REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
+REMARK 220 DATE OF DATA COLLECTION : 31-AUG-21
+REMARK 220
+REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
+REMARK 220 VERSION 2021.31+release.c7009b3115c
+SSBOND CYS H 23 CYS H 106 2.03
+SSBOND CYS L 23 CYS L 106 2.05
+ATOM 1 N SER A 7 15.339 57.506 19.365 1.00 64.53 N
+ATOM 2 CA SER A 7 15.398 57.332 20.809 1.00 66.36 C
+ATOM 3 C SER A 7 14.005 57.114 21.388 1.00 64.54 C
+ATOM 4 O SER A 7 13.209 58.054 21.491 1.00 66.07 O
+ATOM 5 CB SER A 7 16.048 58.547 21.440 1.00 66.43 C
+ATOM 6 OG SER A 7 16.098 58.427 22.831 1.00 74.70 O
+ATOM 7 1H SER A 7 16.260 57.387 18.969 1.00 0.00 H
+ATOM 8 2H SER A 7 14.709 56.820 18.973 1.00 0.00 H
+ATOM 9 3H SER A 7 14.999 58.433 19.161 1.00 0.00 H
+ATOM 10 HA SER A 7 16.006 56.456 21.030 1.00 0.00 H
+ATOM 11 1HB SER A 7 17.059 58.663 21.045 1.00 0.00 H
+ATOM 12 2HB SER A 7 15.486 59.439 21.170 1.00 0.00 H
+ATOM 13 HG SER A 7 16.574 57.614 23.011 1.00 0.00 H
+ATOM 14 N ASP A 8 13.703 55.868 21.757 1.00 62.32 N
+ATOM 15 CA ASP A 8 12.393 55.518 22.306 1.00 62.01 C
+ATOM 16 C ASP A 8 12.117 56.198 23.644 1.00 59.03 C
+ATOM 17 O ASP A 8 13.044 56.462 24.425 1.00 54.13 O
+ATOM 18 CB ASP A 8 12.232 53.998 22.465 1.00 69.50 C
+ATOM 19 CG ASP A 8 12.110 53.258 21.117 1.00 77.46 C
+ATOM 20 OD1 ASP A 8 11.998 53.920 20.107 1.00 74.21 O
+ATOM 21 OD2 ASP A 8 12.107 52.043 21.116 1.00 73.17 O
+ATOM 22 H ASP A 8 14.393 55.135 21.660 1.00 0.00 H
+ATOM 23 HA ASP A 8 11.634 55.857 21.603 1.00 0.00 H
+ATOM 24 1HB ASP A 8 13.068 53.587 23.036 1.00 0.00 H
+ATOM 25 2HB ASP A 8 11.324 53.798 23.032 1.00 0.00 H
+ATOM 26 N PHE A 9 10.829 56.422 23.906 1.00 58.56 N
+ATOM 27 CA PHE A 9 10.354 57.008 25.154 1.00 58.32 C
+ATOM 28 C PHE A 9 9.079 56.332 25.609 1.00 59.17 C
+ATOM 29 O PHE A 9 8.419 55.652 24.822 1.00 58.66 O
+ATOM 30 CB PHE A 9 10.046 58.508 24.996 1.00 55.10 C
+ATOM 31 CG PHE A 9 8.895 58.846 24.083 1.00 54.54 C
+ATOM 32 CD1 PHE A 9 7.611 58.945 24.596 1.00 49.45 C
+ATOM 33 CD2 PHE A 9 9.087 59.103 22.735 1.00 54.85 C
+ATOM 34 CE1 PHE A 9 6.540 59.285 23.795 1.00 50.77 C
+ATOM 35 CE2 PHE A 9 8.013 59.446 21.928 1.00 47.68 C
+ATOM 36 CZ PHE A 9 6.741 59.537 22.464 1.00 54.78 C
+ATOM 37 H PHE A 9 10.150 56.183 23.198 1.00 0.00 H
+ATOM 38 HA PHE A 9 11.109 56.855 25.921 1.00 0.00 H
+ATOM 39 1HB PHE A 9 9.806 58.926 25.963 1.00 0.00 H
+ATOM 40 2HB PHE A 9 10.914 59.020 24.637 1.00 0.00 H
+ATOM 41 HD1 PHE A 9 7.455 58.747 25.656 1.00 0.00 H
+ATOM 42 HD2 PHE A 9 10.094 59.038 22.312 1.00 0.00 H
+ATOM 43 HE1 PHE A 9 5.542 59.354 24.223 1.00 0.00 H
+ATOM 44 HE2 PHE A 9 8.169 59.648 20.868 1.00 0.00 H
+ATOM 45 HZ PHE A 9 5.908 59.809 21.832 1.00 0.00 H
+ATOM 46 N VAL A 10 8.735 56.532 26.878 1.00 61.75 N
+ATOM 47 CA VAL A 10 7.502 55.981 27.428 1.00 63.36 C
+ATOM 48 C VAL A 10 6.659 57.087 28.044 1.00 64.89 C
+ATOM 49 O VAL A 10 7.172 58.156 28.382 1.00 65.32 O
+ATOM 50 CB VAL A 10 7.825 54.929 28.510 1.00 65.58 C
+ATOM 51 CG1 VAL A 10 8.654 53.801 27.907 1.00 59.15 C
+ATOM 52 CG2 VAL A 10 8.572 55.591 29.661 1.00 68.39 C
+ATOM 53 H VAL A 10 9.360 57.081 27.463 1.00 0.00 H
+ATOM 54 HA VAL A 10 6.929 55.511 26.629 1.00 0.00 H
+ATOM 55 HB VAL A 10 6.888 54.496 28.880 1.00 0.00 H
+ATOM 56 1HG1 VAL A 10 8.871 53.074 28.661 1.00 0.00 H
+ATOM 57 2HG1 VAL A 10 8.102 53.334 27.095 1.00 0.00 H
+ATOM 58 3HG1 VAL A 10 9.584 54.202 27.530 1.00 0.00 H
+ATOM 59 1HG2 VAL A 10 8.791 54.849 30.429 1.00 0.00 H
+ATOM 60 2HG2 VAL A 10 9.506 56.019 29.289 1.00 0.00 H
+ATOM 61 3HG2 VAL A 10 7.952 56.383 30.086 1.00 0.00 H
+ATOM 62 N VAL A 11 5.364 56.825 28.207 1.00 65.00 N
+ATOM 63 CA VAL A 11 4.456 57.787 28.832 1.00 63.60 C
+ATOM 64 C VAL A 11 3.887 57.218 30.112 1.00 63.86 C
+ATOM 65 O VAL A 11 3.275 56.154 30.092 1.00 62.20 O
+ATOM 66 CB VAL A 11 3.271 58.113 27.909 1.00 60.82 C
+ATOM 67 CG1 VAL A 11 2.337 59.078 28.589 1.00 64.97 C
+ATOM 68 CG2 VAL A 11 3.767 58.657 26.575 1.00 60.61 C
+ATOM 69 H VAL A 11 5.005 55.923 27.894 1.00 0.00 H
+ATOM 70 HA VAL A 11 5.004 58.699 29.064 1.00 0.00 H
+ATOM 71 HB VAL A 11 2.714 57.224 27.746 1.00 0.00 H
+ATOM 72 1HG1 VAL A 11 1.497 59.260 27.930 1.00 0.00 H
+ATOM 73 2HG1 VAL A 11 1.979 58.641 29.524 1.00 0.00 H
+ATOM 74 3HG1 VAL A 11 2.847 60.006 28.800 1.00 0.00 H
+ATOM 75 1HG2 VAL A 11 2.911 58.859 25.926 1.00 0.00 H
+ATOM 76 2HG2 VAL A 11 4.311 59.558 26.728 1.00 0.00 H
+ATOM 77 3HG2 VAL A 11 4.413 57.929 26.105 1.00 0.00 H
+ATOM 78 N ILE A 12 4.076 57.916 31.224 1.00 63.21 N
+ATOM 79 CA ILE A 12 3.582 57.431 32.504 1.00 63.26 C
+ATOM 80 C ILE A 12 2.610 58.418 33.155 1.00 63.26 C
+ATOM 81 O ILE A 12 2.976 59.564 33.431 1.00 63.46 O
+ATOM 82 CB ILE A 12 4.775 57.186 33.441 1.00 62.98 C
+ATOM 83 CG1 ILE A 12 5.742 56.168 32.787 1.00 60.93 C
+ATOM 84 CG2 ILE A 12 4.262 56.657 34.792 1.00 60.06 C
+ATOM 85 CD1 ILE A 12 7.068 56.091 33.443 1.00 60.67 C
+ATOM 86 H ILE A 12 4.602 58.784 31.187 1.00 0.00 H
+ATOM 87 HA ILE A 12 3.053 56.493 32.346 1.00 0.00 H
+ATOM 88 HB ILE A 12 5.324 58.115 33.591 1.00 0.00 H
+ATOM 89 1HG1 ILE A 12 5.291 55.195 32.822 1.00 0.00 H
+ATOM 90 2HG1 ILE A 12 5.905 56.435 31.750 1.00 0.00 H
+ATOM 91 1HG2 ILE A 12 5.095 56.475 35.456 1.00 0.00 H
+ATOM 92 2HG2 ILE A 12 3.595 57.393 35.239 1.00 0.00 H
+ATOM 93 3HG2 ILE A 12 3.718 55.726 34.636 1.00 0.00 H
+ATOM 94 1HD1 ILE A 12 7.687 55.349 32.933 1.00 0.00 H
+ATOM 95 2HD1 ILE A 12 7.553 57.066 33.391 1.00 0.00 H
+ATOM 96 3HD1 ILE A 12 6.937 55.812 34.468 1.00 0.00 H
+ATOM 97 N LYS A 13 1.379 57.975 33.420 1.00 62.74 N
+ATOM 98 CA LYS A 13 0.372 58.832 34.045 1.00 62.27 C
+ATOM 99 C LYS A 13 -0.018 58.390 35.438 1.00 62.08 C
+ATOM 100 O LYS A 13 -0.536 57.289 35.642 1.00 60.11 O
+ATOM 101 CB LYS A 13 -0.904 58.891 33.224 1.00 55.20 C
+ATOM 102 CG LYS A 13 -1.972 59.731 33.890 1.00 58.93 C
+ATOM 103 CD LYS A 13 -3.234 59.791 33.098 1.00 59.61 C
+ATOM 104 CE LYS A 13 -4.309 60.481 33.926 1.00 62.37 C
+ATOM 105 NZ LYS A 13 -5.567 60.659 33.186 1.00 59.33 N
+ATOM 106 H LYS A 13 1.128 57.023 33.159 1.00 0.00 H
+ATOM 107 HA LYS A 13 0.780 59.839 34.126 1.00 0.00 H
+ATOM 108 1HB LYS A 13 -0.699 59.286 32.234 1.00 0.00 H
+ATOM 109 2HB LYS A 13 -1.303 57.902 33.112 1.00 0.00 H
+ATOM 110 1HG LYS A 13 -2.201 59.307 34.869 1.00 0.00 H
+ATOM 111 2HG LYS A 13 -1.597 60.745 34.042 1.00 0.00 H
+ATOM 112 1HD LYS A 13 -3.069 60.352 32.175 1.00 0.00 H
+ATOM 113 2HD LYS A 13 -3.558 58.781 32.845 1.00 0.00 H
+ATOM 114 1HE LYS A 13 -4.502 59.873 34.806 1.00 0.00 H
+ATOM 115 2HE LYS A 13 -3.950 61.460 34.246 1.00 0.00 H
+ATOM 116 1HZ LYS A 13 -6.258 61.122 33.802 1.00 0.00 H
+ATOM 117 2HZ LYS A 13 -5.361 61.262 32.375 1.00 0.00 H
+ATOM 118 3HZ LYS A 13 -5.933 59.774 32.882 1.00 0.00 H
+ATOM 119 N ALA A 14 0.210 59.245 36.419 1.00 64.01 N
+ATOM 120 CA ALA A 14 -0.115 58.850 37.776 1.00 62.56 C
+ATOM 121 C ALA A 14 -1.616 58.719 37.964 1.00 61.38 C
+ATOM 122 O ALA A 14 -2.371 59.658 37.694 1.00 59.00 O
+ATOM 123 CB ALA A 14 0.435 59.853 38.754 1.00 65.80 C
+ATOM 124 H ALA A 14 0.609 60.167 36.222 1.00 0.00 H
+ATOM 125 HA ALA A 14 0.333 57.876 37.955 1.00 0.00 H
+ATOM 126 1HB ALA A 14 0.212 59.549 39.773 1.00 0.00 H
+ATOM 127 2HB ALA A 14 1.488 59.906 38.620 1.00 0.00 H
+ATOM 128 3HB ALA A 14 -0.008 60.817 38.555 1.00 0.00 H
+ATOM 129 N LEU A 15 -2.056 57.587 38.497 1.00 61.85 N
+ATOM 130 CA LEU A 15 -3.473 57.397 38.766 1.00 64.15 C
+ATOM 131 C LEU A 15 -3.759 57.600 40.256 1.00 66.00 C
+ATOM 132 O LEU A 15 -4.907 57.555 40.702 1.00 65.45 O
+ATOM 133 CB LEU A 15 -3.896 56.026 38.246 1.00 57.67 C
+ATOM 134 CG LEU A 15 -3.711 55.853 36.697 1.00 59.31 C
+ATOM 135 CD1 LEU A 15 -4.047 54.426 36.271 1.00 47.95 C
+ATOM 136 CD2 LEU A 15 -4.576 56.853 35.988 1.00 47.42 C
+ATOM 137 H LEU A 15 -1.415 56.822 38.711 1.00 0.00 H
+ATOM 138 HA LEU A 15 -4.036 58.148 38.215 1.00 0.00 H
+ATOM 139 1HB LEU A 15 -3.291 55.296 38.739 1.00 0.00 H
+ATOM 140 2HB LEU A 15 -4.941 55.846 38.498 1.00 0.00 H
+ATOM 141 HG LEU A 15 -2.696 56.053 36.431 1.00 0.00 H
+ATOM 142 1HD1 LEU A 15 -3.915 54.323 35.202 1.00 0.00 H
+ATOM 143 2HD1 LEU A 15 -3.386 53.733 36.772 1.00 0.00 H
+ATOM 144 3HD1 LEU A 15 -5.078 54.193 36.524 1.00 0.00 H
+ATOM 145 1HD2 LEU A 15 -4.437 56.755 34.912 1.00 0.00 H
+ATOM 146 2HD2 LEU A 15 -5.622 56.677 36.239 1.00 0.00 H
+ATOM 147 3HD2 LEU A 15 -4.289 57.856 36.302 1.00 0.00 H
+ATOM 148 N GLU A 16 -2.691 57.869 41.008 1.00 65.91 N
+ATOM 149 CA GLU A 16 -2.768 58.153 42.439 1.00 68.71 C
+ATOM 150 C GLU A 16 -1.584 59.017 42.867 1.00 69.35 C
+ATOM 151 O GLU A 16 -0.557 59.050 42.198 1.00 70.62 O
+ATOM 152 CB GLU A 16 -2.818 56.865 43.272 1.00 62.31 C
+ATOM 153 CG GLU A 16 -1.579 55.971 43.211 1.00 77.77 C
+ATOM 154 CD GLU A 16 -1.752 54.692 44.042 1.00 83.97 C
+ATOM 155 OE1 GLU A 16 -2.742 54.587 44.730 1.00 92.63 O
+ATOM 156 OE2 GLU A 16 -0.918 53.808 43.948 1.00 81.95 O
+ATOM 157 H GLU A 16 -1.789 57.875 40.556 1.00 0.00 H
+ATOM 158 HA GLU A 16 -3.682 58.716 42.632 1.00 0.00 H
+ATOM 159 1HB GLU A 16 -2.989 57.120 44.320 1.00 0.00 H
+ATOM 160 2HB GLU A 16 -3.662 56.261 42.940 1.00 0.00 H
+ATOM 161 1HG GLU A 16 -1.372 55.713 42.180 1.00 0.00 H
+ATOM 162 2HG GLU A 16 -0.724 56.533 43.594 1.00 0.00 H
+ATOM 163 N ASP A 17 -1.725 59.740 43.969 1.00 69.28 N
+ATOM 164 CA ASP A 17 -0.590 60.500 44.479 1.00 70.34 C
+ATOM 165 C ASP A 17 0.523 59.550 44.906 1.00 70.33 C
+ATOM 166 O ASP A 17 0.250 58.550 45.573 1.00 72.91 O
+ATOM 167 CB ASP A 17 -0.999 61.348 45.690 1.00 72.39 C
+ATOM 168 CG ASP A 17 -1.910 62.543 45.375 1.00 77.07 C
+ATOM 169 OD1 ASP A 17 -2.066 62.896 44.221 1.00 75.03 O
+ATOM 170 OD2 ASP A 17 -2.441 63.100 46.304 1.00 82.23 O
+ATOM 171 H ASP A 17 -2.596 59.721 44.480 1.00 0.00 H
+ATOM 172 HA ASP A 17 -0.206 61.142 43.690 1.00 0.00 H
+ATOM 173 1HB ASP A 17 -1.505 60.711 46.419 1.00 0.00 H
+ATOM 174 2HB ASP A 17 -0.095 61.725 46.172 1.00 0.00 H
+ATOM 175 N GLY A 18 1.778 59.906 44.634 1.00 67.68 N
+ATOM 176 CA GLY A 18 2.885 59.094 45.140 1.00 66.57 C
+ATOM 177 C GLY A 18 3.449 58.100 44.129 1.00 65.43 C
+ATOM 178 O GLY A 18 4.123 57.140 44.508 1.00 64.56 O
+ATOM 179 H GLY A 18 1.972 60.710 44.038 1.00 0.00 H
+ATOM 180 1HA GLY A 18 3.687 59.760 45.462 1.00 0.00 H
+ATOM 181 2HA GLY A 18 2.556 58.557 46.028 1.00 0.00 H
+ATOM 182 N VAL A 19 3.155 58.301 42.855 1.00 62.00 N
+ATOM 183 CA VAL A 19 3.701 57.417 41.831 1.00 60.98 C
+ATOM 184 C VAL A 19 5.171 57.724 41.676 1.00 60.74 C
+ATOM 185 O VAL A 19 5.570 58.888 41.666 1.00 61.30 O
+ATOM 186 CB VAL A 19 2.923 57.529 40.518 1.00 65.68 C
+ATOM 187 CG1 VAL A 19 3.626 56.767 39.387 1.00 73.10 C
+ATOM 188 CG2 VAL A 19 1.563 56.930 40.752 1.00 65.45 C
+ATOM 189 H VAL A 19 2.609 59.118 42.590 1.00 0.00 H
+ATOM 190 HA VAL A 19 3.604 56.387 42.174 1.00 0.00 H
+ATOM 191 HB VAL A 19 2.828 58.545 40.249 1.00 0.00 H
+ATOM 192 1HG1 VAL A 19 3.053 56.862 38.475 1.00 0.00 H
+ATOM 193 2HG1 VAL A 19 4.618 57.185 39.224 1.00 0.00 H
+ATOM 194 3HG1 VAL A 19 3.714 55.712 39.659 1.00 0.00 H
+ATOM 195 1HG2 VAL A 19 0.970 56.993 39.868 1.00 0.00 H
+ATOM 196 2HG2 VAL A 19 1.671 55.888 41.032 1.00 0.00 H
+ATOM 197 3HG2 VAL A 19 1.075 57.461 41.552 1.00 0.00 H
+ATOM 198 N ASN A 20 5.986 56.682 41.622 1.00 59.70 N
+ATOM 199 CA ASN A 20 7.429 56.858 41.584 1.00 60.64 C
+ATOM 200 C ASN A 20 8.065 56.211 40.362 1.00 60.03 C
+ATOM 201 O ASN A 20 7.961 54.997 40.154 1.00 56.10 O
+ATOM 202 CB ASN A 20 8.033 56.324 42.871 1.00 63.15 C
+ATOM 203 CG ASN A 20 9.486 56.599 43.024 1.00 63.24 C
+ATOM 204 OD1 ASN A 20 10.216 55.773 43.581 1.00 59.55 O
+ATOM 205 ND2 ASN A 20 9.923 57.737 42.572 1.00 63.52 N
+ATOM 206 H ASN A 20 5.587 55.747 41.622 1.00 0.00 H
+ATOM 207 HA ASN A 20 7.645 57.925 41.523 1.00 0.00 H
+ATOM 208 1HB ASN A 20 7.502 56.752 43.724 1.00 0.00 H
+ATOM 209 2HB ASN A 20 7.892 55.257 42.916 1.00 0.00 H
+ATOM 210 1HD2 ASN A 20 10.889 57.976 42.677 1.00 0.00 H
+ATOM 211 2HD2 ASN A 20 9.295 58.386 42.140 1.00 0.00 H
+ATOM 212 N VAL A 21 8.666 57.049 39.517 1.00 60.07 N
+ATOM 213 CA VAL A 21 9.313 56.590 38.301 1.00 60.61 C
+ATOM 214 C VAL A 21 10.823 56.659 38.517 1.00 60.58 C
+ATOM 215 O VAL A 21 11.373 57.716 38.837 1.00 60.68 O
+ATOM 216 CB VAL A 21 8.896 57.457 37.105 1.00 56.51 C
+ATOM 217 CG1 VAL A 21 9.589 56.948 35.860 1.00 67.59 C
+ATOM 218 CG2 VAL A 21 7.374 57.427 36.966 1.00 45.89 C
+ATOM 219 H VAL A 21 8.701 58.041 39.743 1.00 0.00 H
+ATOM 220 HA VAL A 21 9.029 55.558 38.106 1.00 0.00 H
+ATOM 221 HB VAL A 21 9.224 58.482 37.266 1.00 0.00 H
+ATOM 222 1HG1 VAL A 21 9.316 57.557 35.008 1.00 0.00 H
+ATOM 223 2HG1 VAL A 21 10.668 56.990 35.999 1.00 0.00 H
+ATOM 224 3HG1 VAL A 21 9.285 55.923 35.684 1.00 0.00 H
+ATOM 225 1HG2 VAL A 21 7.071 58.043 36.120 1.00 0.00 H
+ATOM 226 2HG2 VAL A 21 7.050 56.405 36.808 1.00 0.00 H
+ATOM 227 3HG2 VAL A 21 6.917 57.816 37.877 1.00 0.00 H
+ATOM 228 N ILE A 22 11.485 55.519 38.392 1.00 59.37 N
+ATOM 229 CA ILE A 22 12.895 55.426 38.724 1.00 60.60 C
+ATOM 230 C ILE A 22 13.779 55.163 37.514 1.00 62.32 C
+ATOM 231 O ILE A 22 13.529 54.246 36.729 1.00 61.31 O
+ATOM 232 CB ILE A 22 13.099 54.306 39.752 1.00 61.02 C
+ATOM 233 CG1 ILE A 22 12.287 54.603 41.004 1.00 65.63 C
+ATOM 234 CG2 ILE A 22 14.563 54.185 40.105 1.00 63.20 C
+ATOM 235 CD1 ILE A 22 12.200 53.431 41.942 1.00 56.85 C
+ATOM 236 H ILE A 22 10.984 54.687 38.108 1.00 0.00 H
+ATOM 237 HA ILE A 22 13.204 56.365 39.174 1.00 0.00 H
+ATOM 238 HB ILE A 22 12.745 53.386 39.347 1.00 0.00 H
+ATOM 239 1HG1 ILE A 22 12.743 55.442 41.531 1.00 0.00 H
+ATOM 240 2HG1 ILE A 22 11.273 54.882 40.721 1.00 0.00 H
+ATOM 241 1HG2 ILE A 22 14.699 53.391 40.836 1.00 0.00 H
+ATOM 242 2HG2 ILE A 22 15.146 53.958 39.217 1.00 0.00 H
+ATOM 243 3HG2 ILE A 22 14.901 55.134 40.527 1.00 0.00 H
+ATOM 244 1HD1 ILE A 22 11.612 53.712 42.809 1.00 0.00 H
+ATOM 245 2HD1 ILE A 22 11.721 52.595 41.429 1.00 0.00 H
+ATOM 246 3HD1 ILE A 22 13.200 53.142 42.259 1.00 0.00 H
+ATOM 247 N GLY A 23 14.812 55.991 37.353 1.00 61.71 N
+ATOM 248 CA GLY A 23 15.767 55.808 36.264 1.00 59.83 C
+ATOM 249 C GLY A 23 16.908 54.907 36.726 1.00 60.23 C
+ATOM 250 O GLY A 23 17.576 55.206 37.727 1.00 60.12 O
+ATOM 251 H GLY A 23 14.954 56.730 38.036 1.00 0.00 H
+ATOM 252 1HA GLY A 23 15.269 55.366 35.400 1.00 0.00 H
+ATOM 253 2HA GLY A 23 16.162 56.775 35.956 1.00 0.00 H
+ATOM 254 N LEU A 24 17.147 53.832 35.958 1.00 59.28 N
+ATOM 255 CA LEU A 24 18.184 52.830 36.231 1.00 58.97 C
+ATOM 256 C LEU A 24 19.355 53.007 35.273 1.00 59.13 C
+ATOM 257 O LEU A 24 19.171 53.122 34.050 1.00 60.17 O
+ATOM 258 CB LEU A 24 17.618 51.415 36.083 1.00 59.13 C
+ATOM 259 CG LEU A 24 16.709 50.883 37.222 1.00 62.56 C
+ATOM 260 CD1 LEU A 24 15.349 51.573 37.156 1.00 59.34 C
+ATOM 261 CD2 LEU A 24 16.546 49.366 37.078 1.00 54.54 C
+ATOM 262 H LEU A 24 16.545 53.669 35.154 1.00 0.00 H
+ATOM 263 HA LEU A 24 18.547 52.956 37.244 1.00 0.00 H
+ATOM 264 1HB LEU A 24 17.032 51.420 35.198 1.00 0.00 H
+ATOM 265 2HB LEU A 24 18.446 50.715 35.950 1.00 0.00 H
+ATOM 266 HG LEU A 24 17.162 51.113 38.187 1.00 0.00 H
+ATOM 267 1HD1 LEU A 24 14.721 51.206 37.961 1.00 0.00 H
+ATOM 268 2HD1 LEU A 24 15.473 52.632 37.263 1.00 0.00 H
+ATOM 269 3HD1 LEU A 24 14.873 51.363 36.200 1.00 0.00 H
+ATOM 270 1HD2 LEU A 24 15.908 48.983 37.881 1.00 0.00 H
+ATOM 271 2HD2 LEU A 24 16.089 49.139 36.119 1.00 0.00 H
+ATOM 272 3HD2 LEU A 24 17.523 48.885 37.138 1.00 0.00 H
+ATOM 273 N THR A 25 20.559 53.021 35.844 1.00 57.76 N
+ATOM 274 CA THR A 25 21.767 53.340 35.098 1.00 56.48 C
+ATOM 275 C THR A 25 22.178 52.379 34.003 1.00 55.43 C
+ATOM 276 O THR A 25 22.067 51.160 34.129 1.00 56.07 O
+ATOM 277 CB THR A 25 22.975 53.461 36.045 1.00 54.68 C
+ATOM 278 OG1 THR A 25 23.150 52.225 36.793 1.00 53.29 O
+ATOM 279 CG2 THR A 25 22.788 54.625 36.974 1.00 49.72 C
+ATOM 280 H THR A 25 20.625 52.875 36.847 1.00 0.00 H
+ATOM 281 HA THR A 25 21.606 54.307 34.648 1.00 0.00 H
+ATOM 282 HB THR A 25 23.877 53.636 35.458 1.00 0.00 H
+ATOM 283 HG1 THR A 25 23.805 51.654 36.340 1.00 0.00 H
+ATOM 284 1HG2 THR A 25 23.651 54.706 37.614 1.00 0.00 H
+ATOM 285 2HG2 THR A 25 22.690 55.531 36.380 1.00 0.00 H
+ATOM 286 3HG2 THR A 25 21.896 54.486 37.573 1.00 0.00 H
+ATOM 287 N ARG A 26 22.735 52.976 32.952 1.00 50.88 N
+ATOM 288 CA ARG A 26 23.349 52.263 31.844 1.00 50.96 C
+ATOM 289 C ARG A 26 24.799 51.958 32.201 1.00 50.16 C
+ATOM 290 O ARG A 26 25.537 52.848 32.626 1.00 52.95 O
+ATOM 291 CB ARG A 26 23.308 53.103 30.567 1.00 57.08 C
+ATOM 292 CG ARG A 26 23.807 52.392 29.291 1.00 56.91 C
+ATOM 293 CD ARG A 26 23.746 53.288 28.086 1.00 52.19 C
+ATOM 294 NE ARG A 26 22.394 53.693 27.785 1.00 53.31 N
+ATOM 295 CZ ARG A 26 21.517 52.998 27.047 1.00 52.33 C
+ATOM 296 NH1 ARG A 26 21.841 51.852 26.466 1.00 42.38 N
+ATOM 297 NH2 ARG A 26 20.317 53.504 26.916 1.00 33.33 N
+ATOM 298 H ARG A 26 22.712 53.990 32.931 1.00 0.00 H
+ATOM 299 HA ARG A 26 22.819 51.324 31.685 1.00 0.00 H
+ATOM 300 1HB ARG A 26 22.294 53.456 30.384 1.00 0.00 H
+ATOM 301 2HB ARG A 26 23.927 53.990 30.701 1.00 0.00 H
+ATOM 302 1HG ARG A 26 24.844 52.084 29.423 1.00 0.00 H
+ATOM 303 2HG ARG A 26 23.193 51.515 29.091 1.00 0.00 H
+ATOM 304 1HD ARG A 26 24.345 54.174 28.254 1.00 0.00 H
+ATOM 305 2HD ARG A 26 24.134 52.754 27.222 1.00 0.00 H
+ATOM 306 HE ARG A 26 22.047 54.577 28.176 1.00 0.00 H
+ATOM 307 1HH1 ARG A 26 22.798 51.476 26.534 1.00 0.00 H
+ATOM 308 2HH1 ARG A 26 21.155 51.363 25.905 1.00 0.00 H
+ATOM 309 1HH2 ARG A 26 20.124 54.402 27.375 1.00 0.00 H
+ATOM 310 2HH2 ARG A 26 19.590 53.029 26.387 1.00 0.00 H
+ATOM 311 N GLY A 27 25.213 50.709 32.035 1.00 46.18 N
+ATOM 312 CA GLY A 27 26.590 50.335 32.340 1.00 43.60 C
+ATOM 313 C GLY A 27 26.670 49.010 33.087 1.00 45.91 C
+ATOM 314 O GLY A 27 25.657 48.371 33.356 1.00 43.71 O
+ATOM 315 H GLY A 27 24.566 50.011 31.695 1.00 0.00 H
+ATOM 316 1HA GLY A 27 27.154 50.264 31.411 1.00 0.00 H
+ATOM 317 2HA GLY A 27 27.058 51.116 32.935 1.00 0.00 H
+ATOM 318 N ALA A 28 27.897 48.600 33.409 1.00 46.85 N
+ATOM 319 CA ALA A 28 28.127 47.326 34.091 1.00 51.44 C
+ATOM 320 C ALA A 28 27.433 47.269 35.453 1.00 53.56 C
+ATOM 321 O ALA A 28 26.955 46.207 35.859 1.00 52.26 O
+ATOM 322 CB ALA A 28 29.623 47.105 34.269 1.00 55.36 C
+ATOM 323 H ALA A 28 28.684 49.176 33.162 1.00 0.00 H
+ATOM 324 HA ALA A 28 27.721 46.532 33.467 1.00 0.00 H
+ATOM 325 1HB ALA A 28 29.791 46.141 34.750 1.00 0.00 H
+ATOM 326 2HB ALA A 28 30.112 47.116 33.298 1.00 0.00 H
+ATOM 327 3HB ALA A 28 30.037 47.894 34.894 1.00 0.00 H
+ATOM 328 N ASP A 29 27.389 48.396 36.165 1.00 56.21 N
+ATOM 329 CA ASP A 29 26.760 48.459 37.483 1.00 58.82 C
+ATOM 330 C ASP A 29 25.345 49.029 37.396 1.00 59.82 C
+ATOM 331 O ASP A 29 25.162 50.186 37.011 1.00 56.73 O
+ATOM 332 CB ASP A 29 27.581 49.324 38.442 1.00 60.94 C
+ATOM 333 CG ASP A 29 28.943 48.720 38.798 1.00 63.44 C
+ATOM 334 OD1 ASP A 29 29.043 47.520 38.895 1.00 59.74 O
+ATOM 335 OD2 ASP A 29 29.874 49.474 38.954 1.00 74.04 O
+ATOM 336 H ASP A 29 27.798 49.232 35.770 1.00 0.00 H
+ATOM 337 HA ASP A 29 26.694 47.447 37.886 1.00 0.00 H
+ATOM 338 1HB ASP A 29 27.723 50.317 38.014 1.00 0.00 H
+ATOM 339 2HB ASP A 29 27.014 49.451 39.368 1.00 0.00 H
+ATOM 340 N THR A 30 24.350 48.236 37.777 1.00 60.02 N
+ATOM 341 CA THR A 30 22.976 48.722 37.699 1.00 61.53 C
+ATOM 342 C THR A 30 22.487 49.226 39.054 1.00 63.28 C
+ATOM 343 O THR A 30 22.451 48.484 40.034 1.00 62.62 O
+ATOM 344 CB THR A 30 22.019 47.621 37.207 1.00 59.84 C
+ATOM 345 OG1 THR A 30 22.408 47.182 35.901 1.00 49.99 O
+ATOM 346 CG2 THR A 30 20.587 48.157 37.154 1.00 53.90 C
+ATOM 347 H THR A 30 24.541 47.293 38.090 1.00 0.00 H
+ATOM 348 HA THR A 30 22.939 49.555 36.993 1.00 0.00 H
+ATOM 349 HB THR A 30 22.066 46.778 37.887 1.00 0.00 H
+ATOM 350 HG1 THR A 30 23.274 46.765 35.954 1.00 0.00 H
+ATOM 351 1HG2 THR A 30 19.923 47.366 36.806 1.00 0.00 H
+ATOM 352 2HG2 THR A 30 20.279 48.479 38.152 1.00 0.00 H
+ATOM 353 3HG2 THR A 30 20.533 49.006 36.470 1.00 0.00 H
+ATOM 354 N ARG A 31 22.110 50.496 39.087 1.00 63.49 N
+ATOM 355 CA ARG A 31 21.593 51.169 40.274 1.00 65.18 C
+ATOM 356 C ARG A 31 20.693 52.311 39.849 1.00 64.74 C
+ATOM 357 O ARG A 31 20.691 52.686 38.679 1.00 65.15 O
+ATOM 358 CB ARG A 31 22.731 51.632 41.186 1.00 75.69 C
+ATOM 359 CG ARG A 31 23.885 52.393 40.503 1.00 76.75 C
+ATOM 360 CD ARG A 31 23.708 53.869 40.392 1.00 87.42 C
+ATOM 361 NE ARG A 31 23.831 54.585 41.653 1.00 92.50 N
+ATOM 362 CZ ARG A 31 23.897 55.934 41.744 1.00 94.26 C
+ATOM 363 NH1 ARG A 31 23.891 56.664 40.646 1.00 99.16 N
+ATOM 364 NH2 ARG A 31 23.978 56.525 42.924 1.00 88.82 N
+ATOM 365 H ARG A 31 22.225 51.049 38.238 1.00 0.00 H
+ATOM 366 HA ARG A 31 20.992 50.456 40.840 1.00 0.00 H
+ATOM 367 1HB ARG A 31 22.324 52.283 41.962 1.00 0.00 H
+ATOM 368 2HB ARG A 31 23.167 50.764 41.683 1.00 0.00 H
+ATOM 369 1HG ARG A 31 24.801 52.217 41.074 1.00 0.00 H
+ATOM 370 2HG ARG A 31 24.015 52.001 39.485 1.00 0.00 H
+ATOM 371 1HD ARG A 31 24.474 54.249 39.721 1.00 0.00 H
+ATOM 372 2HD ARG A 31 22.725 54.082 39.976 1.00 0.00 H
+ATOM 373 HE ARG A 31 23.834 54.051 42.509 1.00 0.00 H
+ATOM 374 1HH1 ARG A 31 23.832 56.215 39.746 1.00 0.00 H
+ATOM 375 2HH1 ARG A 31 23.946 57.669 40.706 1.00 0.00 H
+ATOM 376 1HH2 ARG A 31 23.981 55.970 43.766 1.00 0.00 H
+ATOM 377 2HH2 ARG A 31 24.030 57.532 42.980 1.00 0.00 H
+ATOM 378 N PHE A 32 19.861 52.827 40.739 1.00 63.97 N
+ATOM 379 CA PHE A 32 19.061 53.945 40.268 1.00 62.82 C
+ATOM 380 C PHE A 32 19.904 55.196 40.333 1.00 62.98 C
+ATOM 381 O PHE A 32 20.819 55.284 41.151 1.00 63.26 O
+ATOM 382 CB PHE A 32 17.784 54.139 41.078 1.00 55.19 C
+ATOM 383 CG PHE A 32 17.966 54.614 42.474 1.00 59.90 C
+ATOM 384 CD1 PHE A 32 18.068 53.731 43.536 1.00 54.51 C
+ATOM 385 CD2 PHE A 32 18.011 55.974 42.731 1.00 47.78 C
+ATOM 386 CE1 PHE A 32 18.224 54.206 44.829 1.00 50.96 C
+ATOM 387 CE2 PHE A 32 18.166 56.452 44.009 1.00 53.18 C
+ATOM 388 CZ PHE A 32 18.274 55.568 45.065 1.00 56.35 C
+ATOM 389 H PHE A 32 19.816 52.500 41.693 1.00 0.00 H
+ATOM 390 HA PHE A 32 18.779 53.768 39.240 1.00 0.00 H
+ATOM 391 1HB PHE A 32 17.185 54.878 40.561 1.00 0.00 H
+ATOM 392 2HB PHE A 32 17.220 53.211 41.099 1.00 0.00 H
+ATOM 393 HD1 PHE A 32 18.025 52.659 43.349 1.00 0.00 H
+ATOM 394 HD2 PHE A 32 17.922 56.669 41.899 1.00 0.00 H
+ATOM 395 HE1 PHE A 32 18.306 53.506 45.662 1.00 0.00 H
+ATOM 396 HE2 PHE A 32 18.202 57.526 44.189 1.00 0.00 H
+ATOM 397 HZ PHE A 32 18.396 55.942 46.080 1.00 0.00 H
+ATOM 398 N HIS A 33 19.574 56.181 39.511 1.00 62.81 N
+ATOM 399 CA HIS A 33 20.276 57.450 39.596 1.00 62.14 C
+ATOM 400 C HIS A 33 19.284 58.577 39.792 1.00 61.91 C
+ATOM 401 O HIS A 33 19.655 59.685 40.174 1.00 63.67 O
+ATOM 402 CB HIS A 33 21.115 57.692 38.340 1.00 57.62 C
+ATOM 403 CG HIS A 33 20.319 57.878 37.085 1.00 51.11 C
+ATOM 404 ND1 HIS A 33 19.769 59.093 36.747 1.00 49.41 N
+ATOM 405 CD2 HIS A 33 19.961 57.018 36.097 1.00 47.03 C
+ATOM 406 CE1 HIS A 33 19.117 58.979 35.613 1.00 52.69 C
+ATOM 407 NE2 HIS A 33 19.216 57.737 35.197 1.00 47.96 N
+ATOM 408 H HIS A 33 18.834 56.032 38.835 1.00 0.00 H
+ATOM 409 HA HIS A 33 20.943 57.449 40.454 1.00 0.00 H
+ATOM 410 1HB HIS A 33 21.728 58.585 38.482 1.00 0.00 H
+ATOM 411 2HB HIS A 33 21.786 56.865 38.207 1.00 0.00 H
+ATOM 412 HD2 HIS A 33 20.209 55.962 36.027 1.00 0.00 H
+ATOM 413 HE1 HIS A 33 18.586 59.780 35.104 1.00 0.00 H
+ATOM 414 HE2 HIS A 33 18.802 57.389 34.345 1.00 0.00 H
+ATOM 415 N HIS A 34 18.006 58.276 39.581 1.00 61.22 N
+ATOM 416 CA HIS A 34 16.991 59.310 39.737 1.00 62.91 C
+ATOM 417 C HIS A 34 15.626 58.761 40.097 1.00 65.74 C
+ATOM 418 O HIS A 34 15.181 57.741 39.572 1.00 67.49 O
+ATOM 419 CB HIS A 34 16.864 60.188 38.494 1.00 55.28 C
+ATOM 420 CG HIS A 34 15.893 61.321 38.694 1.00 62.67 C
+ATOM 421 ND1 HIS A 34 16.180 62.405 39.499 1.00 64.16 N
+ATOM 422 CD2 HIS A 34 14.646 61.534 38.206 1.00 55.53 C
+ATOM 423 CE1 HIS A 34 15.148 63.238 39.494 1.00 59.90 C
+ATOM 424 NE2 HIS A 34 14.205 62.733 38.720 1.00 58.89 N
+ATOM 425 H HIS A 34 17.761 57.345 39.251 1.00 0.00 H
+ATOM 426 HA HIS A 34 17.287 59.968 40.553 1.00 0.00 H
+ATOM 427 1HB HIS A 34 17.839 60.620 38.253 1.00 0.00 H
+ATOM 428 2HB HIS A 34 16.548 59.590 37.640 1.00 0.00 H
+ATOM 429 HD2 HIS A 34 14.092 60.876 37.537 1.00 0.00 H
+ATOM 430 HE1 HIS A 34 15.091 64.179 40.039 1.00 0.00 H
+ATOM 431 HE2 HIS A 34 13.286 63.163 38.532 1.00 0.00 H
+ATOM 432 N SER A 35 14.953 59.473 40.993 1.00 64.56 N
+ATOM 433 CA SER A 35 13.619 59.115 41.450 1.00 63.21 C
+ATOM 434 C SER A 35 12.664 60.295 41.274 1.00 61.22 C
+ATOM 435 O SER A 35 12.774 61.297 41.985 1.00 60.06 O
+ATOM 436 CB SER A 35 13.719 58.713 42.914 1.00 64.59 C
+ATOM 437 OG SER A 35 12.475 58.431 43.491 1.00 68.56 O
+ATOM 438 H SER A 35 15.384 60.306 41.373 1.00 0.00 H
+ATOM 439 HA SER A 35 13.254 58.273 40.858 1.00 0.00 H
+ATOM 440 1HB SER A 35 14.364 57.839 42.988 1.00 0.00 H
+ATOM 441 2HB SER A 35 14.197 59.517 43.471 1.00 0.00 H
+ATOM 442 HG SER A 35 12.654 58.134 44.388 1.00 0.00 H
+ATOM 443 N GLU A 36 11.745 60.171 40.314 1.00 61.12 N
+ATOM 444 CA GLU A 36 10.796 61.233 39.992 1.00 60.74 C
+ATOM 445 C GLU A 36 9.417 60.911 40.558 1.00 63.17 C
+ATOM 446 O GLU A 36 8.857 59.848 40.284 1.00 64.23 O
+ATOM 447 CB GLU A 36 10.692 61.437 38.469 1.00 50.64 C
+ATOM 448 CG GLU A 36 9.797 62.603 38.049 1.00 56.96 C
+ATOM 449 CD GLU A 36 10.434 63.963 38.235 1.00 56.34 C
+ATOM 450 OE1 GLU A 36 11.641 64.059 38.397 1.00 52.58 O
+ATOM 451 OE2 GLU A 36 9.688 64.927 38.243 1.00 56.42 O
+ATOM 452 H GLU A 36 11.704 59.308 39.776 1.00 0.00 H
+ATOM 453 HA GLU A 36 11.143 62.160 40.449 1.00 0.00 H
+ATOM 454 1HB GLU A 36 11.672 61.609 38.053 1.00 0.00 H
+ATOM 455 2HB GLU A 36 10.299 60.531 38.006 1.00 0.00 H
+ATOM 456 1HG GLU A 36 9.551 62.499 37.001 1.00 0.00 H
+ATOM 457 2HG GLU A 36 8.865 62.561 38.614 1.00 0.00 H
+ATOM 458 N LYS A 37 8.875 61.802 41.381 1.00 64.07 N
+ATOM 459 CA LYS A 37 7.558 61.533 41.939 1.00 63.03 C
+ATOM 460 C LYS A 37 6.475 62.204 41.109 1.00 62.23 C
+ATOM 461 O LYS A 37 6.685 63.297 40.567 1.00 61.53 O
+ATOM 462 CB LYS A 37 7.479 62.020 43.386 1.00 60.64 C
+ATOM 463 CG LYS A 37 7.634 63.530 43.550 1.00 48.56 C
+ATOM 464 CD LYS A 37 7.599 63.940 45.023 1.00 45.00 C
+ATOM 465 CE LYS A 37 7.679 65.457 45.189 1.00 45.00 C
+ATOM 466 NZ LYS A 37 7.628 65.863 46.627 1.00 45.00 N
+ATOM 467 H LYS A 37 9.363 62.661 41.596 1.00 0.00 H
+ATOM 468 HA LYS A 37 7.382 60.461 41.921 1.00 0.00 H
+ATOM 469 1HB LYS A 37 6.513 61.735 43.807 1.00 0.00 H
+ATOM 470 2HB LYS A 37 8.255 61.531 43.980 1.00 0.00 H
+ATOM 471 1HG LYS A 37 8.581 63.848 43.111 1.00 0.00 H
+ATOM 472 2HG LYS A 37 6.819 64.031 43.025 1.00 0.00 H
+ATOM 473 1HD LYS A 37 6.675 63.582 45.478 1.00 0.00 H
+ATOM 474 2HD LYS A 37 8.442 63.484 45.543 1.00 0.00 H
+ATOM 475 1HE LYS A 37 8.613 65.815 44.753 1.00 0.00 H
+ATOM 476 2HE LYS A 37 6.843 65.919 44.661 1.00 0.00 H
+ATOM 477 1HZ LYS A 37 7.683 66.869 46.697 1.00 0.00 H
+ATOM 478 2HZ LYS A 37 6.760 65.544 47.035 1.00 0.00 H
+ATOM 479 3HZ LYS A 37 8.405 65.449 47.123 1.00 0.00 H
+ATOM 480 N LEU A 38 5.305 61.576 41.061 1.00 63.28 N
+ATOM 481 CA LEU A 38 4.153 62.164 40.402 1.00 64.65 C
+ATOM 482 C LEU A 38 2.950 62.266 41.349 1.00 64.86 C
+ATOM 483 O LEU A 38 2.647 61.335 42.118 1.00 63.90 O
+ATOM 484 CB LEU A 38 3.754 61.321 39.182 1.00 69.39 C
+ATOM 485 CG LEU A 38 4.793 61.113 38.065 1.00 68.99 C
+ATOM 486 CD1 LEU A 38 4.227 60.113 37.035 1.00 64.34 C
+ATOM 487 CD2 LEU A 38 5.101 62.427 37.412 1.00 68.85 C
+ATOM 488 H LEU A 38 5.224 60.659 41.488 1.00 0.00 H
+ATOM 489 HA LEU A 38 4.412 63.165 40.072 1.00 0.00 H
+ATOM 490 1HB LEU A 38 3.506 60.367 39.538 1.00 0.00 H
+ATOM 491 2HB LEU A 38 2.868 61.762 38.738 1.00 0.00 H
+ATOM 492 HG LEU A 38 5.708 60.693 38.492 1.00 0.00 H
+ATOM 493 1HD1 LEU A 38 4.955 59.950 36.240 1.00 0.00 H
+ATOM 494 2HD1 LEU A 38 4.011 59.168 37.528 1.00 0.00 H
+ATOM 495 3HD1 LEU A 38 3.307 60.517 36.602 1.00 0.00 H
+ATOM 496 1HD2 LEU A 38 5.834 62.283 36.640 1.00 0.00 H
+ATOM 497 2HD2 LEU A 38 4.194 62.834 36.981 1.00 0.00 H
+ATOM 498 3HD2 LEU A 38 5.488 63.111 38.162 1.00 0.00 H
+ATOM 499 N ASP A 39 2.222 63.371 41.229 1.00 66.46 N
+ATOM 500 CA ASP A 39 0.953 63.544 41.929 1.00 70.77 C
+ATOM 501 C ASP A 39 -0.135 62.975 41.031 1.00 71.03 C
+ATOM 502 O ASP A 39 0.085 62.856 39.824 1.00 71.26 O
+ATOM 503 CB ASP A 39 0.665 65.015 42.243 1.00 73.51 C
+ATOM 504 CG ASP A 39 1.651 65.640 43.247 1.00 79.26 C
+ATOM 505 OD1 ASP A 39 2.412 64.915 43.847 1.00 76.25 O
+ATOM 506 OD2 ASP A 39 1.582 66.833 43.449 1.00 79.55 O
+ATOM 507 H ASP A 39 2.558 64.102 40.599 1.00 0.00 H
+ATOM 508 HA ASP A 39 0.971 62.982 42.858 1.00 0.00 H
+ATOM 509 1HB ASP A 39 0.720 65.583 41.310 1.00 0.00 H
+ATOM 510 2HB ASP A 39 -0.353 65.119 42.628 1.00 0.00 H
+ATOM 511 N LYS A 40 -1.294 62.633 41.574 1.00 71.50 N
+ATOM 512 CA LYS A 40 -2.341 62.094 40.714 1.00 72.03 C
+ATOM 513 C LYS A 40 -2.617 63.027 39.553 1.00 70.68 C
+ATOM 514 O LYS A 40 -2.833 64.226 39.738 1.00 71.21 O
+ATOM 515 CB LYS A 40 -3.632 61.844 41.495 1.00 80.15 C
+ATOM 516 CG LYS A 40 -4.766 61.239 40.663 1.00 83.75 C
+ATOM 517 CD LYS A 40 -5.943 60.829 41.538 1.00 86.43 C
+ATOM 518 CE LYS A 40 -7.041 60.177 40.717 1.00 93.75 C
+ATOM 519 NZ LYS A 40 -8.156 59.705 41.569 1.00 93.09 N
+ATOM 520 H LYS A 40 -1.461 62.731 42.578 1.00 0.00 H
+ATOM 521 HA LYS A 40 -1.999 61.142 40.308 1.00 0.00 H
+ATOM 522 1HB LYS A 40 -3.436 61.190 42.325 1.00 0.00 H
+ATOM 523 2HB LYS A 40 -3.987 62.786 41.911 1.00 0.00 H
+ATOM 524 1HG LYS A 40 -5.117 61.985 39.947 1.00 0.00 H
+ATOM 525 2HG LYS A 40 -4.404 60.378 40.107 1.00 0.00 H
+ATOM 526 1HD LYS A 40 -5.603 60.115 42.287 1.00 0.00 H
+ATOM 527 2HD LYS A 40 -6.346 61.703 42.050 1.00 0.00 H
+ATOM 528 1HE LYS A 40 -7.424 60.897 39.999 1.00 0.00 H
+ATOM 529 2HE LYS A 40 -6.627 59.328 40.177 1.00 0.00 H
+ATOM 530 1HZ LYS A 40 -8.862 59.277 40.990 1.00 0.00 H
+ATOM 531 2HZ LYS A 40 -7.804 59.026 42.229 1.00 0.00 H
+ATOM 532 3HZ LYS A 40 -8.555 60.484 42.066 1.00 0.00 H
+ATOM 533 N GLY A 41 -2.611 62.472 38.347 1.00 70.24 N
+ATOM 534 CA GLY A 41 -2.870 63.242 37.146 1.00 68.92 C
+ATOM 535 C GLY A 41 -1.615 63.745 36.439 1.00 67.30 C
+ATOM 536 O GLY A 41 -1.692 64.181 35.290 1.00 65.89 O
+ATOM 537 H GLY A 41 -2.423 61.477 38.245 1.00 0.00 H
+ATOM 538 1HA GLY A 41 -3.455 62.632 36.458 1.00 0.00 H
+ATOM 539 2HA GLY A 41 -3.488 64.097 37.414 1.00 0.00 H
+ATOM 540 N GLU A 42 -0.454 63.702 37.088 1.00 66.36 N
+ATOM 541 CA GLU A 42 0.734 64.176 36.388 1.00 65.68 C
+ATOM 542 C GLU A 42 1.191 63.165 35.351 1.00 66.54 C
+ATOM 543 O GLU A 42 1.127 61.947 35.562 1.00 63.80 O
+ATOM 544 CB GLU A 42 1.879 64.531 37.345 1.00 69.87 C
+ATOM 545 CG GLU A 42 1.663 65.811 38.165 1.00 70.15 C
+ATOM 546 CD GLU A 42 2.866 66.185 39.013 1.00 73.10 C
+ATOM 547 OE1 GLU A 42 3.448 65.314 39.606 1.00 75.10 O
+ATOM 548 OE2 GLU A 42 3.210 67.350 39.057 1.00 75.22 O
+ATOM 549 H GLU A 42 -0.396 63.357 38.044 1.00 0.00 H
+ATOM 550 HA GLU A 42 0.474 65.095 35.856 1.00 0.00 H
+ATOM 551 1HB GLU A 42 2.031 63.718 38.043 1.00 0.00 H
+ATOM 552 2HB GLU A 42 2.800 64.657 36.772 1.00 0.00 H
+ATOM 553 1HG GLU A 42 1.452 66.629 37.476 1.00 0.00 H
+ATOM 554 2HG GLU A 42 0.792 65.679 38.808 1.00 0.00 H
+ATOM 555 N VAL A 43 1.666 63.682 34.220 1.00 66.18 N
+ATOM 556 CA VAL A 43 2.167 62.819 33.160 1.00 66.16 C
+ATOM 557 C VAL A 43 3.636 63.053 32.879 1.00 65.52 C
+ATOM 558 O VAL A 43 4.080 64.185 32.699 1.00 67.03 O
+ATOM 559 CB VAL A 43 1.355 63.010 31.853 1.00 64.68 C
+ATOM 560 CG1 VAL A 43 1.960 62.175 30.736 1.00 63.66 C
+ATOM 561 CG2 VAL A 43 -0.087 62.566 32.077 1.00 69.19 C
+ATOM 562 H VAL A 43 1.681 64.695 34.106 1.00 0.00 H
+ATOM 563 HA VAL A 43 2.046 61.790 33.479 1.00 0.00 H
+ATOM 564 HB VAL A 43 1.383 64.056 31.559 1.00 0.00 H
+ATOM 565 1HG1 VAL A 43 1.386 62.314 29.823 1.00 0.00 H
+ATOM 566 2HG1 VAL A 43 2.985 62.489 30.569 1.00 0.00 H
+ATOM 567 3HG1 VAL A 43 1.943 61.120 31.023 1.00 0.00 H
+ATOM 568 1HG2 VAL A 43 -0.663 62.696 31.160 1.00 0.00 H
+ATOM 569 2HG2 VAL A 43 -0.091 61.529 32.358 1.00 0.00 H
+ATOM 570 3HG2 VAL A 43 -0.528 63.158 32.874 1.00 0.00 H
+ATOM 571 N LEU A 44 4.396 61.971 32.863 1.00 61.32 N
+ATOM 572 CA LEU A 44 5.812 62.049 32.557 1.00 61.08 C
+ATOM 573 C LEU A 44 6.116 61.325 31.261 1.00 62.23 C
+ATOM 574 O LEU A 44 5.819 60.139 31.114 1.00 59.65 O
+ATOM 575 CB LEU A 44 6.640 61.436 33.685 1.00 47.63 C
+ATOM 576 CG LEU A 44 8.154 61.404 33.466 1.00 56.70 C
+ATOM 577 CD1 LEU A 44 8.704 62.849 33.402 1.00 51.48 C
+ATOM 578 CD2 LEU A 44 8.783 60.620 34.596 1.00 54.45 C
+ATOM 579 H LEU A 44 3.970 61.067 33.054 1.00 0.00 H
+ATOM 580 HA LEU A 44 6.094 63.093 32.438 1.00 0.00 H
+ATOM 581 1HB LEU A 44 6.463 62.009 34.573 1.00 0.00 H
+ATOM 582 2HB LEU A 44 6.299 60.412 33.857 1.00 0.00 H
+ATOM 583 HG LEU A 44 8.378 60.916 32.514 1.00 0.00 H
+ATOM 584 1HD1 LEU A 44 9.778 62.822 33.243 1.00 0.00 H
+ATOM 585 2HD1 LEU A 44 8.232 63.384 32.578 1.00 0.00 H
+ATOM 586 3HD1 LEU A 44 8.491 63.364 34.339 1.00 0.00 H
+ATOM 587 1HD2 LEU A 44 9.862 60.575 34.456 1.00 0.00 H
+ATOM 588 2HD2 LEU A 44 8.557 61.101 35.541 1.00 0.00 H
+ATOM 589 3HD2 LEU A 44 8.373 59.616 34.598 1.00 0.00 H
+ATOM 590 N ILE A 45 6.690 62.042 30.312 1.00 62.42 N
+ATOM 591 CA ILE A 45 7.051 61.431 29.054 1.00 62.97 C
+ATOM 592 C ILE A 45 8.575 61.421 29.012 1.00 62.35 C
+ATOM 593 O ILE A 45 9.206 62.474 29.080 1.00 63.74 O
+ATOM 594 CB ILE A 45 6.457 62.203 27.872 1.00 58.18 C
+ATOM 595 CG1 ILE A 45 4.916 62.292 28.057 1.00 62.85 C
+ATOM 596 CG2 ILE A 45 6.783 61.422 26.633 1.00 55.96 C
+ATOM 597 CD1 ILE A 45 4.170 63.161 27.071 1.00 53.51 C
+ATOM 598 H ILE A 45 6.884 63.024 30.465 1.00 0.00 H
+ATOM 599 HA ILE A 45 6.690 60.412 29.026 1.00 0.00 H
+ATOM 600 HB ILE A 45 6.869 63.210 27.817 1.00 0.00 H
+ATOM 601 1HG1 ILE A 45 4.517 61.305 28.013 1.00 0.00 H
+ATOM 602 2HG1 ILE A 45 4.727 62.695 29.046 1.00 0.00 H
+ATOM 603 1HG2 ILE A 45 6.375 61.901 25.758 1.00 0.00 H
+ATOM 604 2HG2 ILE A 45 7.857 61.330 26.536 1.00 0.00 H
+ATOM 605 3HG2 ILE A 45 6.360 60.438 26.736 1.00 0.00 H
+ATOM 606 1HD1 ILE A 45 3.109 63.143 27.321 1.00 0.00 H
+ATOM 607 2HD1 ILE A 45 4.537 64.185 27.122 1.00 0.00 H
+ATOM 608 3HD1 ILE A 45 4.309 62.774 26.067 1.00 0.00 H
+ATOM 609 N ALA A 46 9.189 60.242 28.950 1.00 59.08 N
+ATOM 610 CA ALA A 46 10.643 60.237 29.113 1.00 58.00 C
+ATOM 611 C ALA A 46 11.370 59.249 28.231 1.00 57.62 C
+ATOM 612 O ALA A 46 10.918 58.123 28.010 1.00 57.16 O
+ATOM 613 CB ALA A 46 10.969 59.926 30.566 1.00 37.50 C
+ATOM 614 H ALA A 46 8.644 59.389 28.838 1.00 0.00 H
+ATOM 615 HA ALA A 46 11.018 61.225 28.861 1.00 0.00 H
+ATOM 616 1HB ALA A 46 12.051 59.960 30.704 1.00 0.00 H
+ATOM 617 2HB ALA A 46 10.496 60.659 31.214 1.00 0.00 H
+ATOM 618 3HB ALA A 46 10.599 58.931 30.812 1.00 0.00 H
+ATOM 619 N GLN A 47 12.533 59.692 27.751 1.00 56.21 N
+ATOM 620 CA GLN A 47 13.403 58.904 26.890 1.00 51.34 C
+ATOM 621 C GLN A 47 14.404 58.055 27.631 1.00 51.04 C
+ATOM 622 O GLN A 47 14.813 58.374 28.748 1.00 51.15 O
+ATOM 623 CB GLN A 47 14.195 59.808 25.948 1.00 41.00 C
+ATOM 624 CG GLN A 47 13.391 60.534 24.926 1.00 48.77 C
+ATOM 625 CD GLN A 47 14.262 61.385 24.072 1.00 55.93 C
+ATOM 626 OE1 GLN A 47 15.133 62.105 24.580 1.00 47.66 O
+ATOM 627 NE2 GLN A 47 14.051 61.320 22.767 1.00 55.77 N
+ATOM 628 H GLN A 47 12.832 60.642 27.979 1.00 0.00 H
+ATOM 629 HA GLN A 47 12.791 58.243 26.291 1.00 0.00 H
+ATOM 630 1HB GLN A 47 14.733 60.550 26.539 1.00 0.00 H
+ATOM 631 2HB GLN A 47 14.941 59.208 25.421 1.00 0.00 H
+ATOM 632 1HG GLN A 47 12.938 59.794 24.273 1.00 0.00 H
+ATOM 633 2HG GLN A 47 12.631 61.148 25.408 1.00 0.00 H
+ATOM 634 1HE2 GLN A 47 14.605 61.866 22.144 1.00 0.00 H
+ATOM 635 2HE2 GLN A 47 13.334 60.710 22.409 1.00 0.00 H
+ATOM 636 N PHE A 48 14.861 57.017 26.952 1.00 50.70 N
+ATOM 637 CA PHE A 48 15.990 56.243 27.444 1.00 48.14 C
+ATOM 638 C PHE A 48 17.227 56.981 26.939 1.00 45.85 C
+ATOM 639 O PHE A 48 17.207 57.527 25.834 1.00 43.27 O
+ATOM 640 CB PHE A 48 15.926 54.819 26.937 1.00 50.53 C
+ATOM 641 CG PHE A 48 14.766 54.050 27.507 1.00 62.60 C
+ATOM 642 CD1 PHE A 48 14.847 53.417 28.740 1.00 62.69 C
+ATOM 643 CD2 PHE A 48 13.573 53.973 26.798 1.00 59.59 C
+ATOM 644 CE1 PHE A 48 13.754 52.733 29.240 1.00 61.44 C
+ATOM 645 CE2 PHE A 48 12.493 53.293 27.302 1.00 64.07 C
+ATOM 646 CZ PHE A 48 12.586 52.680 28.526 1.00 61.04 C
+ATOM 647 H PHE A 48 14.422 56.782 26.061 1.00 0.00 H
+ATOM 648 HA PHE A 48 15.996 56.239 28.535 1.00 0.00 H
+ATOM 649 1HB PHE A 48 15.840 54.826 25.856 1.00 0.00 H
+ATOM 650 2HB PHE A 48 16.848 54.297 27.203 1.00 0.00 H
+ATOM 651 HD1 PHE A 48 15.777 53.469 29.310 1.00 0.00 H
+ATOM 652 HD2 PHE A 48 13.498 54.469 25.831 1.00 0.00 H
+ATOM 653 HE1 PHE A 48 13.807 52.247 30.199 1.00 0.00 H
+ATOM 654 HE2 PHE A 48 11.566 53.249 26.734 1.00 0.00 H
+ATOM 655 HZ PHE A 48 11.737 52.163 28.931 1.00 0.00 H
+ATOM 656 N THR A 49 18.269 57.061 27.759 1.00 43.74 N
+ATOM 657 CA THR A 49 19.442 57.866 27.395 1.00 42.31 C
+ATOM 658 C THR A 49 20.743 57.124 27.587 1.00 43.90 C
+ATOM 659 O THR A 49 20.765 56.002 28.090 1.00 44.06 O
+ATOM 660 CB THR A 49 19.555 59.161 28.230 1.00 44.65 C
+ATOM 661 OG1 THR A 49 19.940 58.835 29.587 1.00 43.68 O
+ATOM 662 CG2 THR A 49 18.220 59.920 28.253 1.00 33.48 C
+ATOM 663 H THR A 49 18.250 56.533 28.627 1.00 0.00 H
+ATOM 664 HA THR A 49 19.363 58.144 26.345 1.00 0.00 H
+ATOM 665 HB THR A 49 20.320 59.808 27.785 1.00 0.00 H
+ATOM 666 HG1 THR A 49 20.169 59.650 30.056 1.00 0.00 H
+ATOM 667 1HG2 THR A 49 18.334 60.836 28.835 1.00 0.00 H
+ATOM 668 2HG2 THR A 49 17.922 60.173 27.240 1.00 0.00 H
+ATOM 669 3HG2 THR A 49 17.444 59.297 28.707 1.00 0.00 H
+ATOM 670 N GLU A 50 21.837 57.806 27.278 1.00 46.59 N
+ATOM 671 CA GLU A 50 23.177 57.302 27.527 1.00 49.74 C
+ATOM 672 C GLU A 50 23.453 57.042 29.026 1.00 52.34 C
+ATOM 673 O GLU A 50 24.439 56.387 29.362 1.00 52.44 O
+ATOM 674 CB GLU A 50 24.214 58.257 26.916 1.00 45.07 C
+ATOM 675 CG GLU A 50 24.141 59.695 27.401 1.00 46.55 C
+ATOM 676 CD GLU A 50 23.172 60.536 26.597 1.00 50.29 C
+ATOM 677 OE1 GLU A 50 22.351 59.971 25.903 1.00 42.16 O
+ATOM 678 OE2 GLU A 50 23.260 61.739 26.667 1.00 47.10 O
+ATOM 679 H GLU A 50 21.733 58.715 26.855 1.00 0.00 H
+ATOM 680 HA GLU A 50 23.272 56.348 27.010 1.00 0.00 H
+ATOM 681 1HB GLU A 50 25.218 57.892 27.137 1.00 0.00 H
+ATOM 682 2HB GLU A 50 24.104 58.271 25.831 1.00 0.00 H
+ATOM 683 1HG GLU A 50 23.817 59.693 28.433 1.00 0.00 H
+ATOM 684 2HG GLU A 50 25.135 60.140 27.360 1.00 0.00 H
+ATOM 685 N HIS A 51 22.597 57.564 29.922 1.00 53.98 N
+ATOM 686 CA HIS A 51 22.739 57.298 31.349 1.00 56.34 C
+ATOM 687 C HIS A 51 21.605 56.407 31.883 1.00 56.49 C
+ATOM 688 O HIS A 51 21.821 55.691 32.856 1.00 57.07 O
+ATOM 689 CB HIS A 51 22.810 58.593 32.182 1.00 58.09 C
+ATOM 690 CG HIS A 51 24.030 59.438 31.915 1.00 56.54 C
+ATOM 691 ND1 HIS A 51 24.037 60.467 31.008 1.00 51.61 N
+ATOM 692 CD2 HIS A 51 25.280 59.393 32.442 1.00 55.51 C
+ATOM 693 CE1 HIS A 51 25.239 61.018 30.978 1.00 55.25 C
+ATOM 694 NE2 HIS A 51 26.011 60.387 31.841 1.00 55.53 N
+ATOM 695 H HIS A 51 21.807 58.111 29.609 1.00 0.00 H
+ATOM 696 HA HIS A 51 23.671 56.760 31.520 1.00 0.00 H
+ATOM 697 1HB HIS A 51 21.925 59.202 31.993 1.00 0.00 H
+ATOM 698 2HB HIS A 51 22.804 58.337 33.243 1.00 0.00 H
+ATOM 699 HD2 HIS A 51 25.640 58.695 33.200 1.00 0.00 H
+ATOM 700 HE1 HIS A 51 25.536 61.854 30.348 1.00 0.00 H
+ATOM 701 HE2 HIS A 51 26.983 60.594 32.030 1.00 0.00 H
+ATOM 702 N THR A 52 20.422 56.420 31.236 1.00 55.95 N
+ATOM 703 CA THR A 52 19.281 55.599 31.699 1.00 55.53 C
+ATOM 704 C THR A 52 18.970 54.458 30.727 1.00 54.31 C
+ATOM 705 O THR A 52 18.547 54.697 29.593 1.00 51.75 O
+ATOM 706 CB THR A 52 17.977 56.425 31.827 1.00 54.69 C
+ATOM 707 OG1 THR A 52 18.155 57.494 32.754 1.00 51.90 O
+ATOM 708 CG2 THR A 52 16.820 55.517 32.313 1.00 59.06 C
+ATOM 709 H THR A 52 20.299 57.038 30.442 1.00 0.00 H
+ATOM 710 HA THR A 52 19.526 55.170 32.669 1.00 0.00 H
+ATOM 711 HB THR A 52 17.716 56.846 30.853 1.00 0.00 H
+ATOM 712 HG1 THR A 52 18.677 58.183 32.331 1.00 0.00 H
+ATOM 713 1HG2 THR A 52 15.904 56.100 32.398 1.00 0.00 H
+ATOM 714 2HG2 THR A 52 16.665 54.704 31.603 1.00 0.00 H
+ATOM 715 3HG2 THR A 52 17.072 55.097 33.287 1.00 0.00 H
+ATOM 716 N SER A 53 19.124 53.211 31.189 1.00 52.03 N
+ATOM 717 CA SER A 53 18.863 52.052 30.330 1.00 50.05 C
+ATOM 718 C SER A 53 17.534 51.390 30.669 1.00 51.33 C
+ATOM 719 O SER A 53 17.000 50.600 29.887 1.00 48.56 O
+ATOM 720 CB SER A 53 19.966 51.031 30.441 1.00 43.36 C
+ATOM 721 OG SER A 53 20.029 50.498 31.720 1.00 44.49 O
+ATOM 722 H SER A 53 19.431 53.081 32.151 1.00 0.00 H
+ATOM 723 HA SER A 53 18.821 52.388 29.294 1.00 0.00 H
+ATOM 724 1HB SER A 53 19.779 50.240 29.730 1.00 0.00 H
+ATOM 725 2HB SER A 53 20.904 51.488 30.181 1.00 0.00 H
+ATOM 726 HG SER A 53 19.170 50.099 31.880 1.00 0.00 H
+ATOM 727 N ALA A 54 16.996 51.715 31.844 1.00 55.98 N
+ATOM 728 CA ALA A 54 15.723 51.123 32.237 1.00 56.93 C
+ATOM 729 C ALA A 54 14.922 52.072 33.122 1.00 59.86 C
+ATOM 730 O ALA A 54 15.477 52.895 33.852 1.00 61.62 O
+ATOM 731 CB ALA A 54 15.950 49.790 32.936 1.00 52.60 C
+ATOM 732 H ALA A 54 17.497 52.346 32.467 1.00 0.00 H
+ATOM 733 HA ALA A 54 15.145 50.942 31.340 1.00 0.00 H
+ATOM 734 1HB ALA A 54 14.985 49.355 33.187 1.00 0.00 H
+ATOM 735 2HB ALA A 54 16.486 49.124 32.266 1.00 0.00 H
+ATOM 736 3HB ALA A 54 16.521 49.915 33.823 1.00 0.00 H
+ATOM 737 N ILE A 55 13.600 51.919 33.054 1.00 59.66 N
+ATOM 738 CA ILE A 55 12.670 52.693 33.864 1.00 58.59 C
+ATOM 739 C ILE A 55 11.776 51.783 34.708 1.00 60.57 C
+ATOM 740 O ILE A 55 11.140 50.859 34.199 1.00 59.82 O
+ATOM 741 CB ILE A 55 11.806 53.624 32.976 1.00 55.51 C
+ATOM 742 CG1 ILE A 55 12.713 54.646 32.224 1.00 56.38 C
+ATOM 743 CG2 ILE A 55 10.789 54.345 33.826 1.00 58.01 C
+ATOM 744 CD1 ILE A 55 11.988 55.461 31.155 1.00 44.38 C
+ATOM 745 H ILE A 55 13.231 51.214 32.425 1.00 0.00 H
+ATOM 746 HA ILE A 55 13.244 53.319 34.538 1.00 0.00 H
+ATOM 747 HB ILE A 55 11.287 53.031 32.223 1.00 0.00 H
+ATOM 748 1HG1 ILE A 55 13.139 55.336 32.954 1.00 0.00 H
+ATOM 749 2HG1 ILE A 55 13.522 54.116 31.745 1.00 0.00 H
+ATOM 750 1HG2 ILE A 55 10.183 54.993 33.197 1.00 0.00 H
+ATOM 751 2HG2 ILE A 55 10.148 53.623 34.326 1.00 0.00 H
+ATOM 752 3HG2 ILE A 55 11.314 54.942 34.573 1.00 0.00 H
+ATOM 753 1HD1 ILE A 55 12.693 56.149 30.678 1.00 0.00 H
+ATOM 754 2HD1 ILE A 55 11.575 54.792 30.401 1.00 0.00 H
+ATOM 755 3HD1 ILE A 55 11.182 56.033 31.612 1.00 0.00 H
+ATOM 756 N LYS A 56 11.748 52.036 36.008 1.00 59.42 N
+ATOM 757 CA LYS A 56 10.926 51.240 36.917 1.00 57.24 C
+ATOM 758 C LYS A 56 9.790 52.093 37.461 1.00 56.92 C
+ATOM 759 O LYS A 56 10.008 53.238 37.847 1.00 56.72 O
+ATOM 760 CB LYS A 56 11.781 50.664 38.039 1.00 56.10 C
+ATOM 761 CG LYS A 56 11.057 49.802 39.045 1.00 53.90 C
+ATOM 762 CD LYS A 56 12.050 49.289 40.072 1.00 59.89 C
+ATOM 763 CE LYS A 56 11.396 48.406 41.120 1.00 64.48 C
+ATOM 764 NZ LYS A 56 12.402 47.879 42.073 1.00 58.61 N
+ATOM 765 H LYS A 56 12.309 52.805 36.367 1.00 0.00 H
+ATOM 766 HA LYS A 56 10.488 50.414 36.366 1.00 0.00 H
+ATOM 767 1HB LYS A 56 12.561 50.045 37.601 1.00 0.00 H
+ATOM 768 2HB LYS A 56 12.267 51.451 38.572 1.00 0.00 H
+ATOM 769 1HG LYS A 56 10.275 50.378 39.548 1.00 0.00 H
+ATOM 770 2HG LYS A 56 10.593 48.952 38.532 1.00 0.00 H
+ATOM 771 1HD LYS A 56 12.832 48.709 39.567 1.00 0.00 H
+ATOM 772 2HD LYS A 56 12.521 50.139 40.570 1.00 0.00 H
+ATOM 773 1HE LYS A 56 10.650 48.979 41.669 1.00 0.00 H
+ATOM 774 2HE LYS A 56 10.906 47.578 40.628 1.00 0.00 H
+ATOM 775 1HZ LYS A 56 11.961 47.287 42.764 1.00 0.00 H
+ATOM 776 2HZ LYS A 56 13.111 47.343 41.553 1.00 0.00 H
+ATOM 777 3HZ LYS A 56 12.853 48.641 42.534 1.00 0.00 H
+ATOM 778 N VAL A 57 8.569 51.565 37.441 1.00 57.34 N
+ATOM 779 CA VAL A 57 7.439 52.354 37.912 1.00 57.15 C
+ATOM 780 C VAL A 57 6.704 51.685 39.072 1.00 56.87 C
+ATOM 781 O VAL A 57 6.345 50.498 39.019 1.00 55.15 O
+ATOM 782 CB VAL A 57 6.458 52.630 36.763 1.00 54.06 C
+ATOM 783 CG1 VAL A 57 5.283 53.503 37.275 1.00 57.42 C
+ATOM 784 CG2 VAL A 57 7.208 53.292 35.632 1.00 55.16 C
+ATOM 785 H VAL A 57 8.430 50.621 37.091 1.00 0.00 H
+ATOM 786 HA VAL A 57 7.816 53.313 38.262 1.00 0.00 H
+ATOM 787 HB VAL A 57 6.036 51.688 36.414 1.00 0.00 H
+ATOM 788 1HG1 VAL A 57 4.583 53.698 36.470 1.00 0.00 H
+ATOM 789 2HG1 VAL A 57 4.757 52.989 38.082 1.00 0.00 H
+ATOM 790 3HG1 VAL A 57 5.672 54.449 37.645 1.00 0.00 H
+ATOM 791 1HG2 VAL A 57 6.528 53.484 34.807 1.00 0.00 H
+ATOM 792 2HG2 VAL A 57 7.629 54.222 35.991 1.00 0.00 H
+ATOM 793 3HG2 VAL A 57 8.008 52.638 35.291 1.00 0.00 H
+ATOM 794 N ARG A 58 6.490 52.472 40.130 1.00 59.08 N
+ATOM 795 CA ARG A 58 5.812 52.035 41.343 1.00 60.21 C
+ATOM 796 C ARG A 58 4.568 52.898 41.622 1.00 60.83 C
+ATOM 797 O ARG A 58 4.630 54.126 41.542 1.00 58.14 O
+ATOM 798 CB ARG A 58 6.771 52.196 42.517 1.00 59.41 C
+ATOM 799 CG ARG A 58 8.090 51.433 42.395 1.00 65.47 C
+ATOM 800 CD ARG A 58 9.112 51.895 43.403 1.00 71.61 C
+ATOM 801 NE ARG A 58 8.707 51.658 44.786 1.00 73.27 N
+ATOM 802 CZ ARG A 58 9.333 52.182 45.862 1.00 72.95 C
+ATOM 803 NH1 ARG A 58 10.389 52.953 45.704 1.00 75.68 N
+ATOM 804 NH2 ARG A 58 8.892 51.928 47.083 1.00 71.22 N
+ATOM 805 H ARG A 58 6.848 53.424 40.094 1.00 0.00 H
+ATOM 806 HA ARG A 58 5.515 50.991 41.230 1.00 0.00 H
+ATOM 807 1HB ARG A 58 7.006 53.242 42.656 1.00 0.00 H
+ATOM 808 2HB ARG A 58 6.282 51.847 43.426 1.00 0.00 H
+ATOM 809 1HG ARG A 58 7.911 50.372 42.535 1.00 0.00 H
+ATOM 810 2HG ARG A 58 8.513 51.600 41.403 1.00 0.00 H
+ATOM 811 1HD ARG A 58 10.043 51.355 43.230 1.00 0.00 H
+ATOM 812 2HD ARG A 58 9.289 52.967 43.277 1.00 0.00 H
+ATOM 813 HE ARG A 58 7.903 51.065 44.948 1.00 0.00 H
+ATOM 814 1HH1 ARG A 58 10.739 53.147 44.776 1.00 0.00 H
+ATOM 815 2HH1 ARG A 58 10.852 53.346 46.510 1.00 0.00 H
+ATOM 816 1HH2 ARG A 58 8.083 51.340 47.216 1.00 0.00 H
+ATOM 817 2HH2 ARG A 58 9.361 52.324 47.881 1.00 0.00 H
+ATOM 818 N GLY A 59 3.457 52.278 42.023 1.00 62.16 N
+ATOM 819 CA GLY A 59 2.242 53.035 42.333 1.00 64.97 C
+ATOM 820 C GLY A 59 1.303 52.991 41.136 1.00 65.60 C
+ATOM 821 O GLY A 59 1.746 52.857 39.999 1.00 65.34 O
+ATOM 822 H GLY A 59 3.396 51.260 42.076 1.00 0.00 H
+ATOM 823 1HA GLY A 59 1.748 52.588 43.196 1.00 0.00 H
+ATOM 824 2HA GLY A 59 2.486 54.063 42.593 1.00 0.00 H
+ATOM 825 N LYS A 60 0.003 53.102 41.378 1.00 66.84 N
+ATOM 826 CA LYS A 60 -0.939 52.960 40.273 1.00 68.13 C
+ATOM 827 C LYS A 60 -0.675 54.001 39.190 1.00 68.47 C
+ATOM 828 O LYS A 60 -0.763 55.207 39.451 1.00 67.78 O
+ATOM 829 CB LYS A 60 -2.380 53.068 40.793 1.00 71.37 C
+ATOM 830 CG LYS A 60 -3.485 52.700 39.798 1.00 76.47 C
+ATOM 831 CD LYS A 60 -3.704 51.201 39.641 1.00 74.48 C
+ATOM 832 CE LYS A 60 -4.500 50.636 40.831 1.00 80.28 C
+ATOM 833 NZ LYS A 60 -4.998 49.227 40.604 1.00 45.00 N
+ATOM 834 H LYS A 60 -0.329 53.255 42.329 1.00 0.00 H
+ATOM 835 HA LYS A 60 -0.803 51.994 39.825 1.00 0.00 H
+ATOM 836 1HB LYS A 60 -2.491 52.433 41.669 1.00 0.00 H
+ATOM 837 2HB LYS A 60 -2.571 54.086 41.108 1.00 0.00 H
+ATOM 838 1HG LYS A 60 -4.420 53.175 40.097 1.00 0.00 H
+ATOM 839 2HG LYS A 60 -3.201 53.064 38.834 1.00 0.00 H
+ATOM 840 1HD LYS A 60 -4.228 50.995 38.707 1.00 0.00 H
+ATOM 841 2HD LYS A 60 -2.731 50.723 39.607 1.00 0.00 H
+ATOM 842 1HE LYS A 60 -3.859 50.649 41.707 1.00 0.00 H
+ATOM 843 2HE LYS A 60 -5.358 51.284 41.013 1.00 0.00 H
+ATOM 844 1HZ LYS A 60 -5.513 48.918 41.409 1.00 0.00 H
+ATOM 845 2HZ LYS A 60 -5.602 49.227 39.804 1.00 0.00 H
+ATOM 846 3HZ LYS A 60 -4.247 48.543 40.433 1.00 0.00 H
+ATOM 847 N ALA A 61 -0.389 53.540 37.972 1.00 68.39 N
+ATOM 848 CA ALA A 61 -0.101 54.465 36.874 1.00 65.65 C
+ATOM 849 C ALA A 61 -0.329 53.834 35.499 1.00 63.73 C
+ATOM 850 O ALA A 61 0.015 52.670 35.256 1.00 61.42 O
+ATOM 851 CB ALA A 61 1.328 54.974 36.978 1.00 66.40 C
+ATOM 852 H ALA A 61 -0.347 52.530 37.836 1.00 0.00 H
+ATOM 853 HA ALA A 61 -0.768 55.307 36.976 1.00 0.00 H
+ATOM 854 1HB ALA A 61 1.516 55.700 36.191 1.00 0.00 H
+ATOM 855 2HB ALA A 61 1.451 55.440 37.940 1.00 0.00 H
+ATOM 856 3HB ALA A 61 2.029 54.158 36.884 1.00 0.00 H
+ATOM 857 N TYR A 62 -0.881 54.625 34.579 1.00 63.14 N
+ATOM 858 CA TYR A 62 -1.122 54.156 33.214 1.00 61.11 C
+ATOM 859 C TYR A 62 0.158 54.333 32.424 1.00 60.20 C
+ATOM 860 O TYR A 62 0.706 55.437 32.393 1.00 58.27 O
+ATOM 861 CB TYR A 62 -2.254 54.938 32.544 1.00 61.88 C
+ATOM 862 CG TYR A 62 -2.709 54.363 31.223 1.00 63.93 C
+ATOM 863 CD1 TYR A 62 -3.543 53.264 31.238 1.00 63.12 C
+ATOM 864 CD2 TYR A 62 -2.312 54.916 30.011 1.00 66.03 C
+ATOM 865 CE1 TYR A 62 -3.995 52.713 30.067 1.00 65.22 C
+ATOM 866 CE2 TYR A 62 -2.771 54.362 28.827 1.00 66.26 C
+ATOM 867 CZ TYR A 62 -3.616 53.263 28.859 1.00 67.76 C
+ATOM 868 OH TYR A 62 -4.098 52.712 27.698 1.00 71.17 O
+ATOM 869 H TYR A 62 -1.110 55.583 34.837 1.00 0.00 H
+ATOM 870 HA TYR A 62 -1.371 53.094 33.234 1.00 0.00 H
+ATOM 871 1HB TYR A 62 -3.112 54.987 33.201 1.00 0.00 H
+ATOM 872 2HB TYR A 62 -1.930 55.948 32.364 1.00 0.00 H
+ATOM 873 HD1 TYR A 62 -3.854 52.838 32.186 1.00 0.00 H
+ATOM 874 HD2 TYR A 62 -1.652 55.781 29.992 1.00 0.00 H
+ATOM 875 HE1 TYR A 62 -4.662 51.849 30.098 1.00 0.00 H
+ATOM 876 HE2 TYR A 62 -2.475 54.793 27.875 1.00 0.00 H
+ATOM 877 HH TYR A 62 -3.770 53.208 26.947 1.00 0.00 H
+ATOM 878 N ILE A 63 0.668 53.268 31.815 1.00 58.98 N
+ATOM 879 CA ILE A 63 1.925 53.394 31.098 1.00 56.93 C
+ATOM 880 C ILE A 63 1.802 53.021 29.618 1.00 53.18 C
+ATOM 881 O ILE A 63 1.292 51.955 29.260 1.00 52.64 O
+ATOM 882 CB ILE A 63 2.988 52.500 31.736 1.00 54.48 C
+ATOM 883 CG1 ILE A 63 3.183 52.847 33.182 1.00 40.39 C
+ATOM 884 CG2 ILE A 63 4.303 52.664 30.998 1.00 48.56 C
+ATOM 885 CD1 ILE A 63 4.014 51.831 33.891 1.00 38.20 C
+ATOM 886 H ILE A 63 0.217 52.360 31.862 1.00 0.00 H
+ATOM 887 HA ILE A 63 2.255 54.414 31.171 1.00 0.00 H
+ATOM 888 HB ILE A 63 2.666 51.500 31.697 1.00 0.00 H
+ATOM 889 1HG1 ILE A 63 3.649 53.806 33.260 1.00 0.00 H
+ATOM 890 2HG1 ILE A 63 2.220 52.891 33.678 1.00 0.00 H
+ATOM 891 1HG2 ILE A 63 5.033 52.032 31.463 1.00 0.00 H
+ATOM 892 2HG2 ILE A 63 4.182 52.380 29.957 1.00 0.00 H
+ATOM 893 3HG2 ILE A 63 4.627 53.702 31.054 1.00 0.00 H
+ATOM 894 1HD1 ILE A 63 4.118 52.112 34.924 1.00 0.00 H
+ATOM 895 2HD1 ILE A 63 3.523 50.859 33.828 1.00 0.00 H
+ATOM 896 3HD1 ILE A 63 4.998 51.770 33.431 1.00 0.00 H
+ATOM 897 N GLN A 64 2.293 53.896 28.747 1.00 52.75 N
+ATOM 898 CA GLN A 64 2.284 53.596 27.323 1.00 52.69 C
+ATOM 899 C GLN A 64 3.717 53.400 26.856 1.00 51.99 C
+ATOM 900 O GLN A 64 4.601 54.180 27.218 1.00 51.83 O
+ATOM 901 CB GLN A 64 1.692 54.746 26.520 1.00 51.20 C
+ATOM 902 CG GLN A 64 0.311 55.179 26.918 1.00 47.71 C
+ATOM 903 CD GLN A 64 -0.145 56.335 26.106 1.00 51.87 C
+ATOM 904 OE1 GLN A 64 0.528 57.368 26.063 1.00 55.93 O
+ATOM 905 NE2 GLN A 64 -1.278 56.181 25.456 1.00 41.18 N
+ATOM 906 H GLN A 64 2.679 54.770 29.091 1.00 0.00 H
+ATOM 907 HA GLN A 64 1.728 52.679 27.143 1.00 0.00 H
+ATOM 908 1HB GLN A 64 2.363 55.575 26.511 1.00 0.00 H
+ATOM 909 2HB GLN A 64 1.609 54.418 25.491 1.00 0.00 H
+ATOM 910 1HG GLN A 64 -0.384 54.374 26.768 1.00 0.00 H
+ATOM 911 2HG GLN A 64 0.307 55.490 27.970 1.00 0.00 H
+ATOM 912 1HE2 GLN A 64 -1.657 56.947 24.891 1.00 0.00 H
+ATOM 913 2HE2 GLN A 64 -1.788 55.339 25.496 1.00 0.00 H
+ATOM 914 N THR A 65 3.944 52.382 26.029 1.00 52.25 N
+ATOM 915 CA THR A 65 5.267 52.167 25.464 1.00 49.88 C
+ATOM 916 C THR A 65 5.101 51.873 23.980 1.00 51.14 C
+ATOM 917 O THR A 65 3.982 51.708 23.485 1.00 50.70 O
+ATOM 918 CB THR A 65 6.025 50.978 26.097 1.00 50.66 C
+ATOM 919 OG1 THR A 65 5.489 49.748 25.608 1.00 49.41 O
+ATOM 920 CG2 THR A 65 5.869 51.003 27.620 1.00 52.37 C
+ATOM 921 H THR A 65 3.189 51.750 25.779 1.00 0.00 H
+ATOM 922 HA THR A 65 5.867 53.069 25.568 1.00 0.00 H
+ATOM 923 HB THR A 65 7.071 51.050 25.845 1.00 0.00 H
+ATOM 924 HG1 THR A 65 5.270 49.858 24.680 1.00 0.00 H
+ATOM 925 1HG2 THR A 65 6.406 50.173 28.055 1.00 0.00 H
+ATOM 926 2HG2 THR A 65 6.267 51.935 28.007 1.00 0.00 H
+ATOM 927 3HG2 THR A 65 4.818 50.921 27.886 1.00 0.00 H
+ATOM 928 N ARG A 66 6.202 51.721 23.280 1.00 51.49 N
+ATOM 929 CA ARG A 66 6.165 51.389 21.861 1.00 49.78 C
+ATOM 930 C ARG A 66 5.486 50.036 21.581 1.00 51.30 C
+ATOM 931 O ARG A 66 5.106 49.761 20.444 1.00 48.96 O
+ATOM 932 CB ARG A 66 7.555 51.454 21.233 1.00 61.30 C
+ATOM 933 CG ARG A 66 7.556 51.369 19.706 1.00 63.38 C
+ATOM 934 CD ARG A 66 8.860 51.824 19.083 1.00 72.82 C
+ATOM 935 NE ARG A 66 10.010 50.964 19.365 1.00 83.35 N
+ATOM 936 CZ ARG A 66 10.265 49.813 18.723 1.00 87.82 C
+ATOM 937 NH1 ARG A 66 11.351 49.140 19.006 1.00 92.65 N
+ATOM 938 NH2 ARG A 66 9.426 49.366 17.797 1.00 87.89 N
+ATOM 939 H ARG A 66 7.098 51.866 23.730 1.00 0.00 H
+ATOM 940 HA ARG A 66 5.565 52.155 21.364 1.00 0.00 H
+ATOM 941 1HB ARG A 66 8.059 52.376 21.524 1.00 0.00 H
+ATOM 942 2HB ARG A 66 8.158 50.622 21.591 1.00 0.00 H
+ATOM 943 1HG ARG A 66 7.367 50.340 19.398 1.00 0.00 H
+ATOM 944 2HG ARG A 66 6.763 52.012 19.314 1.00 0.00 H
+ATOM 945 1HD ARG A 66 8.740 51.870 18.001 1.00 0.00 H
+ATOM 946 2HD ARG A 66 9.094 52.822 19.457 1.00 0.00 H
+ATOM 947 HE ARG A 66 10.713 51.291 20.055 1.00 0.00 H
+ATOM 948 1HH1 ARG A 66 11.990 49.498 19.706 1.00 0.00 H
+ATOM 949 2HH1 ARG A 66 11.556 48.285 18.518 1.00 0.00 H
+ATOM 950 1HH2 ARG A 66 8.587 49.884 17.577 1.00 0.00 H
+ATOM 951 2HH2 ARG A 66 9.621 48.504 17.312 1.00 0.00 H
+ATOM 952 N HIS A 67 5.374 49.160 22.602 1.00 51.67 N
+ATOM 953 CA HIS A 67 4.807 47.834 22.378 1.00 51.85 C
+ATOM 954 C HIS A 67 3.338 47.731 22.808 1.00 54.61 C
+ATOM 955 O HIS A 67 2.783 46.631 22.860 1.00 53.97 O
+ATOM 956 CB HIS A 67 5.583 46.778 23.176 1.00 48.05 C
+ATOM 957 CG HIS A 67 7.023 46.723 22.852 1.00 44.79 C
+ATOM 958 ND1 HIS A 67 7.510 46.796 21.566 1.00 43.66 N
+ATOM 959 CD2 HIS A 67 8.092 46.569 23.654 1.00 44.93 C
+ATOM 960 CE1 HIS A 67 8.826 46.712 21.602 1.00 44.66 C
+ATOM 961 NE2 HIS A 67 9.197 46.563 22.857 1.00 48.35 N
+ATOM 962 H HIS A 67 5.653 49.417 23.544 1.00 0.00 H
+ATOM 963 HA HIS A 67 4.866 47.581 21.321 1.00 0.00 H
+ATOM 964 1HB HIS A 67 5.479 46.982 24.245 1.00 0.00 H
+ATOM 965 2HB HIS A 67 5.157 45.788 22.990 1.00 0.00 H
+ATOM 966 HD2 HIS A 67 8.082 46.462 24.737 1.00 0.00 H
+ATOM 967 HE1 HIS A 67 9.488 46.741 20.741 1.00 0.00 H
+ATOM 968 HE2 HIS A 67 10.146 46.451 23.213 1.00 0.00 H
+ATOM 969 N GLY A 68 2.704 48.862 23.135 1.00 57.44 N
+ATOM 970 CA GLY A 68 1.322 48.818 23.610 1.00 59.51 C
+ATOM 971 C GLY A 68 1.212 49.477 24.978 1.00 59.71 C
+ATOM 972 O GLY A 68 1.991 50.373 25.305 1.00 55.34 O
+ATOM 973 H GLY A 68 3.182 49.759 23.069 1.00 0.00 H
+ATOM 974 1HA GLY A 68 0.673 49.332 22.899 1.00 0.00 H
+ATOM 975 2HA GLY A 68 0.981 47.787 23.673 1.00 0.00 H
+ATOM 976 N VAL A 69 0.221 49.079 25.769 1.00 60.78 N
+ATOM 977 CA VAL A 69 0.055 49.717 27.072 1.00 59.06 C
+ATOM 978 C VAL A 69 0.043 48.699 28.201 1.00 59.19 C
+ATOM 979 O VAL A 69 -0.267 47.521 27.988 1.00 58.03 O
+ATOM 980 CB VAL A 69 -1.243 50.534 27.115 1.00 59.08 C
+ATOM 981 CG1 VAL A 69 -1.206 51.609 26.039 1.00 43.09 C
+ATOM 982 CG2 VAL A 69 -2.427 49.613 26.939 1.00 63.61 C
+ATOM 983 H VAL A 69 -0.408 48.345 25.472 1.00 0.00 H
+ATOM 984 HA VAL A 69 0.894 50.390 27.240 1.00 0.00 H
+ATOM 985 HB VAL A 69 -1.312 51.040 28.083 1.00 0.00 H
+ATOM 986 1HG1 VAL A 69 -2.111 52.206 26.082 1.00 0.00 H
+ATOM 987 2HG1 VAL A 69 -0.348 52.236 26.204 1.00 0.00 H
+ATOM 988 3HG1 VAL A 69 -1.130 51.149 25.059 1.00 0.00 H
+ATOM 989 1HG2 VAL A 69 -3.349 50.190 26.987 1.00 0.00 H
+ATOM 990 2HG2 VAL A 69 -2.361 49.112 25.974 1.00 0.00 H
+ATOM 991 3HG2 VAL A 69 -2.421 48.869 27.738 1.00 0.00 H
+ATOM 992 N ILE A 70 0.367 49.183 29.397 1.00 59.78 N
+ATOM 993 CA ILE A 70 0.393 48.389 30.615 1.00 60.63 C
+ATOM 994 C ILE A 70 -0.014 49.269 31.794 1.00 62.36 C
+ATOM 995 O ILE A 70 0.215 50.477 31.780 1.00 62.17 O
+ATOM 996 CB ILE A 70 1.815 47.798 30.826 1.00 51.34 C
+ATOM 997 CG1 ILE A 70 1.847 46.730 31.921 1.00 47.26 C
+ATOM 998 CG2 ILE A 70 2.781 48.879 31.178 1.00 41.48 C
+ATOM 999 CD1 ILE A 70 1.155 45.481 31.518 1.00 47.39 C
+ATOM 1000 H ILE A 70 0.623 50.166 29.456 1.00 0.00 H
+ATOM 1001 HA ILE A 70 -0.323 47.574 30.526 1.00 0.00 H
+ATOM 1002 HB ILE A 70 2.135 47.329 29.905 1.00 0.00 H
+ATOM 1003 1HG1 ILE A 70 2.887 46.488 32.132 1.00 0.00 H
+ATOM 1004 2HG1 ILE A 70 1.405 47.106 32.829 1.00 0.00 H
+ATOM 1005 1HG2 ILE A 70 3.772 48.456 31.294 1.00 0.00 H
+ATOM 1006 2HG2 ILE A 70 2.795 49.625 30.384 1.00 0.00 H
+ATOM 1007 3HG2 ILE A 70 2.466 49.332 32.116 1.00 0.00 H
+ATOM 1008 1HD1 ILE A 70 1.228 44.744 32.314 1.00 0.00 H
+ATOM 1009 2HD1 ILE A 70 0.105 45.691 31.312 1.00 0.00 H
+ATOM 1010 3HD1 ILE A 70 1.633 45.103 30.622 1.00 0.00 H
+ATOM 1011 N GLU A 71 -0.618 48.679 32.809 1.00 61.90 N
+ATOM 1012 CA GLU A 71 -0.933 49.451 34.000 1.00 58.08 C
+ATOM 1013 C GLU A 71 -0.137 48.950 35.189 1.00 55.86 C
+ATOM 1014 O GLU A 71 -0.190 47.763 35.532 1.00 53.48 O
+ATOM 1015 CB GLU A 71 -2.429 49.396 34.322 1.00 57.19 C
+ATOM 1016 CG GLU A 71 -3.315 50.057 33.283 1.00 74.92 C
+ATOM 1017 CD GLU A 71 -4.779 50.105 33.672 1.00 76.05 C
+ATOM 1018 OE1 GLU A 71 -5.111 49.637 34.736 1.00 66.43 O
+ATOM 1019 OE2 GLU A 71 -5.558 50.620 32.905 1.00 77.41 O
+ATOM 1020 H GLU A 71 -0.825 47.692 32.764 1.00 0.00 H
+ATOM 1021 HA GLU A 71 -0.655 50.494 33.832 1.00 0.00 H
+ATOM 1022 1HB GLU A 71 -2.739 48.354 34.409 1.00 0.00 H
+ATOM 1023 2HB GLU A 71 -2.612 49.873 35.284 1.00 0.00 H
+ATOM 1024 1HG GLU A 71 -2.947 51.062 33.132 1.00 0.00 H
+ATOM 1025 2HG GLU A 71 -3.217 49.520 32.342 1.00 0.00 H
+ATOM 1026 N SER A 72 0.614 49.858 35.806 1.00 54.55 N
+ATOM 1027 CA SER A 72 1.405 49.529 36.982 1.00 55.99 C
+ATOM 1028 C SER A 72 0.524 49.702 38.196 1.00 57.19 C
+ATOM 1029 O SER A 72 -0.443 50.469 38.132 1.00 56.40 O
+ATOM 1030 CB SER A 72 2.629 50.411 37.038 1.00 47.81 C
+ATOM 1031 OG SER A 72 2.268 51.746 37.136 1.00 49.56 O
+ATOM 1032 H SER A 72 0.595 50.822 35.475 1.00 0.00 H
+ATOM 1033 HA SER A 72 1.714 48.487 36.930 1.00 0.00 H
+ATOM 1034 1HB SER A 72 3.247 50.127 37.896 1.00 0.00 H
+ATOM 1035 2HB SER A 72 3.215 50.264 36.156 1.00 0.00 H
+ATOM 1036 HG SER A 72 1.661 51.909 36.395 1.00 0.00 H
+ATOM 1037 N GLU A 73 0.851 49.005 39.288 1.00 58.13 N
+ATOM 1038 CA GLU A 73 0.048 49.110 40.500 1.00 59.63 C
+ATOM 1039 C GLU A 73 0.897 49.275 41.770 1.00 59.65 C
+ATOM 1040 O GLU A 73 2.029 49.739 41.730 1.00 59.10 O
+ATOM 1041 OXT GLU A 73 0.469 48.831 42.828 1.00 0.00 O
+ATOM 1042 CB GLU A 73 -0.865 47.883 40.598 1.00 65.04 C
+ATOM 1043 CG GLU A 73 -1.735 47.676 39.346 1.00 65.54 C
+ATOM 1044 CD GLU A 73 -2.692 46.566 39.456 1.00 67.13 C
+ATOM 1045 OE1 GLU A 73 -3.706 46.769 40.094 1.00 64.78 O
+ATOM 1046 OE2 GLU A 73 -2.465 45.526 38.864 1.00 66.11 O
+ATOM 1047 H GLU A 73 1.660 48.391 39.255 1.00 0.00 H
+ATOM 1048 HA GLU A 73 -0.582 49.981 40.415 1.00 0.00 H
+ATOM 1049 1HB GLU A 73 -0.287 46.992 40.769 1.00 0.00 H
+ATOM 1050 2HB GLU A 73 -1.543 48.008 41.443 1.00 0.00 H
+ATOM 1051 1HG GLU A 73 -2.283 48.576 39.126 1.00 0.00 H
+ATOM 1052 2HG GLU A 73 -1.074 47.474 38.499 1.00 0.00 H
+TER
+ATOM 1054 N SER B 7 17.184 51.390 19.946 1.00 67.09 N
+ATOM 1055 CA SER B 7 17.516 50.082 20.487 1.00 65.59 C
+ATOM 1056 C SER B 7 16.331 49.499 21.243 1.00 64.33 C
+ATOM 1057 O SER B 7 15.649 50.196 21.994 1.00 65.75 O
+ATOM 1058 CB SER B 7 18.718 50.166 21.399 1.00 56.39 C
+ATOM 1059 OG SER B 7 18.990 48.916 21.962 1.00 58.65 O
+ATOM 1060 1H SER B 7 17.823 51.617 19.198 1.00 0.00 H
+ATOM 1061 2H SER B 7 16.239 51.363 19.587 1.00 0.00 H
+ATOM 1062 3H SER B 7 17.251 52.087 20.670 1.00 0.00 H
+ATOM 1063 HA SER B 7 17.749 49.413 19.658 1.00 0.00 H
+ATOM 1064 1HB SER B 7 19.585 50.517 20.838 1.00 0.00 H
+ATOM 1065 2HB SER B 7 18.521 50.886 22.192 1.00 0.00 H
+ATOM 1066 HG SER B 7 18.184 48.657 22.429 1.00 0.00 H
+ATOM 1067 N ASP B 8 16.086 48.218 21.020 1.00 59.93 N
+ATOM 1068 CA ASP B 8 14.949 47.512 21.599 1.00 59.90 C
+ATOM 1069 C ASP B 8 14.942 47.411 23.114 1.00 57.45 C
+ATOM 1070 O ASP B 8 15.997 47.376 23.763 1.00 56.50 O
+ATOM 1071 CB ASP B 8 14.834 46.114 21.009 1.00 59.76 C
+ATOM 1072 CG ASP B 8 14.397 46.169 19.580 1.00 69.30 C
+ATOM 1073 OD1 ASP B 8 14.022 47.240 19.151 1.00 70.12 O
+ATOM 1074 OD2 ASP B 8 14.436 45.166 18.920 1.00 68.27 O
+ATOM 1075 H ASP B 8 16.700 47.704 20.402 1.00 0.00 H
+ATOM 1076 HA ASP B 8 14.049 48.061 21.314 1.00 0.00 H
+ATOM 1077 1HB ASP B 8 15.786 45.591 21.077 1.00 0.00 H
+ATOM 1078 2HB ASP B 8 14.101 45.546 21.586 1.00 0.00 H
+ATOM 1079 N PHE B 9 13.718 47.316 23.635 1.00 56.18 N
+ATOM 1080 CA PHE B 9 13.424 47.157 25.049 1.00 56.49 C
+ATOM 1081 C PHE B 9 12.259 46.212 25.243 1.00 56.07 C
+ATOM 1082 O PHE B 9 11.522 45.917 24.295 1.00 53.32 O
+ATOM 1083 CB PHE B 9 13.035 48.498 25.693 1.00 48.81 C
+ATOM 1084 CG PHE B 9 11.756 49.053 25.196 1.00 48.03 C
+ATOM 1085 CD1 PHE B 9 10.574 48.773 25.855 1.00 41.68 C
+ATOM 1086 CD2 PHE B 9 11.717 49.855 24.075 1.00 38.81 C
+ATOM 1087 CE1 PHE B 9 9.382 49.277 25.411 1.00 40.04 C
+ATOM 1088 CE2 PHE B 9 10.521 50.361 23.624 1.00 41.75 C
+ATOM 1089 CZ PHE B 9 9.353 50.067 24.297 1.00 44.13 C
+ATOM 1090 H PHE B 9 12.938 47.373 22.997 1.00 0.00 H
+ATOM 1091 HA PHE B 9 14.290 46.726 25.540 1.00 0.00 H
+ATOM 1092 1HB PHE B 9 12.941 48.379 26.767 1.00 0.00 H
+ATOM 1093 2HB PHE B 9 13.790 49.218 25.516 1.00 0.00 H
+ATOM 1094 HD1 PHE B 9 10.603 48.137 26.738 1.00 0.00 H
+ATOM 1095 HD2 PHE B 9 12.643 50.088 23.540 1.00 0.00 H
+ATOM 1096 HE1 PHE B 9 8.464 49.044 25.940 1.00 0.00 H
+ATOM 1097 HE2 PHE B 9 10.505 50.991 22.732 1.00 0.00 H
+ATOM 1098 HZ PHE B 9 8.422 50.453 23.944 1.00 0.00 H
+ATOM 1099 N VAL B 10 12.091 45.749 26.476 1.00 55.59 N
+ATOM 1100 CA VAL B 10 10.970 44.889 26.828 1.00 56.12 C
+ATOM 1101 C VAL B 10 10.222 45.484 28.022 1.00 55.38 C
+ATOM 1102 O VAL B 10 10.805 46.224 28.818 1.00 54.22 O
+ATOM 1103 CB VAL B 10 11.496 43.491 27.209 1.00 61.62 C
+ATOM 1104 CG1 VAL B 10 12.284 42.882 26.031 1.00 57.06 C
+ATOM 1105 CG2 VAL B 10 12.362 43.606 28.449 1.00 61.62 C
+ATOM 1106 H VAL B 10 12.774 46.016 27.180 1.00 0.00 H
+ATOM 1107 HA VAL B 10 10.288 44.813 25.980 1.00 0.00 H
+ATOM 1108 HB VAL B 10 10.648 42.833 27.417 1.00 0.00 H
+ATOM 1109 1HG1 VAL B 10 12.645 41.907 26.308 1.00 0.00 H
+ATOM 1110 2HG1 VAL B 10 11.639 42.801 25.158 1.00 0.00 H
+ATOM 1111 3HG1 VAL B 10 13.138 43.515 25.794 1.00 0.00 H
+ATOM 1112 1HG2 VAL B 10 12.723 42.619 28.732 1.00 0.00 H
+ATOM 1113 2HG2 VAL B 10 13.211 44.263 28.241 1.00 0.00 H
+ATOM 1114 3HG2 VAL B 10 11.771 44.023 29.268 1.00 0.00 H
+ATOM 1115 N VAL B 11 8.942 45.133 28.169 1.00 52.56 N
+ATOM 1116 CA VAL B 11 8.157 45.596 29.318 1.00 51.69 C
+ATOM 1117 C VAL B 11 7.759 44.409 30.180 1.00 52.00 C
+ATOM 1118 O VAL B 11 7.150 43.464 29.686 1.00 51.38 O
+ATOM 1119 CB VAL B 11 6.856 46.274 28.862 1.00 54.10 C
+ATOM 1120 CG1 VAL B 11 6.060 46.759 30.081 1.00 61.24 C
+ATOM 1121 CG2 VAL B 11 7.159 47.377 27.879 1.00 51.44 C
+ATOM 1122 H VAL B 11 8.499 44.543 27.468 1.00 0.00 H
+ATOM 1123 HA VAL B 11 8.751 46.288 29.912 1.00 0.00 H
+ATOM 1124 HB VAL B 11 6.248 45.548 28.390 1.00 0.00 H
+ATOM 1125 1HG1 VAL B 11 5.125 47.201 29.740 1.00 0.00 H
+ATOM 1126 2HG1 VAL B 11 5.842 45.913 30.734 1.00 0.00 H
+ATOM 1127 3HG1 VAL B 11 6.630 47.497 30.632 1.00 0.00 H
+ATOM 1128 1HG2 VAL B 11 6.221 47.825 27.543 1.00 0.00 H
+ATOM 1129 2HG2 VAL B 11 7.771 48.128 28.340 1.00 0.00 H
+ATOM 1130 3HG2 VAL B 11 7.683 46.957 27.025 1.00 0.00 H
+ATOM 1131 N ILE B 12 8.108 44.450 31.465 1.00 52.57 N
+ATOM 1132 CA ILE B 12 7.777 43.339 32.352 1.00 51.84 C
+ATOM 1133 C ILE B 12 6.962 43.785 33.578 1.00 52.68 C
+ATOM 1134 O ILE B 12 7.389 44.652 34.342 1.00 52.44 O
+ATOM 1135 CB ILE B 12 9.083 42.660 32.810 1.00 46.20 C
+ATOM 1136 CG1 ILE B 12 9.876 42.168 31.565 1.00 48.03 C
+ATOM 1137 CG2 ILE B 12 8.739 41.474 33.729 1.00 34.35 C
+ATOM 1138 CD1 ILE B 12 11.255 41.760 31.868 1.00 46.36 C
+ATOM 1139 H ILE B 12 8.628 45.244 31.823 1.00 0.00 H
+ATOM 1140 HA ILE B 12 7.185 42.613 31.802 1.00 0.00 H
+ATOM 1141 HB ILE B 12 9.712 43.376 33.343 1.00 0.00 H
+ATOM 1142 1HG1 ILE B 12 9.365 41.331 31.139 1.00 0.00 H
+ATOM 1143 2HG1 ILE B 12 9.930 42.956 30.825 1.00 0.00 H
+ATOM 1144 1HG2 ILE B 12 9.645 40.978 34.051 1.00 0.00 H
+ATOM 1145 2HG2 ILE B 12 8.197 41.838 34.603 1.00 0.00 H
+ATOM 1146 3HG2 ILE B 12 8.116 40.768 33.187 1.00 0.00 H
+ATOM 1147 1HD1 ILE B 12 11.750 41.420 30.957 1.00 0.00 H
+ATOM 1148 2HD1 ILE B 12 11.789 42.612 32.275 1.00 0.00 H
+ATOM 1149 3HD1 ILE B 12 11.232 40.970 32.591 1.00 0.00 H
+ATOM 1150 N LYS B 13 5.783 43.172 33.764 1.00 53.99 N
+ATOM 1151 CA LYS B 13 4.922 43.484 34.911 1.00 52.15 C
+ATOM 1152 C LYS B 13 4.781 42.314 35.872 1.00 50.26 C
+ATOM 1153 O LYS B 13 4.343 41.226 35.501 1.00 49.60 O
+ATOM 1154 CB LYS B 13 3.519 43.892 34.478 1.00 53.58 C
+ATOM 1155 CG LYS B 13 2.627 44.169 35.677 1.00 55.43 C
+ATOM 1156 CD LYS B 13 1.238 44.586 35.313 1.00 49.75 C
+ATOM 1157 CE LYS B 13 0.415 44.707 36.586 1.00 52.51 C
+ATOM 1158 NZ LYS B 13 -0.939 45.234 36.355 1.00 50.82 N
+ATOM 1159 H LYS B 13 5.474 42.481 33.087 1.00 0.00 H
+ATOM 1160 HA LYS B 13 5.364 44.311 35.463 1.00 0.00 H
+ATOM 1161 1HB LYS B 13 3.560 44.775 33.847 1.00 0.00 H
+ATOM 1162 2HB LYS B 13 3.074 43.105 33.907 1.00 0.00 H
+ATOM 1163 1HG LYS B 13 2.559 43.270 36.291 1.00 0.00 H
+ATOM 1164 2HG LYS B 13 3.079 44.955 36.284 1.00 0.00 H
+ATOM 1165 1HD LYS B 13 1.260 45.552 34.808 1.00 0.00 H
+ATOM 1166 2HD LYS B 13 0.787 43.845 34.654 1.00 0.00 H
+ATOM 1167 1HE LYS B 13 0.338 43.722 37.047 1.00 0.00 H
+ATOM 1168 2HE LYS B 13 0.935 45.374 37.261 1.00 0.00 H
+ATOM 1169 1HZ LYS B 13 -1.445 45.310 37.256 1.00 0.00 H
+ATOM 1170 2HZ LYS B 13 -0.834 46.169 35.949 1.00 0.00 H
+ATOM 1171 3HZ LYS B 13 -1.452 44.640 35.733 1.00 0.00 H
+ATOM 1172 N ALA B 14 5.156 42.531 37.125 1.00 49.79 N
+ATOM 1173 CA ALA B 14 5.070 41.431 38.079 1.00 52.25 C
+ATOM 1174 C ALA B 14 3.623 41.035 38.345 1.00 52.57 C
+ATOM 1175 O ALA B 14 2.783 41.880 38.666 1.00 53.81 O
+ATOM 1176 CB ALA B 14 5.728 41.834 39.374 1.00 44.95 C
+ATOM 1177 H ALA B 14 5.495 43.451 37.409 1.00 0.00 H
+ATOM 1178 HA ALA B 14 5.587 40.573 37.657 1.00 0.00 H
+ATOM 1179 1HB ALA B 14 5.687 41.015 40.092 1.00 0.00 H
+ATOM 1180 2HB ALA B 14 6.743 42.084 39.172 1.00 0.00 H
+ATOM 1181 3HB ALA B 14 5.212 42.690 39.771 1.00 0.00 H
+ATOM 1182 N LEU B 15 3.350 39.730 38.315 1.00 52.32 N
+ATOM 1183 CA LEU B 15 2.011 39.242 38.638 1.00 56.14 C
+ATOM 1184 C LEU B 15 1.948 38.693 40.063 1.00 57.85 C
+ATOM 1185 O LEU B 15 0.882 38.327 40.563 1.00 56.48 O
+ATOM 1186 CB LEU B 15 1.591 38.196 37.610 1.00 51.10 C
+ATOM 1187 CG LEU B 15 1.503 38.728 36.165 1.00 52.46 C
+ATOM 1188 CD1 LEU B 15 1.195 37.575 35.219 1.00 47.68 C
+ATOM 1189 CD2 LEU B 15 0.449 39.813 36.092 1.00 42.91 C
+ATOM 1190 H LEU B 15 4.064 39.055 38.042 1.00 0.00 H
+ATOM 1191 HA LEU B 15 1.314 40.076 38.573 1.00 0.00 H
+ATOM 1192 1HB LEU B 15 2.316 37.394 37.627 1.00 0.00 H
+ATOM 1193 2HB LEU B 15 0.619 37.795 37.889 1.00 0.00 H
+ATOM 1194 HG LEU B 15 2.434 39.161 35.884 1.00 0.00 H
+ATOM 1195 1HD1 LEU B 15 1.143 37.942 34.194 1.00 0.00 H
+ATOM 1196 2HD1 LEU B 15 1.984 36.825 35.290 1.00 0.00 H
+ATOM 1197 3HD1 LEU B 15 0.243 37.126 35.490 1.00 0.00 H
+ATOM 1198 1HD2 LEU B 15 0.388 40.204 35.081 1.00 0.00 H
+ATOM 1199 2HD2 LEU B 15 -0.517 39.399 36.378 1.00 0.00 H
+ATOM 1200 3HD2 LEU B 15 0.716 40.623 36.775 1.00 0.00 H
+ATOM 1201 N GLU B 16 3.104 38.663 40.715 1.00 58.79 N
+ATOM 1202 CA GLU B 16 3.238 38.185 42.089 1.00 60.90 C
+ATOM 1203 C GLU B 16 4.445 38.839 42.754 1.00 62.57 C
+ATOM 1204 O GLU B 16 5.299 39.408 42.083 1.00 63.73 O
+ATOM 1205 CB GLU B 16 3.358 36.658 42.143 1.00 58.19 C
+ATOM 1206 CG GLU B 16 4.588 36.079 41.477 1.00 68.84 C
+ATOM 1207 CD GLU B 16 4.606 34.570 41.530 1.00 68.24 C
+ATOM 1208 OE1 GLU B 16 3.747 33.996 42.162 1.00 74.86 O
+ATOM 1209 OE2 GLU B 16 5.452 33.987 40.891 1.00 68.18 O
+ATOM 1210 H GLU B 16 3.926 38.983 40.226 1.00 0.00 H
+ATOM 1211 HA GLU B 16 2.348 38.474 42.646 1.00 0.00 H
+ATOM 1212 1HB GLU B 16 3.358 36.331 43.185 1.00 0.00 H
+ATOM 1213 2HB GLU B 16 2.490 36.208 41.661 1.00 0.00 H
+ATOM 1214 1HG GLU B 16 4.633 36.412 40.441 1.00 0.00 H
+ATOM 1215 2HG GLU B 16 5.471 36.462 41.990 1.00 0.00 H
+ATOM 1216 N ASP B 17 4.502 38.810 44.075 1.00 62.48 N
+ATOM 1217 CA ASP B 17 5.678 39.341 44.754 1.00 63.09 C
+ATOM 1218 C ASP B 17 6.918 38.487 44.478 1.00 61.66 C
+ATOM 1219 O ASP B 17 6.841 37.260 44.545 1.00 62.13 O
+ATOM 1220 CB ASP B 17 5.434 39.412 46.261 1.00 66.47 C
+ATOM 1221 CG ASP B 17 4.395 40.462 46.651 1.00 67.63 C
+ATOM 1222 OD1 ASP B 17 4.064 41.296 45.825 1.00 69.96 O
+ATOM 1223 OD2 ASP B 17 3.935 40.420 47.767 1.00 75.30 O
+ATOM 1224 H ASP B 17 3.760 38.372 44.604 1.00 0.00 H
+ATOM 1225 HA ASP B 17 5.866 40.335 44.382 1.00 0.00 H
+ATOM 1226 1HB ASP B 17 5.114 38.435 46.631 1.00 0.00 H
+ATOM 1227 2HB ASP B 17 6.375 39.661 46.760 1.00 0.00 H
+ATOM 1228 N GLY B 18 8.079 39.120 44.278 1.00 59.00 N
+ATOM 1229 CA GLY B 18 9.326 38.360 44.141 1.00 58.72 C
+ATOM 1230 C GLY B 18 9.701 38.004 42.700 1.00 60.16 C
+ATOM 1231 O GLY B 18 10.427 37.040 42.460 1.00 59.28 O
+ATOM 1232 H GLY B 18 8.103 40.136 44.174 1.00 0.00 H
+ATOM 1233 1HA GLY B 18 10.135 38.945 44.578 1.00 0.00 H
+ATOM 1234 2HA GLY B 18 9.254 37.448 44.730 1.00 0.00 H
+ATOM 1235 N VAL B 19 9.188 38.759 41.749 1.00 58.93 N
+ATOM 1236 CA VAL B 19 9.504 38.550 40.340 1.00 57.00 C
+ATOM 1237 C VAL B 19 10.905 39.054 40.069 1.00 56.03 C
+ATOM 1238 O VAL B 19 11.288 40.109 40.563 1.00 56.37 O
+ATOM 1239 CB VAL B 19 8.448 39.228 39.464 1.00 56.48 C
+ATOM 1240 CG1 VAL B 19 8.842 39.235 37.990 1.00 51.53 C
+ATOM 1241 CG2 VAL B 19 7.173 38.457 39.632 1.00 47.81 C
+ATOM 1242 H VAL B 19 8.609 39.552 42.014 1.00 0.00 H
+ATOM 1243 HA VAL B 19 9.476 37.480 40.128 1.00 0.00 H
+ATOM 1244 HB VAL B 19 8.306 40.224 39.796 1.00 0.00 H
+ATOM 1245 1HG1 VAL B 19 8.059 39.720 37.419 1.00 0.00 H
+ATOM 1246 2HG1 VAL B 19 9.772 39.790 37.863 1.00 0.00 H
+ATOM 1247 3HG1 VAL B 19 8.976 38.213 37.636 1.00 0.00 H
+ATOM 1248 1HG2 VAL B 19 6.390 38.907 39.057 1.00 0.00 H
+ATOM 1249 2HG2 VAL B 19 7.322 37.435 39.296 1.00 0.00 H
+ATOM 1250 3HG2 VAL B 19 6.904 38.451 40.674 1.00 0.00 H
+ATOM 1251 N ASN B 20 11.695 38.280 39.342 1.00 53.73 N
+ATOM 1252 CA ASN B 20 13.080 38.663 39.095 1.00 53.06 C
+ATOM 1253 C ASN B 20 13.428 38.780 37.631 1.00 53.54 C
+ATOM 1254 O ASN B 20 13.301 37.823 36.860 1.00 49.12 O
+ATOM 1255 CB ASN B 20 14.040 37.707 39.785 1.00 59.78 C
+ATOM 1256 CG ASN B 20 14.055 37.867 41.279 1.00 66.90 C
+ATOM 1257 OD1 ASN B 20 14.719 38.775 41.775 1.00 68.80 O
+ATOM 1258 ND2 ASN B 20 13.357 37.025 41.997 1.00 54.63 N
+ATOM 1259 H ASN B 20 11.318 37.424 38.942 1.00 0.00 H
+ATOM 1260 HA ASN B 20 13.241 39.651 39.526 1.00 0.00 H
+ATOM 1261 1HB ASN B 20 13.767 36.686 39.549 1.00 0.00 H
+ATOM 1262 2HB ASN B 20 15.051 37.874 39.406 1.00 0.00 H
+ATOM 1263 1HD2 ASN B 20 13.339 37.102 42.992 1.00 0.00 H
+ATOM 1264 2HD2 ASN B 20 12.820 36.302 41.554 1.00 0.00 H
+ATOM 1265 N VAL B 21 13.866 39.975 37.253 1.00 53.64 N
+ATOM 1266 CA VAL B 21 14.280 40.229 35.886 1.00 53.67 C
+ATOM 1267 C VAL B 21 15.798 40.275 35.871 1.00 53.02 C
+ATOM 1268 O VAL B 21 16.420 41.101 36.542 1.00 54.01 O
+ATOM 1269 CB VAL B 21 13.677 41.532 35.372 1.00 49.42 C
+ATOM 1270 CG1 VAL B 21 14.137 41.761 33.955 1.00 47.65 C
+ATOM 1271 CG2 VAL B 21 12.161 41.439 35.479 1.00 47.64 C
+ATOM 1272 H VAL B 21 13.916 40.725 37.944 1.00 0.00 H
+ATOM 1273 HA VAL B 21 13.948 39.410 35.246 1.00 0.00 H
+ATOM 1274 HB VAL B 21 14.032 42.367 35.973 1.00 0.00 H
+ATOM 1275 1HG1 VAL B 21 13.726 42.685 33.574 1.00 0.00 H
+ATOM 1276 2HG1 VAL B 21 15.224 41.814 33.932 1.00 0.00 H
+ATOM 1277 3HG1 VAL B 21 13.802 40.932 33.341 1.00 0.00 H
+ATOM 1278 1HG2 VAL B 21 11.706 42.360 35.117 1.00 0.00 H
+ATOM 1279 2HG2 VAL B 21 11.815 40.600 34.886 1.00 0.00 H
+ATOM 1280 3HG2 VAL B 21 11.878 41.283 36.521 1.00 0.00 H
+ATOM 1281 N ILE B 22 16.394 39.335 35.156 1.00 49.94 N
+ATOM 1282 CA ILE B 22 17.824 39.123 35.223 1.00 50.83 C
+ATOM 1283 C ILE B 22 18.569 39.506 33.959 1.00 51.39 C
+ATOM 1284 O ILE B 22 18.219 39.080 32.857 1.00 48.31 O
+ATOM 1285 CB ILE B 22 18.084 37.644 35.530 1.00 50.32 C
+ATOM 1286 CG1 ILE B 22 17.436 37.267 36.860 1.00 49.65 C
+ATOM 1287 CG2 ILE B 22 19.557 37.369 35.576 1.00 53.96 C
+ATOM 1288 CD1 ILE B 22 17.418 35.787 37.116 1.00 46.20 C
+ATOM 1289 H ILE B 22 15.834 38.708 34.596 1.00 0.00 H
+ATOM 1290 HA ILE B 22 18.212 39.715 36.040 1.00 0.00 H
+ATOM 1291 HB ILE B 22 17.627 37.045 34.773 1.00 0.00 H
+ATOM 1292 1HG1 ILE B 22 17.978 37.753 37.663 1.00 0.00 H
+ATOM 1293 2HG1 ILE B 22 16.405 37.621 36.870 1.00 0.00 H
+ATOM 1294 1HG2 ILE B 22 19.687 36.325 35.790 1.00 0.00 H
+ATOM 1295 2HG2 ILE B 22 20.016 37.607 34.623 1.00 0.00 H
+ATOM 1296 3HG2 ILE B 22 20.020 37.969 36.362 1.00 0.00 H
+ATOM 1297 1HD1 ILE B 22 16.946 35.600 38.076 1.00 0.00 H
+ATOM 1298 2HD1 ILE B 22 16.855 35.286 36.326 1.00 0.00 H
+ATOM 1299 3HD1 ILE B 22 18.437 35.411 37.132 1.00 0.00 H
+ATOM 1300 N GLY B 23 19.604 40.324 34.115 1.00 51.56 N
+ATOM 1301 CA GLY B 23 20.411 40.706 32.965 1.00 49.00 C
+ATOM 1302 C GLY B 23 21.552 39.713 32.772 1.00 50.00 C
+ATOM 1303 O GLY B 23 22.275 39.399 33.726 1.00 49.43 O
+ATOM 1304 H GLY B 23 19.843 40.644 35.052 1.00 0.00 H
+ATOM 1305 1HA GLY B 23 19.791 40.735 32.068 1.00 0.00 H
+ATOM 1306 2HA GLY B 23 20.816 41.705 33.114 1.00 0.00 H
+ATOM 1307 N LEU B 24 21.717 39.258 31.524 1.00 47.40 N
+ATOM 1308 CA LEU B 24 22.771 38.328 31.120 1.00 47.58 C
+ATOM 1309 C LEU B 24 23.843 39.061 30.311 1.00 46.16 C
+ATOM 1310 O LEU B 24 23.530 39.763 29.331 1.00 44.75 O
+ATOM 1311 CB LEU B 24 22.174 37.193 30.286 1.00 51.58 C
+ATOM 1312 CG LEU B 24 21.459 36.065 31.058 1.00 52.71 C
+ATOM 1313 CD1 LEU B 24 20.131 36.578 31.610 1.00 51.51 C
+ATOM 1314 CD2 LEU B 24 21.223 34.878 30.135 1.00 45.67 C
+ATOM 1315 H LEU B 24 21.046 39.546 30.817 1.00 0.00 H
+ATOM 1316 HA LEU B 24 23.223 37.908 32.011 1.00 0.00 H
+ATOM 1317 1HB LEU B 24 21.441 37.640 29.657 1.00 0.00 H
+ATOM 1318 2HB LEU B 24 22.946 36.759 29.662 1.00 0.00 H
+ATOM 1319 HG LEU B 24 22.079 35.753 31.887 1.00 0.00 H
+ATOM 1320 1HD1 LEU B 24 19.642 35.783 32.162 1.00 0.00 H
+ATOM 1321 2HD1 LEU B 24 20.303 37.403 32.268 1.00 0.00 H
+ATOM 1322 3HD1 LEU B 24 19.492 36.900 30.790 1.00 0.00 H
+ATOM 1323 1HD2 LEU B 24 20.724 34.078 30.689 1.00 0.00 H
+ATOM 1324 2HD2 LEU B 24 20.598 35.181 29.302 1.00 0.00 H
+ATOM 1325 3HD2 LEU B 24 22.176 34.510 29.758 1.00 0.00 H
+ATOM 1326 N THR B 25 25.110 38.875 30.712 1.00 46.51 N
+ATOM 1327 CA THR B 25 26.206 39.649 30.129 1.00 45.74 C
+ATOM 1328 C THR B 25 26.465 39.404 28.655 1.00 45.19 C
+ATOM 1329 O THR B 25 26.393 38.274 28.163 1.00 41.73 O
+ATOM 1330 CB THR B 25 27.547 39.416 30.875 1.00 43.63 C
+ATOM 1331 OG1 THR B 25 27.912 38.027 30.843 1.00 49.37 O
+ATOM 1332 CG2 THR B 25 27.436 39.858 32.312 1.00 45.65 C
+ATOM 1333 H THR B 25 25.288 38.255 31.495 1.00 0.00 H
+ATOM 1334 HA THR B 25 25.949 40.693 30.256 1.00 0.00 H
+ATOM 1335 HB THR B 25 28.339 39.996 30.389 1.00 0.00 H
+ATOM 1336 HG1 THR B 25 28.597 37.852 30.149 1.00 0.00 H
+ATOM 1337 1HG2 THR B 25 28.389 39.691 32.811 1.00 0.00 H
+ATOM 1338 2HG2 THR B 25 27.188 40.915 32.339 1.00 0.00 H
+ATOM 1339 3HG2 THR B 25 26.661 39.292 32.816 1.00 0.00 H
+ATOM 1340 N ARG B 26 26.824 40.499 27.985 1.00 44.20 N
+ATOM 1341 CA ARG B 26 27.217 40.534 26.585 1.00 44.83 C
+ATOM 1342 C ARG B 26 28.701 40.236 26.432 1.00 45.73 C
+ATOM 1343 O ARG B 26 29.528 40.798 27.150 1.00 48.43 O
+ATOM 1344 CB ARG B 26 26.932 41.905 25.976 1.00 40.26 C
+ATOM 1345 CG ARG B 26 27.173 42.001 24.466 1.00 39.08 C
+ATOM 1346 CD ARG B 26 26.945 43.383 23.923 1.00 33.33 C
+ATOM 1347 NE ARG B 26 25.575 43.848 24.106 1.00 44.58 N
+ATOM 1348 CZ ARG B 26 24.538 43.518 23.323 1.00 45.60 C
+ATOM 1349 NH1 ARG B 26 24.705 42.704 22.309 1.00 46.84 N
+ATOM 1350 NH2 ARG B 26 23.361 44.032 23.599 1.00 38.84 N
+ATOM 1351 H ARG B 26 26.798 41.376 28.497 1.00 0.00 H
+ATOM 1352 HA ARG B 26 26.654 39.775 26.043 1.00 0.00 H
+ATOM 1353 1HB ARG B 26 25.900 42.189 26.175 1.00 0.00 H
+ATOM 1354 2HB ARG B 26 27.568 42.654 26.457 1.00 0.00 H
+ATOM 1355 1HG ARG B 26 28.204 41.729 24.250 1.00 0.00 H
+ATOM 1356 2HG ARG B 26 26.505 41.317 23.946 1.00 0.00 H
+ATOM 1357 1HD ARG B 26 27.608 44.078 24.424 1.00 0.00 H
+ATOM 1358 2HD ARG B 26 27.162 43.390 22.857 1.00 0.00 H
+ATOM 1359 HE ARG B 26 25.371 44.502 24.870 1.00 0.00 H
+ATOM 1360 1HH1 ARG B 26 25.620 42.333 22.119 1.00 0.00 H
+ATOM 1361 2HH1 ARG B 26 23.924 42.462 21.716 1.00 0.00 H
+ATOM 1362 1HH2 ARG B 26 23.297 44.674 24.392 1.00 0.00 H
+ATOM 1363 2HH2 ARG B 26 22.534 43.802 23.049 1.00 0.00 H
+ATOM 1364 N GLY B 27 29.042 39.365 25.491 1.00 43.30 N
+ATOM 1365 CA GLY B 27 30.441 39.051 25.233 1.00 40.81 C
+ATOM 1366 C GLY B 27 30.677 37.553 25.202 1.00 45.39 C
+ATOM 1367 O GLY B 27 29.737 36.764 25.218 1.00 43.49 O
+ATOM 1368 H GLY B 27 28.323 38.915 24.943 1.00 0.00 H
+ATOM 1369 1HA GLY B 27 30.736 39.491 24.283 1.00 0.00 H
+ATOM 1370 2HA GLY B 27 31.066 39.501 26.002 1.00 0.00 H
+ATOM 1371 N ALA B 28 31.950 37.163 25.147 1.00 46.13 N
+ATOM 1372 CA ALA B 28 32.323 35.749 25.092 1.00 49.26 C
+ATOM 1373 C ALA B 28 31.821 34.989 26.319 1.00 49.95 C
+ATOM 1374 O ALA B 28 31.479 33.809 26.224 1.00 51.55 O
+ATOM 1375 CB ALA B 28 33.834 35.611 24.986 1.00 43.06 C
+ATOM 1376 H ALA B 28 32.675 37.864 25.133 1.00 0.00 H
+ATOM 1377 HA ALA B 28 31.858 35.310 24.209 1.00 0.00 H
+ATOM 1378 1HB ALA B 28 34.092 34.555 24.923 1.00 0.00 H
+ATOM 1379 2HB ALA B 28 34.188 36.126 24.095 1.00 0.00 H
+ATOM 1380 3HB ALA B 28 34.304 36.045 25.868 1.00 0.00 H
+ATOM 1381 N ASP B 29 31.800 35.662 27.472 1.00 51.36 N
+ATOM 1382 CA ASP B 29 31.364 35.056 28.722 1.00 49.84 C
+ATOM 1383 C ASP B 29 29.988 35.576 29.154 1.00 45.16 C
+ATOM 1384 O ASP B 29 29.847 36.748 29.523 1.00 38.10 O
+ATOM 1385 CB ASP B 29 32.373 35.347 29.839 1.00 60.54 C
+ATOM 1386 CG ASP B 29 33.742 34.683 29.635 1.00 68.43 C
+ATOM 1387 OD1 ASP B 29 33.849 33.798 28.825 1.00 71.52 O
+ATOM 1388 OD2 ASP B 29 34.669 35.087 30.292 1.00 73.31 O
+ATOM 1389 H ASP B 29 32.093 36.628 27.470 1.00 0.00 H
+ATOM 1390 HA ASP B 29 31.290 33.977 28.581 1.00 0.00 H
+ATOM 1391 1HB ASP B 29 32.522 36.422 29.924 1.00 0.00 H
+ATOM 1392 2HB ASP B 29 31.963 35.000 30.786 1.00 0.00 H
+ATOM 1393 N THR B 30 28.991 34.696 29.129 1.00 44.66 N
+ATOM 1394 CA THR B 30 27.634 35.076 29.519 1.00 51.85 C
+ATOM 1395 C THR B 30 27.313 34.627 30.940 1.00 54.28 C
+ATOM 1396 O THR B 30 27.414 33.444 31.266 1.00 54.73 O
+ATOM 1397 CB THR B 30 26.576 34.514 28.554 1.00 46.78 C
+ATOM 1398 OG1 THR B 30 26.785 35.055 27.244 1.00 52.10 O
+ATOM 1399 CG2 THR B 30 25.182 34.885 29.045 1.00 48.80 C
+ATOM 1400 H THR B 30 29.174 33.754 28.812 1.00 0.00 H
+ATOM 1401 HA THR B 30 27.553 36.156 29.473 1.00 0.00 H
+ATOM 1402 HB THR B 30 26.666 33.431 28.502 1.00 0.00 H
+ATOM 1403 HG1 THR B 30 26.787 36.027 27.302 1.00 0.00 H
+ATOM 1404 1HG2 THR B 30 24.437 34.486 28.361 1.00 0.00 H
+ATOM 1405 2HG2 THR B 30 25.018 34.469 30.040 1.00 0.00 H
+ATOM 1406 3HG2 THR B 30 25.098 35.972 29.088 1.00 0.00 H
+ATOM 1407 N ARG B 31 26.914 35.577 31.779 1.00 54.86 N
+ATOM 1408 CA ARG B 31 26.571 35.314 33.173 1.00 57.45 C
+ATOM 1409 C ARG B 31 25.561 36.312 33.693 1.00 55.95 C
+ATOM 1410 O ARG B 31 25.265 37.310 33.045 1.00 56.12 O
+ATOM 1411 CB ARG B 31 27.785 35.409 34.079 1.00 63.75 C
+ATOM 1412 CG ARG B 31 28.424 36.801 34.138 1.00 68.26 C
+ATOM 1413 CD ARG B 31 29.449 36.878 35.201 1.00 66.27 C
+ATOM 1414 NE ARG B 31 30.189 38.143 35.198 1.00 73.90 N
+ATOM 1415 CZ ARG B 31 29.826 39.299 35.811 1.00 69.51 C
+ATOM 1416 NH1 ARG B 31 28.696 39.424 36.489 1.00 65.31 N
+ATOM 1417 NH2 ARG B 31 30.640 40.339 35.729 1.00 61.42 N
+ATOM 1418 H ARG B 31 26.916 36.531 31.435 1.00 0.00 H
+ATOM 1419 HA ARG B 31 26.145 34.311 33.246 1.00 0.00 H
+ATOM 1420 1HB ARG B 31 27.504 35.136 35.094 1.00 0.00 H
+ATOM 1421 2HB ARG B 31 28.546 34.706 33.747 1.00 0.00 H
+ATOM 1422 1HG ARG B 31 28.901 37.025 33.181 1.00 0.00 H
+ATOM 1423 2HG ARG B 31 27.657 37.548 34.348 1.00 0.00 H
+ATOM 1424 1HD ARG B 31 28.961 36.770 36.171 1.00 0.00 H
+ATOM 1425 2HD ARG B 31 30.164 36.070 35.063 1.00 0.00 H
+ATOM 1426 HE ARG B 31 31.072 38.149 34.705 1.00 0.00 H
+ATOM 1427 1HH1 ARG B 31 28.016 38.658 36.565 1.00 0.00 H
+ATOM 1428 2HH1 ARG B 31 28.491 40.301 36.940 1.00 0.00 H
+ATOM 1429 1HH2 ARG B 31 31.507 40.260 35.217 1.00 0.00 H
+ATOM 1430 2HH2 ARG B 31 30.396 41.210 36.178 1.00 0.00 H
+ATOM 1431 N PHE B 32 25.021 36.062 34.873 1.00 56.09 N
+ATOM 1432 CA PHE B 32 24.116 37.046 35.446 1.00 55.79 C
+ATOM 1433 C PHE B 32 24.945 38.205 35.981 1.00 55.17 C
+ATOM 1434 O PHE B 32 26.008 37.977 36.574 1.00 55.08 O
+ATOM 1435 CB PHE B 32 23.315 36.440 36.598 1.00 50.81 C
+ATOM 1436 CG PHE B 32 22.354 35.394 36.169 1.00 65.81 C
+ATOM 1437 CD1 PHE B 32 21.674 34.622 37.106 1.00 63.47 C
+ATOM 1438 CD2 PHE B 32 22.133 35.161 34.826 1.00 67.31 C
+ATOM 1439 CE1 PHE B 32 20.790 33.647 36.701 1.00 64.63 C
+ATOM 1440 CE2 PHE B 32 21.252 34.185 34.418 1.00 59.04 C
+ATOM 1441 CZ PHE B 32 20.581 33.430 35.357 1.00 62.38 C
+ATOM 1442 H PHE B 32 25.246 35.218 35.380 1.00 0.00 H
+ATOM 1443 HA PHE B 32 23.439 37.413 34.674 1.00 0.00 H
+ATOM 1444 1HB PHE B 32 23.992 36.008 37.332 1.00 0.00 H
+ATOM 1445 2HB PHE B 32 22.753 37.232 37.095 1.00 0.00 H
+ATOM 1446 HD1 PHE B 32 21.845 34.798 38.169 1.00 0.00 H
+ATOM 1447 HD2 PHE B 32 22.665 35.762 34.093 1.00 0.00 H
+ATOM 1448 HE1 PHE B 32 20.261 33.048 37.440 1.00 0.00 H
+ATOM 1449 HE2 PHE B 32 21.082 34.002 33.355 1.00 0.00 H
+ATOM 1450 HZ PHE B 32 19.894 32.663 35.032 1.00 0.00 H
+ATOM 1451 N HIS B 33 24.454 39.435 35.819 1.00 54.25 N
+ATOM 1452 CA HIS B 33 25.155 40.572 36.415 1.00 56.09 C
+ATOM 1453 C HIS B 33 24.231 41.430 37.282 1.00 58.11 C
+ATOM 1454 O HIS B 33 24.690 42.302 38.019 1.00 57.70 O
+ATOM 1455 CB HIS B 33 25.800 41.443 35.331 1.00 42.53 C
+ATOM 1456 CG HIS B 33 24.842 42.190 34.454 1.00 47.39 C
+ATOM 1457 ND1 HIS B 33 24.276 43.381 34.850 1.00 42.29 N
+ATOM 1458 CD2 HIS B 33 24.356 41.943 33.210 1.00 45.29 C
+ATOM 1459 CE1 HIS B 33 23.484 43.830 33.906 1.00 45.18 C
+ATOM 1460 NE2 HIS B 33 23.516 42.986 32.896 1.00 45.01 N
+ATOM 1461 H HIS B 33 23.610 39.560 35.261 1.00 0.00 H
+ATOM 1462 HA HIS B 33 25.948 40.208 37.065 1.00 0.00 H
+ATOM 1463 1HB HIS B 33 26.460 42.173 35.800 1.00 0.00 H
+ATOM 1464 2HB HIS B 33 26.414 40.817 34.705 1.00 0.00 H
+ATOM 1465 HD2 HIS B 33 24.588 41.087 32.579 1.00 0.00 H
+ATOM 1466 HE1 HIS B 33 22.907 44.753 33.950 1.00 0.00 H
+ATOM 1467 HE2 HIS B 33 22.998 43.111 32.035 1.00 0.00 H
+ATOM 1468 N HIS B 34 22.929 41.178 37.192 1.00 58.98 N
+ATOM 1469 CA HIS B 34 21.937 41.934 37.954 1.00 56.77 C
+ATOM 1470 C HIS B 34 20.590 41.239 37.985 1.00 56.67 C
+ATOM 1471 O HIS B 34 20.105 40.751 36.965 1.00 56.03 O
+ATOM 1472 CB HIS B 34 21.736 43.350 37.402 1.00 40.70 C
+ATOM 1473 CG HIS B 34 20.787 44.183 38.243 1.00 64.48 C
+ATOM 1474 ND1 HIS B 34 21.121 44.661 39.496 1.00 61.09 N
+ATOM 1475 CD2 HIS B 34 19.524 44.615 38.001 1.00 63.07 C
+ATOM 1476 CE1 HIS B 34 20.098 45.353 39.987 1.00 60.10 C
+ATOM 1477 NE2 HIS B 34 19.121 45.340 39.098 1.00 65.54 N
+ATOM 1478 H HIS B 34 22.621 40.444 36.576 1.00 0.00 H
+ATOM 1479 HA HIS B 34 22.276 42.029 38.985 1.00 0.00 H
+ATOM 1480 1HB HIS B 34 22.695 43.870 37.347 1.00 0.00 H
+ATOM 1481 2HB HIS B 34 21.337 43.295 36.390 1.00 0.00 H
+ATOM 1482 HD2 HIS B 34 18.937 44.424 37.104 1.00 0.00 H
+ATOM 1483 HE1 HIS B 34 20.066 45.850 40.956 1.00 0.00 H
+ATOM 1484 HE2 HIS B 34 18.203 45.798 39.207 1.00 0.00 H
+ATOM 1485 N SER B 35 19.960 41.239 39.156 1.00 54.59 N
+ATOM 1486 CA SER B 35 18.611 40.700 39.298 1.00 53.61 C
+ATOM 1487 C SER B 35 17.698 41.767 39.893 1.00 53.74 C
+ATOM 1488 O SER B 35 17.857 42.141 41.057 1.00 58.10 O
+ATOM 1489 CB SER B 35 18.621 39.478 40.203 1.00 48.67 C
+ATOM 1490 OG SER B 35 19.422 38.452 39.672 1.00 62.25 O
+ATOM 1491 H SER B 35 20.416 41.650 39.960 1.00 0.00 H
+ATOM 1492 HA SER B 35 18.227 40.427 38.317 1.00 0.00 H
+ATOM 1493 1HB SER B 35 18.984 39.753 41.193 1.00 0.00 H
+ATOM 1494 2HB SER B 35 17.598 39.116 40.325 1.00 0.00 H
+ATOM 1495 HG SER B 35 20.331 38.733 39.793 1.00 0.00 H
+ATOM 1496 N GLU B 36 16.760 42.272 39.099 1.00 55.10 N
+ATOM 1497 CA GLU B 36 15.876 43.322 39.588 1.00 54.70 C
+ATOM 1498 C GLU B 36 14.609 42.717 40.169 1.00 56.19 C
+ATOM 1499 O GLU B 36 13.839 42.070 39.451 1.00 55.35 O
+ATOM 1500 CB GLU B 36 15.506 44.318 38.480 1.00 50.06 C
+ATOM 1501 CG GLU B 36 14.650 45.512 38.958 1.00 57.95 C
+ATOM 1502 CD GLU B 36 15.407 46.481 39.839 1.00 62.92 C
+ATOM 1503 OE1 GLU B 36 16.606 46.612 39.665 1.00 48.49 O
+ATOM 1504 OE2 GLU B 36 14.789 47.112 40.684 1.00 68.63 O
+ATOM 1505 H GLU B 36 16.660 41.924 38.149 1.00 0.00 H
+ATOM 1506 HA GLU B 36 16.389 43.868 40.380 1.00 0.00 H
+ATOM 1507 1HB GLU B 36 16.410 44.711 38.015 1.00 0.00 H
+ATOM 1508 2HB GLU B 36 14.944 43.803 37.704 1.00 0.00 H
+ATOM 1509 1HG GLU B 36 14.276 46.061 38.104 1.00 0.00 H
+ATOM 1510 2HG GLU B 36 13.789 45.127 39.511 1.00 0.00 H
+ATOM 1511 N LYS B 37 14.403 42.894 41.472 1.00 55.39 N
+ATOM 1512 CA LYS B 37 13.216 42.336 42.104 1.00 52.87 C
+ATOM 1513 C LYS B 37 12.016 43.232 41.885 1.00 49.24 C
+ATOM 1514 O LYS B 37 12.095 44.447 42.088 1.00 46.19 O
+ATOM 1515 CB LYS B 37 13.396 42.151 43.612 1.00 57.12 C
+ATOM 1516 CG LYS B 37 14.370 41.079 44.037 1.00 58.32 C
+ATOM 1517 CD LYS B 37 14.410 40.957 45.548 1.00 45.00 C
+ATOM 1518 CE LYS B 37 15.357 39.859 45.988 1.00 45.00 C
+ATOM 1519 NZ LYS B 37 15.387 39.709 47.472 1.00 45.00 N
+ATOM 1520 H LYS B 37 15.072 43.418 42.018 1.00 0.00 H
+ATOM 1521 HA LYS B 37 13.010 41.365 41.660 1.00 0.00 H
+ATOM 1522 1HB LYS B 37 13.739 43.086 44.046 1.00 0.00 H
+ATOM 1523 2HB LYS B 37 12.426 41.920 44.059 1.00 0.00 H
+ATOM 1524 1HG LYS B 37 14.026 40.133 43.642 1.00 0.00 H
+ATOM 1525 2HG LYS B 37 15.367 41.287 43.641 1.00 0.00 H
+ATOM 1526 1HD LYS B 37 14.739 41.904 45.975 1.00 0.00 H
+ATOM 1527 2HD LYS B 37 13.407 40.739 45.917 1.00 0.00 H
+ATOM 1528 1HE LYS B 37 15.038 38.920 45.543 1.00 0.00 H
+ATOM 1529 2HE LYS B 37 16.356 40.096 45.637 1.00 0.00 H
+ATOM 1530 1HZ LYS B 37 16.030 38.971 47.725 1.00 0.00 H
+ATOM 1531 2HZ LYS B 37 15.690 40.574 47.890 1.00 0.00 H
+ATOM 1532 3HZ LYS B 37 14.465 39.478 47.805 1.00 0.00 H
+ATOM 1533 N LEU B 38 10.897 42.626 41.520 1.00 48.71 N
+ATOM 1534 CA LEU B 38 9.646 43.341 41.385 1.00 53.35 C
+ATOM 1535 C LEU B 38 8.615 42.761 42.359 1.00 55.32 C
+ATOM 1536 O LEU B 38 8.486 41.533 42.506 1.00 55.24 O
+ATOM 1537 CB LEU B 38 9.113 43.235 39.943 1.00 46.52 C
+ATOM 1538 CG LEU B 38 10.007 43.740 38.789 1.00 51.52 C
+ATOM 1539 CD1 LEU B 38 9.289 43.458 37.437 1.00 41.97 C
+ATOM 1540 CD2 LEU B 38 10.282 45.209 38.963 1.00 45.70 C
+ATOM 1541 H LEU B 38 10.924 41.632 41.334 1.00 0.00 H
+ATOM 1542 HA LEU B 38 9.803 44.392 41.634 1.00 0.00 H
+ATOM 1543 1HB LEU B 38 8.945 42.213 39.745 1.00 0.00 H
+ATOM 1544 2HB LEU B 38 8.164 43.759 39.883 1.00 0.00 H
+ATOM 1545 HG LEU B 38 10.957 43.191 38.795 1.00 0.00 H
+ATOM 1546 1HD1 LEU B 38 9.911 43.797 36.608 1.00 0.00 H
+ATOM 1547 2HD1 LEU B 38 9.108 42.388 37.334 1.00 0.00 H
+ATOM 1548 3HD1 LEU B 38 8.334 43.992 37.409 1.00 0.00 H
+ATOM 1549 1HD2 LEU B 38 10.917 45.553 38.165 1.00 0.00 H
+ATOM 1550 2HD2 LEU B 38 9.344 45.758 38.951 1.00 0.00 H
+ATOM 1551 3HD2 LEU B 38 10.784 45.364 39.916 1.00 0.00 H
+ATOM 1552 N ASP B 39 7.841 43.632 42.980 1.00 57.07 N
+ATOM 1553 CA ASP B 39 6.718 43.167 43.786 1.00 61.04 C
+ATOM 1554 C ASP B 39 5.472 43.188 42.919 1.00 61.83 C
+ATOM 1555 O ASP B 39 5.494 43.799 41.851 1.00 64.22 O
+ATOM 1556 CB ASP B 39 6.560 43.954 45.082 1.00 64.21 C
+ATOM 1557 CG ASP B 39 7.688 43.617 46.073 1.00 62.92 C
+ATOM 1558 OD1 ASP B 39 8.381 42.646 45.832 1.00 60.59 O
+ATOM 1559 OD2 ASP B 39 7.836 44.304 47.054 1.00 56.34 O
+ATOM 1560 H ASP B 39 8.019 44.632 42.859 1.00 0.00 H
+ATOM 1561 HA ASP B 39 6.911 42.145 44.073 1.00 0.00 H
+ATOM 1562 1HB ASP B 39 6.566 45.027 44.873 1.00 0.00 H
+ATOM 1563 2HB ASP B 39 5.597 43.705 45.542 1.00 0.00 H
+ATOM 1564 N LYS B 40 4.406 42.507 43.328 1.00 60.74 N
+ATOM 1565 CA LYS B 40 3.227 42.454 42.472 1.00 58.62 C
+ATOM 1566 C LYS B 40 2.786 43.847 42.073 1.00 56.96 C
+ATOM 1567 O LYS B 40 2.625 44.723 42.923 1.00 57.08 O
+ATOM 1568 CB LYS B 40 2.075 41.719 43.162 1.00 56.58 C
+ATOM 1569 CG LYS B 40 0.834 41.545 42.295 1.00 60.54 C
+ATOM 1570 CD LYS B 40 -0.198 40.654 42.967 1.00 56.43 C
+ATOM 1571 CE LYS B 40 -1.396 40.426 42.055 1.00 62.55 C
+ATOM 1572 NZ LYS B 40 -2.400 39.503 42.659 1.00 62.73 N
+ATOM 1573 H LYS B 40 4.405 42.017 44.225 1.00 0.00 H
+ATOM 1574 HA LYS B 40 3.483 41.908 41.564 1.00 0.00 H
+ATOM 1575 1HB LYS B 40 2.406 40.745 43.481 1.00 0.00 H
+ATOM 1576 2HB LYS B 40 1.785 42.264 44.062 1.00 0.00 H
+ATOM 1577 1HG LYS B 40 0.385 42.521 42.110 1.00 0.00 H
+ATOM 1578 2HG LYS B 40 1.114 41.112 41.340 1.00 0.00 H
+ATOM 1579 1HD LYS B 40 0.257 39.690 43.194 1.00 0.00 H
+ATOM 1580 2HD LYS B 40 -0.529 41.112 43.900 1.00 0.00 H
+ATOM 1581 1HE LYS B 40 -1.872 41.383 41.851 1.00 0.00 H
+ATOM 1582 2HE LYS B 40 -1.046 39.998 41.115 1.00 0.00 H
+ATOM 1583 1HZ LYS B 40 -3.170 39.381 42.017 1.00 0.00 H
+ATOM 1584 2HZ LYS B 40 -1.968 38.608 42.839 1.00 0.00 H
+ATOM 1585 3HZ LYS B 40 -2.742 39.890 43.524 1.00 0.00 H
+ATOM 1586 N GLY B 41 2.595 44.051 40.773 1.00 55.53 N
+ATOM 1587 CA GLY B 41 2.167 45.338 40.249 1.00 50.55 C
+ATOM 1588 C GLY B 41 3.310 46.239 39.776 1.00 48.74 C
+ATOM 1589 O GLY B 41 3.078 47.227 39.078 1.00 49.05 O
+ATOM 1590 H GLY B 41 2.748 43.287 40.114 1.00 0.00 H
+ATOM 1591 1HA GLY B 41 1.470 45.173 39.434 1.00 0.00 H
+ATOM 1592 2HA GLY B 41 1.613 45.858 41.029 1.00 0.00 H
+ATOM 1593 N GLU B 42 4.550 45.929 40.132 1.00 49.35 N
+ATOM 1594 CA GLU B 42 5.629 46.799 39.676 1.00 52.15 C
+ATOM 1595 C GLU B 42 5.950 46.547 38.211 1.00 54.51 C
+ATOM 1596 O GLU B 42 5.908 45.407 37.731 1.00 52.52 O
+ATOM 1597 CB GLU B 42 6.874 46.670 40.564 1.00 60.62 C
+ATOM 1598 CG GLU B 42 6.682 47.250 41.972 1.00 67.42 C
+ATOM 1599 CD GLU B 42 7.933 47.256 42.810 1.00 67.67 C
+ATOM 1600 OE1 GLU B 42 8.685 46.319 42.743 1.00 56.96 O
+ATOM 1601 OE2 GLU B 42 8.121 48.199 43.540 1.00 69.61 O
+ATOM 1602 H GLU B 42 4.745 45.119 40.716 1.00 0.00 H
+ATOM 1603 HA GLU B 42 5.291 47.834 39.761 1.00 0.00 H
+ATOM 1604 1HB GLU B 42 7.125 45.623 40.678 1.00 0.00 H
+ATOM 1605 2HB GLU B 42 7.723 47.174 40.098 1.00 0.00 H
+ATOM 1606 1HG GLU B 42 6.319 48.277 41.878 1.00 0.00 H
+ATOM 1607 2HG GLU B 42 5.911 46.671 42.486 1.00 0.00 H
+ATOM 1608 N VAL B 43 6.270 47.627 37.492 1.00 55.33 N
+ATOM 1609 CA VAL B 43 6.598 47.514 36.074 1.00 56.62 C
+ATOM 1610 C VAL B 43 8.011 47.965 35.755 1.00 57.77 C
+ATOM 1611 O VAL B 43 8.447 49.040 36.165 1.00 57.24 O
+ATOM 1612 CB VAL B 43 5.596 48.325 35.209 1.00 56.38 C
+ATOM 1613 CG1 VAL B 43 6.019 48.296 33.741 1.00 47.09 C
+ATOM 1614 CG2 VAL B 43 4.201 47.703 35.329 1.00 48.60 C
+ATOM 1615 H VAL B 43 6.284 48.545 37.944 1.00 0.00 H
+ATOM 1616 HA VAL B 43 6.509 46.468 35.790 1.00 0.00 H
+ATOM 1617 HB VAL B 43 5.579 49.360 35.549 1.00 0.00 H
+ATOM 1618 1HG1 VAL B 43 5.311 48.865 33.145 1.00 0.00 H
+ATOM 1619 2HG1 VAL B 43 7.008 48.736 33.636 1.00 0.00 H
+ATOM 1620 3HG1 VAL B 43 6.041 47.260 33.394 1.00 0.00 H
+ATOM 1621 1HG2 VAL B 43 3.487 48.263 34.721 1.00 0.00 H
+ATOM 1622 2HG2 VAL B 43 4.250 46.687 34.977 1.00 0.00 H
+ATOM 1623 3HG2 VAL B 43 3.881 47.711 36.368 1.00 0.00 H
+ATOM 1624 N LEU B 44 8.726 47.125 35.016 1.00 58.51 N
+ATOM 1625 CA LEU B 44 10.076 47.448 34.588 1.00 57.62 C
+ATOM 1626 C LEU B 44 10.170 47.488 33.072 1.00 57.58 C
+ATOM 1627 O LEU B 44 9.818 46.525 32.389 1.00 57.35 O
+ATOM 1628 CB LEU B 44 11.072 46.420 35.120 1.00 51.60 C
+ATOM 1629 CG LEU B 44 12.538 46.620 34.697 1.00 46.63 C
+ATOM 1630 CD1 LEU B 44 13.083 47.928 35.300 1.00 45.64 C
+ATOM 1631 CD2 LEU B 44 13.340 45.421 35.158 1.00 45.25 C
+ATOM 1632 H LEU B 44 8.310 46.238 34.737 1.00 0.00 H
+ATOM 1633 HA LEU B 44 10.342 48.430 34.972 1.00 0.00 H
+ATOM 1634 1HB LEU B 44 11.043 46.453 36.192 1.00 0.00 H
+ATOM 1635 2HB LEU B 44 10.757 45.427 34.794 1.00 0.00 H
+ATOM 1636 HG LEU B 44 12.598 46.702 33.612 1.00 0.00 H
+ATOM 1637 1HD1 LEU B 44 14.114 48.065 34.992 1.00 0.00 H
+ATOM 1638 2HD1 LEU B 44 12.486 48.765 34.946 1.00 0.00 H
+ATOM 1639 3HD1 LEU B 44 13.034 47.880 36.387 1.00 0.00 H
+ATOM 1640 1HD2 LEU B 44 14.382 45.537 34.864 1.00 0.00 H
+ATOM 1641 2HD2 LEU B 44 13.278 45.332 36.233 1.00 0.00 H
+ATOM 1642 3HD2 LEU B 44 12.930 44.530 34.703 1.00 0.00 H
+ATOM 1643 N ILE B 45 10.628 48.609 32.544 1.00 56.16 N
+ATOM 1644 CA ILE B 45 10.809 48.734 31.112 1.00 55.45 C
+ATOM 1645 C ILE B 45 12.303 48.831 30.874 1.00 55.07 C
+ATOM 1646 O ILE B 45 12.962 49.715 31.422 1.00 53.59 O
+ATOM 1647 CB ILE B 45 10.084 49.963 30.563 1.00 50.31 C
+ATOM 1648 CG1 ILE B 45 8.607 49.857 30.913 1.00 50.29 C
+ATOM 1649 CG2 ILE B 45 10.248 49.962 29.056 1.00 43.88 C
+ATOM 1650 CD1 ILE B 45 7.821 51.083 30.678 1.00 43.38 C
+ATOM 1651 H ILE B 45 10.868 49.389 33.148 1.00 0.00 H
+ATOM 1652 HA ILE B 45 10.431 47.847 30.615 1.00 0.00 H
+ATOM 1653 HB ILE B 45 10.488 50.878 30.998 1.00 0.00 H
+ATOM 1654 1HG1 ILE B 45 8.185 49.070 30.324 1.00 0.00 H
+ATOM 1655 2HG1 ILE B 45 8.513 49.593 31.961 1.00 0.00 H
+ATOM 1656 1HG2 ILE B 45 9.728 50.804 28.617 1.00 0.00 H
+ATOM 1657 2HG2 ILE B 45 11.304 50.009 28.803 1.00 0.00 H
+ATOM 1658 3HG2 ILE B 45 9.834 49.041 28.673 1.00 0.00 H
+ATOM 1659 1HD1 ILE B 45 6.799 50.885 30.947 1.00 0.00 H
+ATOM 1660 2HD1 ILE B 45 8.210 51.901 31.284 1.00 0.00 H
+ATOM 1661 3HD1 ILE B 45 7.879 51.344 29.639 1.00 0.00 H
+ATOM 1662 N ALA B 46 12.866 47.919 30.093 1.00 53.64 N
+ATOM 1663 CA ALA B 46 14.322 47.934 30.012 1.00 52.67 C
+ATOM 1664 C ALA B 46 14.881 47.615 28.650 1.00 51.13 C
+ATOM 1665 O ALA B 46 14.400 46.729 27.943 1.00 50.62 O
+ATOM 1666 CB ALA B 46 14.873 46.931 31.007 1.00 45.40 C
+ATOM 1667 H ALA B 46 12.295 47.224 29.614 1.00 0.00 H
+ATOM 1668 HA ALA B 46 14.664 48.931 30.271 1.00 0.00 H
+ATOM 1669 1HB ALA B 46 15.962 46.966 30.983 1.00 0.00 H
+ATOM 1670 2HB ALA B 46 14.521 47.174 32.008 1.00 0.00 H
+ATOM 1671 3HB ALA B 46 14.531 45.933 30.734 1.00 0.00 H
+ATOM 1672 N GLN B 47 15.943 48.341 28.312 1.00 47.94 N
+ATOM 1673 CA GLN B 47 16.659 48.183 27.059 1.00 45.03 C
+ATOM 1674 C GLN B 47 17.775 47.175 27.119 1.00 43.49 C
+ATOM 1675 O GLN B 47 18.361 46.926 28.175 1.00 43.28 O
+ATOM 1676 CB GLN B 47 17.260 49.507 26.595 1.00 43.09 C
+ATOM 1677 CG GLN B 47 16.271 50.558 26.213 1.00 41.15 C
+ATOM 1678 CD GLN B 47 16.936 51.772 25.680 1.00 46.46 C
+ATOM 1679 OE1 GLN B 47 18.018 52.167 26.136 1.00 46.02 O
+ATOM 1680 NE2 GLN B 47 16.304 52.387 24.687 1.00 37.01 N
+ATOM 1681 H GLN B 47 16.273 49.062 28.953 1.00 0.00 H
+ATOM 1682 HA GLN B 47 15.962 47.851 26.303 1.00 0.00 H
+ATOM 1683 1HB GLN B 47 17.883 49.914 27.394 1.00 0.00 H
+ATOM 1684 2HB GLN B 47 17.907 49.326 25.735 1.00 0.00 H
+ATOM 1685 1HG GLN B 47 15.668 50.170 25.413 1.00 0.00 H
+ATOM 1686 2HG GLN B 47 15.655 50.829 27.077 1.00 0.00 H
+ATOM 1687 1HE2 GLN B 47 16.689 53.212 24.276 1.00 0.00 H
+ATOM 1688 2HE2 GLN B 47 15.427 52.023 24.355 1.00 0.00 H
+ATOM 1689 N PHE B 48 18.117 46.653 25.952 1.00 42.91 N
+ATOM 1690 CA PHE B 48 19.305 45.827 25.823 1.00 41.43 C
+ATOM 1691 C PHE B 48 20.466 46.811 25.761 1.00 37.30 C
+ATOM 1692 O PHE B 48 20.294 47.923 25.261 1.00 35.34 O
+ATOM 1693 CB PHE B 48 19.222 44.956 24.583 1.00 38.32 C
+ATOM 1694 CG PHE B 48 18.170 43.896 24.704 1.00 32.68 C
+ATOM 1695 CD1 PHE B 48 18.397 42.746 25.447 1.00 32.00 C
+ATOM 1696 CD2 PHE B 48 16.931 44.067 24.095 1.00 39.56 C
+ATOM 1697 CE1 PHE B 48 17.408 41.798 25.571 1.00 38.56 C
+ATOM 1698 CE2 PHE B 48 15.947 43.122 24.226 1.00 33.39 C
+ATOM 1699 CZ PHE B 48 16.189 41.995 24.967 1.00 33.53 C
+ATOM 1700 H PHE B 48 17.541 46.866 25.135 1.00 0.00 H
+ATOM 1701 HA PHE B 48 19.417 45.194 26.704 1.00 0.00 H
+ATOM 1702 1HB PHE B 48 19.014 45.566 23.704 1.00 0.00 H
+ATOM 1703 2HB PHE B 48 20.182 44.467 24.438 1.00 0.00 H
+ATOM 1704 HD1 PHE B 48 19.367 42.606 25.934 1.00 0.00 H
+ATOM 1705 HD2 PHE B 48 16.745 44.974 23.517 1.00 0.00 H
+ATOM 1706 HE1 PHE B 48 17.583 40.904 26.152 1.00 0.00 H
+ATOM 1707 HE2 PHE B 48 14.975 43.267 23.751 1.00 0.00 H
+ATOM 1708 HZ PHE B 48 15.418 41.271 25.082 1.00 0.00 H
+ATOM 1709 N THR B 49 21.613 46.457 26.331 1.00 37.44 N
+ATOM 1710 CA THR B 49 22.712 47.426 26.414 1.00 39.95 C
+ATOM 1711 C THR B 49 24.045 46.880 25.972 1.00 42.10 C
+ATOM 1712 O THR B 49 24.176 45.721 25.578 1.00 41.13 O
+ATOM 1713 CB THR B 49 22.922 47.953 27.841 1.00 33.68 C
+ATOM 1714 OG1 THR B 49 23.485 46.909 28.650 1.00 33.77 O
+ATOM 1715 CG2 THR B 49 21.605 48.413 28.446 1.00 26.33 C
+ATOM 1716 H THR B 49 21.728 45.508 26.681 1.00 0.00 H
+ATOM 1717 HA THR B 49 22.477 48.274 25.768 1.00 0.00 H
+ATOM 1718 HB THR B 49 23.612 48.800 27.820 1.00 0.00 H
+ATOM 1719 HG1 THR B 49 24.161 46.452 28.136 1.00 0.00 H
+ATOM 1720 1HG2 THR B 49 21.780 48.784 29.453 1.00 0.00 H
+ATOM 1721 2HG2 THR B 49 21.183 49.209 27.830 1.00 0.00 H
+ATOM 1722 3HG2 THR B 49 20.904 47.579 28.489 1.00 0.00 H
+ATOM 1723 N GLU B 50 25.057 47.715 26.105 1.00 42.88 N
+ATOM 1724 CA GLU B 50 26.439 47.373 25.838 1.00 45.72 C
+ATOM 1725 C GLU B 50 26.896 46.214 26.737 1.00 48.76 C
+ATOM 1726 O GLU B 50 27.851 45.510 26.413 1.00 51.37 O
+ATOM 1727 CB GLU B 50 27.317 48.592 26.086 1.00 41.16 C
+ATOM 1728 CG GLU B 50 26.892 49.828 25.303 1.00 45.73 C
+ATOM 1729 CD GLU B 50 25.817 50.612 26.047 1.00 46.95 C
+ATOM 1730 OE1 GLU B 50 24.671 50.597 25.634 1.00 32.40 O
+ATOM 1731 OE2 GLU B 50 26.150 51.221 27.034 1.00 46.85 O
+ATOM 1732 H GLU B 50 24.863 48.656 26.418 1.00 0.00 H
+ATOM 1733 HA GLU B 50 26.529 47.064 24.795 1.00 0.00 H
+ATOM 1734 1HB GLU B 50 27.291 48.847 27.145 1.00 0.00 H
+ATOM 1735 2HB GLU B 50 28.349 48.359 25.832 1.00 0.00 H
+ATOM 1736 1HG GLU B 50 27.758 50.473 25.137 1.00 0.00 H
+ATOM 1737 2HG GLU B 50 26.508 49.517 24.331 1.00 0.00 H
+ATOM 1738 N HIS B 51 26.226 46.044 27.887 1.00 47.25 N
+ATOM 1739 CA HIS B 51 26.585 45.003 28.836 1.00 48.66 C
+ATOM 1740 C HIS B 51 25.527 43.894 28.944 1.00 46.78 C
+ATOM 1741 O HIS B 51 25.869 42.779 29.326 1.00 45.51 O
+ATOM 1742 CB HIS B 51 26.845 45.624 30.213 1.00 45.43 C
+ATOM 1743 CG HIS B 51 28.003 46.586 30.211 1.00 42.00 C
+ATOM 1744 ND1 HIS B 51 27.873 47.901 29.822 1.00 44.83 N
+ATOM 1745 CD2 HIS B 51 29.306 46.420 30.541 1.00 35.54 C
+ATOM 1746 CE1 HIS B 51 29.046 48.502 29.908 1.00 40.55 C
+ATOM 1747 NE2 HIS B 51 29.932 47.629 30.344 1.00 43.91 N
+ATOM 1748 H HIS B 51 25.429 46.630 28.103 1.00 0.00 H
+ATOM 1749 HA HIS B 51 27.514 44.533 28.509 1.00 0.00 H
+ATOM 1750 1HB HIS B 51 25.952 46.163 30.545 1.00 0.00 H
+ATOM 1751 2HB HIS B 51 27.041 44.838 30.944 1.00 0.00 H
+ATOM 1752 HD2 HIS B 51 29.775 45.501 30.896 1.00 0.00 H
+ATOM 1753 HE1 HIS B 51 29.244 49.544 29.660 1.00 0.00 H
+ATOM 1754 HE2 HIS B 51 30.914 47.811 30.504 1.00 0.00 H
+ATOM 1755 N THR B 52 24.262 44.182 28.585 1.00 45.69 N
+ATOM 1756 CA THR B 52 23.192 43.163 28.675 1.00 45.80 C
+ATOM 1757 C THR B 52 22.734 42.690 27.292 1.00 46.38 C
+ATOM 1758 O THR B 52 22.183 43.469 26.510 1.00 42.34 O
+ATOM 1759 CB THR B 52 21.938 43.699 29.412 1.00 46.43 C
+ATOM 1760 OG1 THR B 52 22.277 44.090 30.748 1.00 43.19 O
+ATOM 1761 CG2 THR B 52 20.835 42.616 29.455 1.00 40.79 C
+ATOM 1762 H THR B 52 24.028 45.121 28.295 1.00 0.00 H
+ATOM 1763 HA THR B 52 23.574 42.300 29.217 1.00 0.00 H
+ATOM 1764 HB THR B 52 21.552 44.570 28.883 1.00 0.00 H
+ATOM 1765 HG1 THR B 52 22.743 44.937 30.718 1.00 0.00 H
+ATOM 1766 1HG2 THR B 52 19.956 43.007 29.971 1.00 0.00 H
+ATOM 1767 2HG2 THR B 52 20.558 42.332 28.440 1.00 0.00 H
+ATOM 1768 3HG2 THR B 52 21.204 41.742 29.986 1.00 0.00 H
+ATOM 1769 N SER B 53 22.921 41.393 27.018 1.00 43.15 N
+ATOM 1770 CA SER B 53 22.547 40.813 25.721 1.00 48.14 C
+ATOM 1771 C SER B 53 21.263 40.012 25.813 1.00 48.90 C
+ATOM 1772 O SER B 53 20.623 39.715 24.800 1.00 48.38 O
+ATOM 1773 CB SER B 53 23.642 39.921 25.194 1.00 42.51 C
+ATOM 1774 OG SER B 53 23.853 38.818 26.030 1.00 36.13 O
+ATOM 1775 H SER B 53 23.344 40.802 27.732 1.00 0.00 H
+ATOM 1776 HA SER B 53 22.387 41.624 25.011 1.00 0.00 H
+ATOM 1777 1HB SER B 53 23.370 39.577 24.198 1.00 0.00 H
+ATOM 1778 2HB SER B 53 24.544 40.489 25.103 1.00 0.00 H
+ATOM 1779 HG SER B 53 23.890 39.165 26.936 1.00 0.00 H
+ATOM 1780 N ALA B 54 20.889 39.655 27.035 1.00 44.60 N
+ATOM 1781 CA ALA B 54 19.672 38.880 27.205 1.00 45.74 C
+ATOM 1782 C ALA B 54 19.027 39.178 28.544 1.00 47.05 C
+ATOM 1783 O ALA B 54 19.696 39.524 29.521 1.00 45.69 O
+ATOM 1784 CB ALA B 54 19.958 37.393 27.048 1.00 35.57 C
+ATOM 1785 H ALA B 54 21.476 39.894 27.830 1.00 0.00 H
+ATOM 1786 HA ALA B 54 18.972 39.179 26.431 1.00 0.00 H
+ATOM 1787 1HB ALA B 54 19.028 36.839 27.146 1.00 0.00 H
+ATOM 1788 2HB ALA B 54 20.387 37.219 26.063 1.00 0.00 H
+ATOM 1789 3HB ALA B 54 20.645 37.056 27.784 1.00 0.00 H
+ATOM 1790 N ILE B 55 17.710 39.012 28.571 1.00 47.54 N
+ATOM 1791 CA ILE B 55 16.914 39.199 29.771 1.00 48.40 C
+ATOM 1792 C ILE B 55 16.178 37.918 30.141 1.00 49.36 C
+ATOM 1793 O ILE B 55 15.466 37.332 29.329 1.00 48.13 O
+ATOM 1794 CB ILE B 55 15.909 40.354 29.579 1.00 47.64 C
+ATOM 1795 CG1 ILE B 55 16.675 41.677 29.304 1.00 41.75 C
+ATOM 1796 CG2 ILE B 55 15.026 40.478 30.803 1.00 49.48 C
+ATOM 1797 CD1 ILE B 55 15.791 42.827 28.871 1.00 37.17 C
+ATOM 1798 H ILE B 55 17.250 38.721 27.717 1.00 0.00 H
+ATOM 1799 HA ILE B 55 17.577 39.459 30.589 1.00 0.00 H
+ATOM 1800 HB ILE B 55 15.286 40.153 28.711 1.00 0.00 H
+ATOM 1801 1HG1 ILE B 55 17.208 41.968 30.211 1.00 0.00 H
+ATOM 1802 2HG1 ILE B 55 17.402 41.505 28.521 1.00 0.00 H
+ATOM 1803 1HG2 ILE B 55 14.315 41.289 30.660 1.00 0.00 H
+ATOM 1804 2HG2 ILE B 55 14.484 39.546 30.961 1.00 0.00 H
+ATOM 1805 3HG2 ILE B 55 15.653 40.684 31.670 1.00 0.00 H
+ATOM 1806 1HD1 ILE B 55 16.402 43.716 28.692 1.00 0.00 H
+ATOM 1807 2HD1 ILE B 55 15.268 42.559 27.950 1.00 0.00 H
+ATOM 1808 3HD1 ILE B 55 15.066 43.042 29.653 1.00 0.00 H
+ATOM 1809 N LYS B 56 16.366 37.472 31.370 1.00 50.40 N
+ATOM 1810 CA LYS B 56 15.708 36.256 31.831 1.00 53.00 C
+ATOM 1811 C LYS B 56 14.695 36.601 32.904 1.00 56.12 C
+ATOM 1812 O LYS B 56 14.973 37.413 33.781 1.00 54.77 O
+ATOM 1813 CB LYS B 56 16.739 35.254 32.325 1.00 44.27 C
+ATOM 1814 CG LYS B 56 16.186 33.948 32.796 1.00 51.57 C
+ATOM 1815 CD LYS B 56 17.322 33.030 33.164 1.00 49.79 C
+ATOM 1816 CE LYS B 56 16.830 31.686 33.650 1.00 51.83 C
+ATOM 1817 NZ LYS B 56 17.954 30.740 33.837 1.00 48.80 N
+ATOM 1818 H LYS B 56 16.979 37.991 31.993 1.00 0.00 H
+ATOM 1819 HA LYS B 56 15.170 35.809 31.000 1.00 0.00 H
+ATOM 1820 1HB LYS B 56 17.430 35.032 31.518 1.00 0.00 H
+ATOM 1821 2HB LYS B 56 17.310 35.678 33.129 1.00 0.00 H
+ATOM 1822 1HG LYS B 56 15.536 34.097 33.664 1.00 0.00 H
+ATOM 1823 2HG LYS B 56 15.601 33.496 31.989 1.00 0.00 H
+ATOM 1824 1HD LYS B 56 17.970 32.877 32.293 1.00 0.00 H
+ATOM 1825 2HD LYS B 56 17.905 33.500 33.953 1.00 0.00 H
+ATOM 1826 1HE LYS B 56 16.310 31.811 34.599 1.00 0.00 H
+ATOM 1827 2HE LYS B 56 16.142 31.282 32.932 1.00 0.00 H
+ATOM 1828 1HZ LYS B 56 17.611 29.834 34.148 1.00 0.00 H
+ATOM 1829 2HZ LYS B 56 18.457 30.624 32.957 1.00 0.00 H
+ATOM 1830 3HZ LYS B 56 18.593 31.100 34.514 1.00 0.00 H
+ATOM 1831 N VAL B 57 13.498 36.035 32.812 1.00 58.42 N
+ATOM 1832 CA VAL B 57 12.483 36.376 33.792 1.00 58.41 C
+ATOM 1833 C VAL B 57 12.000 35.169 34.599 1.00 58.61 C
+ATOM 1834 O VAL B 57 11.604 34.132 34.048 1.00 60.18 O
+ATOM 1835 CB VAL B 57 11.294 37.060 33.092 1.00 55.01 C
+ATOM 1836 CG1 VAL B 57 10.224 37.445 34.128 1.00 48.61 C
+ATOM 1837 CG2 VAL B 57 11.799 38.273 32.327 1.00 53.24 C
+ATOM 1838 H VAL B 57 13.297 35.389 32.056 1.00 0.00 H
+ATOM 1839 HA VAL B 57 12.910 37.092 34.491 1.00 0.00 H
+ATOM 1840 HB VAL B 57 10.836 36.361 32.392 1.00 0.00 H
+ATOM 1841 1HG1 VAL B 57 9.388 37.919 33.629 1.00 0.00 H
+ATOM 1842 2HG1 VAL B 57 9.870 36.551 34.649 1.00 0.00 H
+ATOM 1843 3HG1 VAL B 57 10.650 38.139 34.854 1.00 0.00 H
+ATOM 1844 1HG2 VAL B 57 10.964 38.751 31.823 1.00 0.00 H
+ATOM 1845 2HG2 VAL B 57 12.259 38.966 33.028 1.00 0.00 H
+ATOM 1846 3HG2 VAL B 57 12.536 37.964 31.587 1.00 0.00 H
+ATOM 1847 N ARG B 58 12.048 35.339 35.927 1.00 58.62 N
+ATOM 1848 CA ARG B 58 11.601 34.359 36.918 1.00 58.47 C
+ATOM 1849 C ARG B 58 10.416 34.888 37.715 1.00 58.73 C
+ATOM 1850 O ARG B 58 10.317 36.086 37.992 1.00 59.49 O
+ATOM 1851 CB ARG B 58 12.717 33.997 37.884 1.00 57.46 C
+ATOM 1852 CG ARG B 58 13.809 33.132 37.329 1.00 64.89 C
+ATOM 1853 CD ARG B 58 14.858 32.877 38.352 1.00 76.16 C
+ATOM 1854 NE ARG B 58 15.818 31.882 37.913 1.00 86.50 N
+ATOM 1855 CZ ARG B 58 17.025 31.683 38.480 1.00 86.67 C
+ATOM 1856 NH1 ARG B 58 17.415 32.454 39.471 1.00 87.01 N
+ATOM 1857 NH2 ARG B 58 17.812 30.711 38.049 1.00 74.41 N
+ATOM 1858 H ARG B 58 12.423 36.221 36.272 1.00 0.00 H
+ATOM 1859 HA ARG B 58 11.289 33.453 36.398 1.00 0.00 H
+ATOM 1860 1HB ARG B 58 13.185 34.903 38.244 1.00 0.00 H
+ATOM 1861 2HB ARG B 58 12.295 33.479 38.754 1.00 0.00 H
+ATOM 1862 1HG ARG B 58 13.378 32.175 37.027 1.00 0.00 H
+ATOM 1863 2HG ARG B 58 14.270 33.617 36.468 1.00 0.00 H
+ATOM 1864 1HD ARG B 58 15.392 33.797 38.573 1.00 0.00 H
+ATOM 1865 2HD ARG B 58 14.379 32.511 39.263 1.00 0.00 H
+ATOM 1866 HE ARG B 58 15.525 31.260 37.148 1.00 0.00 H
+ATOM 1867 1HH1 ARG B 58 16.808 33.192 39.804 1.00 0.00 H
+ATOM 1868 2HH1 ARG B 58 18.314 32.306 39.904 1.00 0.00 H
+ATOM 1869 1HH2 ARG B 58 17.498 30.098 37.308 1.00 0.00 H
+ATOM 1870 2HH2 ARG B 58 18.712 30.560 38.482 1.00 0.00 H
+ATOM 1871 N GLY B 59 9.532 33.982 38.106 1.00 58.71 N
+ATOM 1872 CA GLY B 59 8.334 34.340 38.845 1.00 56.97 C
+ATOM 1873 C GLY B 59 7.266 34.643 37.818 1.00 57.35 C
+ATOM 1874 O GLY B 59 7.570 34.766 36.631 1.00 58.85 O
+ATOM 1875 H GLY B 59 9.658 33.003 37.882 1.00 0.00 H
+ATOM 1876 1HA GLY B 59 8.023 33.510 39.484 1.00 0.00 H
+ATOM 1877 2HA GLY B 59 8.514 35.204 39.480 1.00 0.00 H
+ATOM 1878 N LYS B 60 6.019 34.747 38.241 1.00 56.67 N
+ATOM 1879 CA LYS B 60 4.977 35.028 37.265 1.00 55.89 C
+ATOM 1880 C LYS B 60 5.032 36.485 36.823 1.00 55.27 C
+ATOM 1881 O LYS B 60 5.087 37.390 37.659 1.00 55.90 O
+ATOM 1882 CB LYS B 60 3.601 34.708 37.844 1.00 50.21 C
+ATOM 1883 CG LYS B 60 3.368 33.238 38.110 1.00 45.51 C
+ATOM 1884 CD LYS B 60 1.999 32.998 38.690 1.00 49.27 C
+ATOM 1885 CE LYS B 60 1.774 31.524 38.956 1.00 45.00 C
+ATOM 1886 NZ LYS B 60 0.434 31.266 39.543 1.00 45.00 N
+ATOM 1887 H LYS B 60 5.803 34.611 39.228 1.00 0.00 H
+ATOM 1888 HA LYS B 60 5.146 34.401 36.395 1.00 0.00 H
+ATOM 1889 1HB LYS B 60 3.455 35.248 38.775 1.00 0.00 H
+ATOM 1890 2HB LYS B 60 2.834 35.040 37.149 1.00 0.00 H
+ATOM 1891 1HG LYS B 60 3.453 32.682 37.182 1.00 0.00 H
+ATOM 1892 2HG LYS B 60 4.124 32.869 38.807 1.00 0.00 H
+ATOM 1893 1HD LYS B 60 1.911 33.548 39.633 1.00 0.00 H
+ATOM 1894 2HD LYS B 60 1.240 33.363 38.000 1.00 0.00 H
+ATOM 1895 1HE LYS B 60 1.863 30.976 38.018 1.00 0.00 H
+ATOM 1896 2HE LYS B 60 2.538 31.166 39.649 1.00 0.00 H
+ATOM 1897 1HZ LYS B 60 0.322 30.277 39.706 1.00 0.00 H
+ATOM 1898 2HZ LYS B 60 0.352 31.765 40.419 1.00 0.00 H
+ATOM 1899 3HZ LYS B 60 -0.281 31.586 38.905 1.00 0.00 H
+ATOM 1900 N ALA B 61 4.986 36.716 35.517 1.00 54.80 N
+ATOM 1901 CA ALA B 61 5.029 38.091 35.016 1.00 53.31 C
+ATOM 1902 C ALA B 61 4.397 38.216 33.635 1.00 53.65 C
+ATOM 1903 O ALA B 61 4.464 37.299 32.812 1.00 55.36 O
+ATOM 1904 CB ALA B 61 6.457 38.602 34.974 1.00 38.63 C
+ATOM 1905 H ALA B 61 4.935 35.918 34.885 1.00 0.00 H
+ATOM 1906 HA ALA B 61 4.482 38.716 35.709 1.00 0.00 H
+ATOM 1907 1HB ALA B 61 6.457 39.639 34.645 1.00 0.00 H
+ATOM 1908 2HB ALA B 61 6.879 38.532 35.963 1.00 0.00 H
+ATOM 1909 3HB ALA B 61 7.050 38.014 34.293 1.00 0.00 H
+ATOM 1910 N TYR B 62 3.840 39.392 33.366 1.00 52.84 N
+ATOM 1911 CA TYR B 62 3.256 39.706 32.066 1.00 52.44 C
+ATOM 1912 C TYR B 62 4.316 40.434 31.252 1.00 53.22 C
+ATOM 1913 O TYR B 62 4.849 41.449 31.703 1.00 51.46 O
+ATOM 1914 CB TYR B 62 2.018 40.576 32.264 1.00 49.73 C
+ATOM 1915 CG TYR B 62 1.252 40.940 31.031 1.00 47.95 C
+ATOM 1916 CD1 TYR B 62 0.377 40.041 30.456 1.00 45.76 C
+ATOM 1917 CD2 TYR B 62 1.420 42.182 30.481 1.00 51.06 C
+ATOM 1918 CE1 TYR B 62 -0.341 40.404 29.338 1.00 45.50 C
+ATOM 1919 CE2 TYR B 62 0.705 42.549 29.365 1.00 48.31 C
+ATOM 1920 CZ TYR B 62 -0.173 41.673 28.797 1.00 49.24 C
+ATOM 1921 OH TYR B 62 -0.896 42.051 27.691 1.00 52.40 O
+ATOM 1922 H TYR B 62 3.838 40.101 34.096 1.00 0.00 H
+ATOM 1923 HA TYR B 62 2.989 38.786 31.550 1.00 0.00 H
+ATOM 1924 1HB TYR B 62 1.336 40.067 32.937 1.00 0.00 H
+ATOM 1925 2HB TYR B 62 2.305 41.485 32.742 1.00 0.00 H
+ATOM 1926 HD1 TYR B 62 0.241 39.054 30.893 1.00 0.00 H
+ATOM 1927 HD2 TYR B 62 2.117 42.877 30.940 1.00 0.00 H
+ATOM 1928 HE1 TYR B 62 -1.042 39.698 28.890 1.00 0.00 H
+ATOM 1929 HE2 TYR B 62 0.833 43.535 28.941 1.00 0.00 H
+ATOM 1930 HH TYR B 62 -0.725 42.976 27.498 1.00 0.00 H
+ATOM 1931 N ILE B 63 4.665 39.901 30.083 1.00 52.41 N
+ATOM 1932 CA ILE B 63 5.760 40.481 29.320 1.00 51.57 C
+ATOM 1933 C ILE B 63 5.340 40.952 27.916 1.00 51.09 C
+ATOM 1934 O ILE B 63 4.686 40.230 27.157 1.00 51.02 O
+ATOM 1935 CB ILE B 63 6.885 39.444 29.189 1.00 49.30 C
+ATOM 1936 CG1 ILE B 63 7.344 38.974 30.568 1.00 37.36 C
+ATOM 1937 CG2 ILE B 63 8.055 40.049 28.447 1.00 36.83 C
+ATOM 1938 CD1 ILE B 63 8.252 37.774 30.512 1.00 34.70 C
+ATOM 1939 H ILE B 63 4.217 39.064 29.721 1.00 0.00 H
+ATOM 1940 HA ILE B 63 6.140 41.334 29.868 1.00 0.00 H
+ATOM 1941 HB ILE B 63 6.524 38.595 28.664 1.00 0.00 H
+ATOM 1942 1HG1 ILE B 63 7.850 39.775 31.061 1.00 0.00 H
+ATOM 1943 2HG1 ILE B 63 6.477 38.698 31.161 1.00 0.00 H
+ATOM 1944 1HG2 ILE B 63 8.830 39.308 28.361 1.00 0.00 H
+ATOM 1945 2HG2 ILE B 63 7.736 40.358 27.462 1.00 0.00 H
+ATOM 1946 3HG2 ILE B 63 8.431 40.915 28.991 1.00 0.00 H
+ATOM 1947 1HD1 ILE B 63 8.534 37.489 31.518 1.00 0.00 H
+ATOM 1948 2HD1 ILE B 63 7.729 36.943 30.033 1.00 0.00 H
+ATOM 1949 3HD1 ILE B 63 9.146 38.017 29.941 1.00 0.00 H
+ATOM 1950 N GLN B 64 5.712 42.186 27.571 1.00 51.25 N
+ATOM 1951 CA GLN B 64 5.407 42.725 26.245 1.00 50.78 C
+ATOM 1952 C GLN B 64 6.721 42.993 25.514 1.00 49.87 C
+ATOM 1953 O GLN B 64 7.607 43.680 26.039 1.00 49.47 O
+ATOM 1954 CB GLN B 64 4.600 44.025 26.354 1.00 46.36 C
+ATOM 1955 CG GLN B 64 3.284 43.884 27.106 1.00 41.46 C
+ATOM 1956 CD GLN B 64 2.595 45.220 27.392 1.00 45.11 C
+ATOM 1957 OE1 GLN B 64 3.187 46.101 28.012 1.00 52.94 O
+ATOM 1958 NE2 GLN B 64 1.349 45.357 26.960 1.00 35.56 N
+ATOM 1959 H GLN B 64 6.230 42.746 28.244 1.00 0.00 H
+ATOM 1960 HA GLN B 64 4.840 41.991 25.673 1.00 0.00 H
+ATOM 1961 1HB GLN B 64 5.182 44.798 26.780 1.00 0.00 H
+ATOM 1962 2HB GLN B 64 4.343 44.355 25.343 1.00 0.00 H
+ATOM 1963 1HG GLN B 64 2.606 43.277 26.524 1.00 0.00 H
+ATOM 1964 2HG GLN B 64 3.486 43.400 28.061 1.00 0.00 H
+ATOM 1965 1HE2 GLN B 64 0.830 46.215 27.155 1.00 0.00 H
+ATOM 1966 2HE2 GLN B 64 0.912 44.616 26.454 1.00 0.00 H
+ATOM 1967 N THR B 65 6.873 42.424 24.322 1.00 49.40 N
+ATOM 1968 CA THR B 65 8.107 42.622 23.566 1.00 44.79 C
+ATOM 1969 C THR B 65 7.781 43.004 22.134 1.00 45.54 C
+ATOM 1970 O THR B 65 6.625 43.040 21.718 1.00 46.02 O
+ATOM 1971 CB THR B 65 9.004 41.361 23.494 1.00 41.51 C
+ATOM 1972 OG1 THR B 65 8.425 40.411 22.591 1.00 42.56 O
+ATOM 1973 CG2 THR B 65 9.146 40.707 24.854 1.00 30.44 C
+ATOM 1974 H THR B 65 6.123 41.860 23.927 1.00 0.00 H
+ATOM 1975 HA THR B 65 8.676 43.439 24.008 1.00 0.00 H
+ATOM 1976 HB THR B 65 9.985 41.644 23.139 1.00 0.00 H
+ATOM 1977 HG1 THR B 65 8.035 40.884 21.853 1.00 0.00 H
+ATOM 1978 1HG2 THR B 65 9.784 39.829 24.765 1.00 0.00 H
+ATOM 1979 2HG2 THR B 65 9.588 41.409 25.558 1.00 0.00 H
+ATOM 1980 3HG2 THR B 65 8.165 40.407 25.206 1.00 0.00 H
+ATOM 1981 N ARG B 66 8.827 43.198 21.357 1.00 45.57 N
+ATOM 1982 CA ARG B 66 8.731 43.491 19.936 1.00 44.88 C
+ATOM 1983 C ARG B 66 7.996 42.408 19.152 1.00 42.37 C
+ATOM 1984 O ARG B 66 7.497 42.671 18.059 1.00 37.24 O
+ATOM 1985 CB ARG B 66 10.126 43.731 19.374 1.00 57.08 C
+ATOM 1986 CG ARG B 66 10.235 44.118 17.908 1.00 65.35 C
+ATOM 1987 CD ARG B 66 11.576 44.770 17.660 1.00 68.86 C
+ATOM 1988 NE ARG B 66 11.809 45.164 16.261 1.00 81.83 N
+ATOM 1989 CZ ARG B 66 12.635 44.522 15.400 1.00 82.73 C
+ATOM 1990 NH1 ARG B 66 13.324 43.488 15.803 1.00 80.14 N
+ATOM 1991 NH2 ARG B 66 12.777 44.961 14.158 1.00 83.95 N
+ATOM 1992 H ARG B 66 9.743 43.163 21.777 1.00 0.00 H
+ATOM 1993 HA ARG B 66 8.168 44.418 19.824 1.00 0.00 H
+ATOM 1994 1HB ARG B 66 10.644 44.487 19.966 1.00 0.00 H
+ATOM 1995 2HB ARG B 66 10.687 42.802 19.457 1.00 0.00 H
+ATOM 1996 1HG ARG B 66 10.165 43.220 17.290 1.00 0.00 H
+ATOM 1997 2HG ARG B 66 9.438 44.816 17.643 1.00 0.00 H
+ATOM 1998 1HD ARG B 66 11.649 45.665 18.271 1.00 0.00 H
+ATOM 1999 2HD ARG B 66 12.371 44.091 17.953 1.00 0.00 H
+ATOM 2000 HE ARG B 66 11.305 45.968 15.916 1.00 0.00 H
+ATOM 2001 1HH1 ARG B 66 13.241 43.171 16.760 1.00 0.00 H
+ATOM 2002 2HH1 ARG B 66 13.996 43.032 15.166 1.00 0.00 H
+ATOM 2003 1HH2 ARG B 66 12.259 45.768 13.850 1.00 0.00 H
+ATOM 2004 2HH2 ARG B 66 13.429 44.507 13.535 1.00 0.00 H
+ATOM 2005 N HIS B 67 7.946 41.178 19.685 1.00 42.79 N
+ATOM 2006 CA HIS B 67 7.316 40.097 18.948 1.00 45.84 C
+ATOM 2007 C HIS B 67 5.904 39.774 19.458 1.00 47.97 C
+ATOM 2008 O HIS B 67 5.327 38.755 19.071 1.00 49.04 O
+ATOM 2009 CB HIS B 67 8.175 38.838 19.027 1.00 38.96 C
+ATOM 2010 CG HIS B 67 9.551 39.060 18.521 1.00 38.65 C
+ATOM 2011 ND1 HIS B 67 9.824 39.828 17.408 1.00 38.30 N
+ATOM 2012 CD2 HIS B 67 10.736 38.596 18.955 1.00 37.02 C
+ATOM 2013 CE1 HIS B 67 11.125 39.846 17.210 1.00 40.31 C
+ATOM 2014 NE2 HIS B 67 11.690 39.099 18.129 1.00 38.64 N
+ATOM 2015 H HIS B 67 8.326 40.989 20.610 1.00 0.00 H
+ATOM 2016 HA HIS B 67 7.228 40.378 17.898 1.00 0.00 H
+ATOM 2017 1HB HIS B 67 8.237 38.498 20.066 1.00 0.00 H
+ATOM 2018 2HB HIS B 67 7.722 38.041 18.441 1.00 0.00 H
+ATOM 2019 HD2 HIS B 67 10.906 37.944 19.798 1.00 0.00 H
+ATOM 2020 HE1 HIS B 67 11.645 40.376 16.411 1.00 0.00 H
+ATOM 2021 HE2 HIS B 67 12.678 38.907 18.222 1.00 0.00 H
+ATOM 2022 N GLY B 68 5.342 40.627 20.325 1.00 48.01 N
+ATOM 2023 CA GLY B 68 4.001 40.362 20.848 1.00 48.18 C
+ATOM 2024 C GLY B 68 3.964 40.248 22.372 1.00 49.51 C
+ATOM 2025 O GLY B 68 4.745 40.877 23.086 1.00 49.53 O
+ATOM 2026 H GLY B 68 5.836 41.466 20.624 1.00 0.00 H
+ATOM 2027 1HA GLY B 68 3.337 41.168 20.534 1.00 0.00 H
+ATOM 2028 2HA GLY B 68 3.609 39.446 20.407 1.00 0.00 H
+ATOM 2029 N VAL B 69 2.995 39.488 22.872 1.00 49.56 N
+ATOM 2030 CA VAL B 69 2.802 39.352 24.315 1.00 49.87 C
+ATOM 2031 C VAL B 69 2.990 37.912 24.764 1.00 50.31 C
+ATOM 2032 O VAL B 69 2.510 36.978 24.112 1.00 48.49 O
+ATOM 2033 CB VAL B 69 1.410 39.857 24.725 1.00 48.13 C
+ATOM 2034 CG1 VAL B 69 1.208 39.673 26.220 1.00 52.98 C
+ATOM 2035 CG2 VAL B 69 1.282 41.321 24.348 1.00 45.45 C
+ATOM 2036 H VAL B 69 2.381 38.992 22.243 1.00 0.00 H
+ATOM 2037 HA VAL B 69 3.548 39.963 24.826 1.00 0.00 H
+ATOM 2038 HB VAL B 69 0.645 39.275 24.214 1.00 0.00 H
+ATOM 2039 1HG1 VAL B 69 0.220 40.028 26.480 1.00 0.00 H
+ATOM 2040 2HG1 VAL B 69 1.289 38.623 26.486 1.00 0.00 H
+ATOM 2041 3HG1 VAL B 69 1.962 40.246 26.764 1.00 0.00 H
+ATOM 2042 1HG2 VAL B 69 0.296 41.687 24.638 1.00 0.00 H
+ATOM 2043 2HG2 VAL B 69 2.046 41.886 24.864 1.00 0.00 H
+ATOM 2044 3HG2 VAL B 69 1.409 41.438 23.276 1.00 0.00 H
+ATOM 2045 N ILE B 70 3.722 37.736 25.859 1.00 49.16 N
+ATOM 2046 CA ILE B 70 4.006 36.417 26.397 1.00 48.44 C
+ATOM 2047 C ILE B 70 3.972 36.502 27.917 1.00 48.84 C
+ATOM 2048 O ILE B 70 4.283 37.546 28.484 1.00 47.75 O
+ATOM 2049 CB ILE B 70 5.396 35.927 25.925 1.00 36.30 C
+ATOM 2050 CG1 ILE B 70 5.586 34.448 26.214 1.00 37.71 C
+ATOM 2051 CG2 ILE B 70 6.484 36.714 26.638 1.00 48.43 C
+ATOM 2052 CD1 ILE B 70 6.768 33.880 25.485 1.00 36.58 C
+ATOM 2053 H ILE B 70 4.085 38.558 26.341 1.00 0.00 H
+ATOM 2054 HA ILE B 70 3.240 35.717 26.065 1.00 0.00 H
+ATOM 2055 HB ILE B 70 5.487 36.070 24.848 1.00 0.00 H
+ATOM 2056 1HG1 ILE B 70 5.730 34.288 27.284 1.00 0.00 H
+ATOM 2057 2HG1 ILE B 70 4.692 33.909 25.895 1.00 0.00 H
+ATOM 2058 1HG2 ILE B 70 7.457 36.383 26.311 1.00 0.00 H
+ATOM 2059 2HG2 ILE B 70 6.365 37.775 26.412 1.00 0.00 H
+ATOM 2060 3HG2 ILE B 70 6.390 36.546 27.711 1.00 0.00 H
+ATOM 2061 1HD1 ILE B 70 6.850 32.836 25.696 1.00 0.00 H
+ATOM 2062 2HD1 ILE B 70 6.639 34.020 24.411 1.00 0.00 H
+ATOM 2063 3HD1 ILE B 70 7.662 34.391 25.812 1.00 0.00 H
+ATOM 2064 N GLU B 71 3.562 35.437 28.580 1.00 46.28 N
+ATOM 2065 CA GLU B 71 3.595 35.462 30.034 1.00 45.11 C
+ATOM 2066 C GLU B 71 4.587 34.442 30.549 1.00 43.92 C
+ATOM 2067 O GLU B 71 4.701 33.343 29.994 1.00 42.85 O
+ATOM 2068 CB GLU B 71 2.208 35.188 30.621 1.00 55.17 C
+ATOM 2069 CG GLU B 71 1.161 36.238 30.282 1.00 61.70 C
+ATOM 2070 CD GLU B 71 -0.178 35.968 30.928 1.00 67.98 C
+ATOM 2071 OE1 GLU B 71 -0.310 34.967 31.591 1.00 58.93 O
+ATOM 2072 OE2 GLU B 71 -1.068 36.768 30.756 1.00 71.81 O
+ATOM 2073 H GLU B 71 3.274 34.606 28.082 1.00 0.00 H
+ATOM 2074 HA GLU B 71 3.926 36.447 30.369 1.00 0.00 H
+ATOM 2075 1HB GLU B 71 1.847 34.223 30.267 1.00 0.00 H
+ATOM 2076 2HB GLU B 71 2.283 35.131 31.709 1.00 0.00 H
+ATOM 2077 1HG GLU B 71 1.529 37.200 30.613 1.00 0.00 H
+ATOM 2078 2HG GLU B 71 1.033 36.278 29.202 1.00 0.00 H
+ATOM 2079 N SER B 72 5.285 34.803 31.618 1.00 42.77 N
+ATOM 2080 CA SER B 72 6.219 33.904 32.273 1.00 45.59 C
+ATOM 2081 C SER B 72 5.543 33.279 33.473 1.00 46.58 C
+ATOM 2082 O SER B 72 4.712 33.919 34.127 1.00 45.54 O
+ATOM 2083 CB SER B 72 7.463 34.668 32.668 1.00 40.36 C
+ATOM 2084 OG SER B 72 7.137 35.723 33.502 1.00 41.30 O
+ATOM 2085 H SER B 72 5.127 35.729 32.010 1.00 0.00 H
+ATOM 2086 HA SER B 72 6.494 33.105 31.583 1.00 0.00 H
+ATOM 2087 1HB SER B 72 8.167 33.999 33.173 1.00 0.00 H
+ATOM 2088 2HB SER B 72 7.953 35.050 31.788 1.00 0.00 H
+ATOM 2089 HG SER B 72 6.465 36.231 33.021 1.00 0.00 H
+ATOM 2090 N GLU B 73 5.896 32.027 33.750 1.00 48.58 N
+ATOM 2091 CA GLU B 73 5.333 31.262 34.856 1.00 52.70 C
+ATOM 2092 C GLU B 73 6.389 30.537 35.687 1.00 54.29 C
+ATOM 2093 O GLU B 73 6.061 29.626 36.446 1.00 54.46 O
+ATOM 2094 CB GLU B 73 4.321 30.248 34.311 1.00 52.94 C
+ATOM 2095 CG GLU B 73 3.086 30.874 33.628 1.00 53.03 C
+ATOM 2096 CD GLU B 73 2.121 29.859 33.063 1.00 58.58 C
+ATOM 2097 OE1 GLU B 73 1.008 29.803 33.531 1.00 69.91 O
+ATOM 2098 OE2 GLU B 73 2.482 29.180 32.111 1.00 65.29 O
+ATOM 2099 H GLU B 73 6.614 31.592 33.175 1.00 0.00 H
+ATOM 2100 HA GLU B 73 4.816 31.955 35.515 1.00 0.00 H
+ATOM 2101 1HB GLU B 73 4.813 29.605 33.582 1.00 0.00 H
+ATOM 2102 2HB GLU B 73 3.973 29.612 35.124 1.00 0.00 H
+ATOM 2103 1HG GLU B 73 2.561 31.502 34.351 1.00 0.00 H
+ATOM 2104 2HG GLU B 73 3.424 31.516 32.817 1.00 0.00 H
+ATOM 2105 N GLY B 74 7.654 30.899 35.512 1.00 56.06 N
+ATOM 2106 CA GLY B 74 8.735 30.179 36.180 1.00 60.26 C
+ATOM 2107 C GLY B 74 8.586 30.262 37.684 1.00 63.39 C
+ATOM 2108 O GLY B 74 8.174 31.291 38.211 1.00 64.27 O
+ATOM 2109 H GLY B 74 7.867 31.666 34.889 1.00 0.00 H
+ATOM 2110 1HA GLY B 74 8.729 29.134 35.864 1.00 0.00 H
+ATOM 2111 2HA GLY B 74 9.693 30.600 35.876 1.00 0.00 H
+ATOM 2112 N LYS B 75 8.969 29.197 38.381 1.00 66.55 N
+ATOM 2113 CA LYS B 75 8.851 29.158 39.833 1.00 70.43 C
+ATOM 2114 C LYS B 75 9.951 29.938 40.532 1.00 74.20 C
+ATOM 2115 O LYS B 75 11.101 29.915 40.096 1.00 75.05 O
+ATOM 2116 CB LYS B 75 8.906 27.715 40.334 1.00 66.09 C
+ATOM 2117 CG LYS B 75 7.740 26.838 39.904 1.00 69.42 C
+ATOM 2118 CD LYS B 75 7.875 25.430 40.477 1.00 15.00 C
+ATOM 2119 CE LYS B 75 6.729 24.530 40.042 1.00 15.00 C
+ATOM 2120 NZ LYS B 75 6.916 23.130 40.517 1.00 15.00 N
+ATOM 2121 H LYS B 75 9.318 28.387 37.888 1.00 0.00 H
+ATOM 2122 HA LYS B 75 7.895 29.596 40.115 1.00 0.00 H
+ATOM 2123 1HB LYS B 75 9.831 27.250 39.990 1.00 0.00 H
+ATOM 2124 2HB LYS B 75 8.935 27.723 41.422 1.00 0.00 H
+ATOM 2125 1HG LYS B 75 6.800 27.288 40.243 1.00 0.00 H
+ATOM 2126 2HG LYS B 75 7.718 26.780 38.814 1.00 0.00 H
+ATOM 2127 1HD LYS B 75 8.814 24.986 40.137 1.00 0.00 H
+ATOM 2128 2HD LYS B 75 7.894 25.487 41.567 1.00 0.00 H
+ATOM 2129 1HE LYS B 75 5.796 24.919 40.450 1.00 0.00 H
+ATOM 2130 2HE LYS B 75 6.668 24.528 38.955 1.00 0.00 H
+ATOM 2131 1HZ LYS B 75 6.139 22.559 40.211 1.00 0.00 H
+ATOM 2132 2HZ LYS B 75 7.776 22.761 40.133 1.00 0.00 H
+ATOM 2133 3HZ LYS B 75 6.964 23.119 41.526 1.00 0.00 H
+ATOM 2134 N LYS B 76 9.583 30.546 41.660 1.00 78.02 N
+ATOM 2135 CA LYS B 76 10.504 31.230 42.559 1.00 81.92 C
+ATOM 2136 C LYS B 76 11.450 32.186 41.838 1.00 85.15 C
+ATOM 2137 O LYS B 76 10.990 33.111 41.170 1.00 87.28 O
+ATOM 2138 OXT LYS B 76 12.617 32.246 42.226 1.00 98.40 O
+ATOM 2139 CB LYS B 76 11.288 30.193 43.368 1.00 77.13 C
+ATOM 2140 CG LYS B 76 10.410 29.395 44.341 1.00 83.33 C
+ATOM 2141 CD LYS B 76 11.206 28.373 45.143 1.00 85.83 C
+ATOM 2142 CE LYS B 76 10.286 27.585 46.079 1.00 80.64 C
+ATOM 2143 NZ LYS B 76 11.015 26.520 46.829 1.00 88.34 N
+ATOM 2144 H LYS B 76 8.604 30.526 41.908 1.00 0.00 H
+ATOM 2145 HA LYS B 76 9.913 31.825 43.255 1.00 0.00 H
+ATOM 2146 1HB LYS B 76 11.778 29.488 42.691 1.00 0.00 H
+ATOM 2147 2HB LYS B 76 12.068 30.690 43.945 1.00 0.00 H
+ATOM 2148 1HG LYS B 76 9.917 30.081 45.030 1.00 0.00 H
+ATOM 2149 2HG LYS B 76 9.642 28.868 43.777 1.00 0.00 H
+ATOM 2150 1HD LYS B 76 11.706 27.681 44.466 1.00 0.00 H
+ATOM 2151 2HD LYS B 76 11.964 28.887 45.738 1.00 0.00 H
+ATOM 2152 1HE LYS B 76 9.835 28.272 46.795 1.00 0.00 H
+ATOM 2153 2HE LYS B 76 9.497 27.121 45.489 1.00 0.00 H
+ATOM 2154 1HZ LYS B 76 10.367 26.027 47.429 1.00 0.00 H
+ATOM 2155 2HZ LYS B 76 11.427 25.869 46.175 1.00 0.00 H
+ATOM 2156 3HZ LYS B 76 11.743 26.936 47.392 1.00 0.00 H
+TER
+ATOM 2158 N SER C 7 19.279 45.527 17.086 1.00 58.42 N
+ATOM 2159 CA SER C 7 19.625 44.165 16.715 1.00 58.32 C
+ATOM 2160 C SER C 7 18.555 43.182 17.184 1.00 55.18 C
+ATOM 2161 O SER C 7 18.086 43.235 18.328 1.00 60.56 O
+ATOM 2162 CB SER C 7 20.970 43.785 17.287 1.00 60.56 C
+ATOM 2163 OG SER C 7 21.269 42.455 16.995 1.00 57.68 O
+ATOM 2164 1H SER C 7 19.930 46.167 16.654 1.00 0.00 H
+ATOM 2165 2H SER C 7 18.343 45.724 16.764 1.00 0.00 H
+ATOM 2166 3H SER C 7 19.322 45.627 18.088 1.00 0.00 H
+ATOM 2167 HA SER C 7 19.684 44.107 15.627 1.00 0.00 H
+ATOM 2168 1HB SER C 7 21.741 44.437 16.878 1.00 0.00 H
+ATOM 2169 2HB SER C 7 20.959 43.926 18.364 1.00 0.00 H
+ATOM 2170 HG SER C 7 20.550 41.932 17.373 1.00 0.00 H
+ATOM 2171 N ASP C 8 18.184 42.275 16.283 1.00 50.37 N
+ATOM 2172 CA ASP C 8 17.136 41.291 16.537 1.00 46.89 C
+ATOM 2173 C ASP C 8 17.421 40.354 17.699 1.00 43.99 C
+ATOM 2174 O ASP C 8 18.579 40.018 17.990 1.00 44.55 O
+ATOM 2175 CB ASP C 8 16.843 40.457 15.286 1.00 49.33 C
+ATOM 2176 CG ASP C 8 16.091 41.242 14.215 1.00 55.45 C
+ATOM 2177 OD1 ASP C 8 15.687 42.344 14.499 1.00 54.92 O
+ATOM 2178 OD2 ASP C 8 15.908 40.735 13.141 1.00 60.11 O
+ATOM 2179 H ASP C 8 18.628 42.275 15.375 1.00 0.00 H
+ATOM 2180 HA ASP C 8 16.227 41.842 16.781 1.00 0.00 H
+ATOM 2181 1HB ASP C 8 17.781 40.097 14.862 1.00 0.00 H
+ATOM 2182 2HB ASP C 8 16.253 39.579 15.564 1.00 0.00 H
+ATOM 2183 N PHE C 9 16.320 39.921 18.311 1.00 40.66 N
+ATOM 2184 CA PHE C 9 16.293 38.984 19.424 1.00 40.39 C
+ATOM 2185 C PHE C 9 15.131 38.035 19.280 1.00 41.37 C
+ATOM 2186 O PHE C 9 14.233 38.274 18.469 1.00 41.28 O
+ATOM 2187 CB PHE C 9 16.132 39.710 20.770 1.00 35.25 C
+ATOM 2188 CG PHE C 9 14.846 40.440 20.961 1.00 34.05 C
+ATOM 2189 CD1 PHE C 9 13.763 39.803 21.545 1.00 32.04 C
+ATOM 2190 CD2 PHE C 9 14.711 41.764 20.596 1.00 32.60 C
+ATOM 2191 CE1 PHE C 9 12.575 40.468 21.759 1.00 33.79 C
+ATOM 2192 CE2 PHE C 9 13.521 42.427 20.810 1.00 38.78 C
+ATOM 2193 CZ PHE C 9 12.458 41.775 21.395 1.00 39.23 C
+ATOM 2194 H PHE C 9 15.435 40.281 17.984 1.00 0.00 H
+ATOM 2195 HA PHE C 9 17.205 38.395 19.412 1.00 0.00 H
+ATOM 2196 1HB PHE C 9 16.193 38.994 21.567 1.00 0.00 H
+ATOM 2197 2HB PHE C 9 16.923 40.398 20.908 1.00 0.00 H
+ATOM 2198 HD1 PHE C 9 13.863 38.760 21.838 1.00 0.00 H
+ATOM 2199 HD2 PHE C 9 15.555 42.292 20.136 1.00 0.00 H
+ATOM 2200 HE1 PHE C 9 11.737 39.953 22.219 1.00 0.00 H
+ATOM 2201 HE2 PHE C 9 13.424 43.473 20.515 1.00 0.00 H
+ATOM 2202 HZ PHE C 9 11.535 42.301 21.561 1.00 0.00 H
+ATOM 2203 N VAL C 10 15.155 36.966 20.062 1.00 41.26 N
+ATOM 2204 CA VAL C 10 14.064 35.999 20.078 1.00 44.07 C
+ATOM 2205 C VAL C 10 13.551 35.834 21.505 1.00 45.18 C
+ATOM 2206 O VAL C 10 14.265 36.130 22.466 1.00 44.53 O
+ATOM 2207 CB VAL C 10 14.556 34.640 19.537 1.00 39.94 C
+ATOM 2208 CG1 VAL C 10 15.077 34.808 18.099 1.00 38.44 C
+ATOM 2209 CG2 VAL C 10 15.646 34.090 20.455 1.00 39.53 C
+ATOM 2210 H VAL C 10 15.965 36.836 20.668 1.00 0.00 H
+ATOM 2211 HA VAL C 10 13.250 36.365 19.449 1.00 0.00 H
+ATOM 2212 HB VAL C 10 13.716 33.938 19.507 1.00 0.00 H
+ATOM 2213 1HG1 VAL C 10 15.414 33.856 17.723 1.00 0.00 H
+ATOM 2214 2HG1 VAL C 10 14.280 35.192 17.466 1.00 0.00 H
+ATOM 2215 3HG1 VAL C 10 15.910 35.502 18.095 1.00 0.00 H
+ATOM 2216 1HG2 VAL C 10 15.988 33.124 20.080 1.00 0.00 H
+ATOM 2217 2HG2 VAL C 10 16.485 34.788 20.484 1.00 0.00 H
+ATOM 2218 3HG2 VAL C 10 15.242 33.966 21.463 1.00 0.00 H
+ATOM 2219 N VAL C 11 12.319 35.345 21.651 1.00 44.07 N
+ATOM 2220 CA VAL C 11 11.760 35.105 22.984 1.00 44.00 C
+ATOM 2221 C VAL C 11 11.475 33.624 23.158 1.00 46.00 C
+ATOM 2222 O VAL C 11 10.767 33.033 22.350 1.00 46.32 O
+ATOM 2223 CB VAL C 11 10.438 35.865 23.194 1.00 44.65 C
+ATOM 2224 CG1 VAL C 11 9.913 35.594 24.565 1.00 45.73 C
+ATOM 2225 CG2 VAL C 11 10.619 37.341 22.957 1.00 23.86 C
+ATOM 2226 H VAL C 11 11.773 35.130 20.820 1.00 0.00 H
+ATOM 2227 HA VAL C 11 12.478 35.416 23.740 1.00 0.00 H
+ATOM 2228 HB VAL C 11 9.714 35.482 22.519 1.00 0.00 H
+ATOM 2229 1HG1 VAL C 11 8.968 36.113 24.673 1.00 0.00 H
+ATOM 2230 2HG1 VAL C 11 9.764 34.524 24.692 1.00 0.00 H
+ATOM 2231 3HG1 VAL C 11 10.612 35.946 25.306 1.00 0.00 H
+ATOM 2232 1HG2 VAL C 11 9.660 37.849 23.096 1.00 0.00 H
+ATOM 2233 2HG2 VAL C 11 11.329 37.732 23.647 1.00 0.00 H
+ATOM 2234 3HG2 VAL C 11 10.968 37.505 21.953 1.00 0.00 H
+ATOM 2235 N ILE C 12 12.036 33.017 24.195 1.00 47.69 N
+ATOM 2236 CA ILE C 12 11.846 31.588 24.407 1.00 44.45 C
+ATOM 2237 C ILE C 12 11.231 31.272 25.778 1.00 43.61 C
+ATOM 2238 O ILE C 12 11.774 31.653 26.815 1.00 46.70 O
+ATOM 2239 CB ILE C 12 13.206 30.879 24.290 1.00 42.87 C
+ATOM 2240 CG1 ILE C 12 13.817 31.153 22.902 1.00 45.82 C
+ATOM 2241 CG2 ILE C 12 13.009 29.368 24.486 1.00 33.94 C
+ATOM 2242 CD1 ILE C 12 15.238 30.769 22.803 1.00 45.71 C
+ATOM 2243 H ILE C 12 12.621 33.548 24.828 1.00 0.00 H
+ATOM 2244 HA ILE C 12 11.183 31.203 23.639 1.00 0.00 H
+ATOM 2245 HB ILE C 12 13.894 31.268 25.043 1.00 0.00 H
+ATOM 2246 1HG1 ILE C 12 13.262 30.599 22.166 1.00 0.00 H
+ATOM 2247 2HG1 ILE C 12 13.746 32.210 22.668 1.00 0.00 H
+ATOM 2248 1HG2 ILE C 12 13.960 28.859 24.398 1.00 0.00 H
+ATOM 2249 2HG2 ILE C 12 12.588 29.182 25.474 1.00 0.00 H
+ATOM 2250 3HG2 ILE C 12 12.325 28.993 23.725 1.00 0.00 H
+ATOM 2251 1HD1 ILE C 12 15.608 30.977 21.798 1.00 0.00 H
+ATOM 2252 2HD1 ILE C 12 15.814 31.344 23.529 1.00 0.00 H
+ATOM 2253 3HD1 ILE C 12 15.332 29.725 23.019 1.00 0.00 H
+ATOM 2254 N LYS C 13 10.106 30.548 25.775 1.00 41.88 N
+ATOM 2255 CA LYS C 13 9.460 30.145 27.028 1.00 40.42 C
+ATOM 2256 C LYS C 13 9.482 28.649 27.247 1.00 41.46 C
+ATOM 2257 O LYS C 13 8.976 27.866 26.447 1.00 37.14 O
+ATOM 2258 CB LYS C 13 8.009 30.580 27.088 1.00 45.43 C
+ATOM 2259 CG LYS C 13 7.310 30.106 28.359 1.00 46.77 C
+ATOM 2260 CD LYS C 13 5.860 30.499 28.394 1.00 49.39 C
+ATOM 2261 CE LYS C 13 5.188 29.924 29.643 1.00 44.39 C
+ATOM 2262 NZ LYS C 13 3.731 30.191 29.674 1.00 43.47 N
+ATOM 2263 H LYS C 13 9.691 30.285 24.889 1.00 0.00 H
+ATOM 2264 HA LYS C 13 9.991 30.605 27.852 1.00 0.00 H
+ATOM 2265 1HB LYS C 13 7.970 31.647 27.082 1.00 0.00 H
+ATOM 2266 2HB LYS C 13 7.472 30.216 26.232 1.00 0.00 H
+ATOM 2267 1HG LYS C 13 7.361 29.017 28.404 1.00 0.00 H
+ATOM 2268 2HG LYS C 13 7.821 30.508 29.239 1.00 0.00 H
+ATOM 2269 1HD LYS C 13 5.777 31.589 28.408 1.00 0.00 H
+ATOM 2270 2HD LYS C 13 5.358 30.119 27.505 1.00 0.00 H
+ATOM 2271 1HE LYS C 13 5.353 28.847 29.673 1.00 0.00 H
+ATOM 2272 2HE LYS C 13 5.640 30.377 30.528 1.00 0.00 H
+ATOM 2273 1HZ LYS C 13 3.316 29.792 30.531 1.00 0.00 H
+ATOM 2274 2HZ LYS C 13 3.581 31.196 29.667 1.00 0.00 H
+ATOM 2275 3HZ LYS C 13 3.288 29.777 28.873 1.00 0.00 H
+ATOM 2276 N ALA C 14 10.077 28.238 28.355 1.00 43.40 N
+ATOM 2277 CA ALA C 14 10.148 26.813 28.612 1.00 45.94 C
+ATOM 2278 C ALA C 14 8.757 26.239 28.836 1.00 46.78 C
+ATOM 2279 O ALA C 14 8.005 26.727 29.681 1.00 43.40 O
+ATOM 2280 CB ALA C 14 10.994 26.558 29.832 1.00 45.78 C
+ATOM 2281 H ALA C 14 10.465 28.916 29.011 1.00 0.00 H
+ATOM 2282 HA ALA C 14 10.583 26.331 27.743 1.00 0.00 H
+ATOM 2283 1HB ALA C 14 11.061 25.489 30.033 1.00 0.00 H
+ATOM 2284 2HB ALA C 14 11.975 26.950 29.669 1.00 0.00 H
+ATOM 2285 3HB ALA C 14 10.533 27.061 30.662 1.00 0.00 H
+ATOM 2286 N LEU C 15 8.432 25.153 28.141 1.00 49.40 N
+ATOM 2287 CA LEU C 15 7.135 24.523 28.366 1.00 50.58 C
+ATOM 2288 C LEU C 15 7.286 23.272 29.230 1.00 51.75 C
+ATOM 2289 O LEU C 15 6.301 22.641 29.621 1.00 53.80 O
+ATOM 2290 CB LEU C 15 6.463 24.252 27.024 1.00 40.08 C
+ATOM 2291 CG LEU C 15 6.170 25.544 26.199 1.00 51.27 C
+ATOM 2292 CD1 LEU C 15 5.591 25.174 24.852 1.00 38.99 C
+ATOM 2293 CD2 LEU C 15 5.235 26.441 26.971 1.00 37.44 C
+ATOM 2294 H LEU C 15 9.060 24.765 27.437 1.00 0.00 H
+ATOM 2295 HA LEU C 15 6.501 25.220 28.908 1.00 0.00 H
+ATOM 2296 1HB LEU C 15 7.119 23.619 26.437 1.00 0.00 H
+ATOM 2297 2HB LEU C 15 5.526 23.728 27.194 1.00 0.00 H
+ATOM 2298 HG LEU C 15 7.075 26.081 26.045 1.00 0.00 H
+ATOM 2299 1HD1 LEU C 15 5.399 26.066 24.275 1.00 0.00 H
+ATOM 2300 2HD1 LEU C 15 6.295 24.557 24.312 1.00 0.00 H
+ATOM 2301 3HD1 LEU C 15 4.662 24.634 24.994 1.00 0.00 H
+ATOM 2302 1HD2 LEU C 15 5.049 27.351 26.398 1.00 0.00 H
+ATOM 2303 2HD2 LEU C 15 4.294 25.924 27.149 1.00 0.00 H
+ATOM 2304 3HD2 LEU C 15 5.695 26.704 27.925 1.00 0.00 H
+ATOM 2305 N GLU C 16 8.534 22.957 29.558 1.00 51.59 N
+ATOM 2306 CA GLU C 16 8.884 21.820 30.404 1.00 53.98 C
+ATOM 2307 C GLU C 16 10.195 22.096 31.140 1.00 56.05 C
+ATOM 2308 O GLU C 16 10.934 23.007 30.786 1.00 56.98 O
+ATOM 2309 CB GLU C 16 8.975 20.518 29.593 1.00 54.23 C
+ATOM 2310 CG GLU C 16 10.047 20.472 28.511 1.00 57.42 C
+ATOM 2311 CD GLU C 16 10.023 19.153 27.748 1.00 61.17 C
+ATOM 2312 OE1 GLU C 16 9.270 18.287 28.120 1.00 56.39 O
+ATOM 2313 OE2 GLU C 16 10.724 19.032 26.767 1.00 65.66 O
+ATOM 2314 H GLU C 16 9.276 23.534 29.191 1.00 0.00 H
+ATOM 2315 HA GLU C 16 8.102 21.693 31.152 1.00 0.00 H
+ATOM 2316 1HB GLU C 16 9.163 19.686 30.272 1.00 0.00 H
+ATOM 2317 2HB GLU C 16 8.019 20.330 29.105 1.00 0.00 H
+ATOM 2318 1HG GLU C 16 9.906 21.304 27.823 1.00 0.00 H
+ATOM 2319 2HG GLU C 16 11.023 20.591 28.986 1.00 0.00 H
+ATOM 2320 N ASP C 17 10.462 21.348 32.198 1.00 55.42 N
+ATOM 2321 CA ASP C 17 11.726 21.515 32.911 1.00 54.19 C
+ATOM 2322 C ASP C 17 12.920 21.127 32.045 1.00 53.08 C
+ATOM 2323 O ASP C 17 12.826 20.200 31.241 1.00 49.84 O
+ATOM 2324 CB ASP C 17 11.722 20.725 34.213 1.00 52.70 C
+ATOM 2325 CG ASP C 17 10.805 21.353 35.244 1.00 60.97 C
+ATOM 2326 OD1 ASP C 17 10.371 22.473 35.022 1.00 55.20 O
+ATOM 2327 OD2 ASP C 17 10.535 20.725 36.239 1.00 66.77 O
+ATOM 2328 H ASP C 17 9.812 20.629 32.482 1.00 0.00 H
+ATOM 2329 HA ASP C 17 11.832 22.557 33.167 1.00 0.00 H
+ATOM 2330 1HB ASP C 17 11.407 19.701 34.025 1.00 0.00 H
+ATOM 2331 2HB ASP C 17 12.737 20.695 34.621 1.00 0.00 H
+ATOM 2332 N GLY C 18 14.053 21.808 32.232 1.00 53.62 N
+ATOM 2333 CA GLY C 18 15.274 21.448 31.513 1.00 53.84 C
+ATOM 2334 C GLY C 18 15.417 21.967 30.071 1.00 53.51 C
+ATOM 2335 O GLY C 18 16.237 21.437 29.317 1.00 54.32 O
+ATOM 2336 H GLY C 18 14.096 22.567 32.922 1.00 0.00 H
+ATOM 2337 1HA GLY C 18 16.121 21.807 32.090 1.00 0.00 H
+ATOM 2338 2HA GLY C 18 15.357 20.363 31.503 1.00 0.00 H
+ATOM 2339 N VAL C 19 14.634 22.965 29.665 1.00 52.20 N
+ATOM 2340 CA VAL C 19 14.763 23.492 28.304 1.00 51.18 C
+ATOM 2341 C VAL C 19 16.133 24.115 28.152 1.00 51.08 C
+ATOM 2342 O VAL C 19 16.598 24.838 29.028 1.00 49.12 O
+ATOM 2343 CB VAL C 19 13.637 24.480 27.979 1.00 45.05 C
+ATOM 2344 CG1 VAL C 19 13.890 25.200 26.653 1.00 37.47 C
+ATOM 2345 CG2 VAL C 19 12.353 23.693 27.868 1.00 36.58 C
+ATOM 2346 H VAL C 19 13.983 23.404 30.312 1.00 0.00 H
+ATOM 2347 HA VAL C 19 14.683 22.662 27.601 1.00 0.00 H
+ATOM 2348 HB VAL C 19 13.565 25.204 28.763 1.00 0.00 H
+ATOM 2349 1HG1 VAL C 19 13.074 25.885 26.461 1.00 0.00 H
+ATOM 2350 2HG1 VAL C 19 14.823 25.762 26.713 1.00 0.00 H
+ATOM 2351 3HG1 VAL C 19 13.955 24.466 25.844 1.00 0.00 H
+ATOM 2352 1HG2 VAL C 19 11.540 24.350 27.656 1.00 0.00 H
+ATOM 2353 2HG2 VAL C 19 12.444 22.967 27.066 1.00 0.00 H
+ATOM 2354 3HG2 VAL C 19 12.167 23.175 28.791 1.00 0.00 H
+ATOM 2355 N ASN C 20 16.812 23.782 27.072 1.00 49.74 N
+ATOM 2356 CA ASN C 20 18.176 24.230 26.892 1.00 47.75 C
+ATOM 2357 C ASN C 20 18.359 25.150 25.689 1.00 47.21 C
+ATOM 2358 O ASN C 20 18.186 24.730 24.538 1.00 46.84 O
+ATOM 2359 CB ASN C 20 19.074 23.013 26.832 1.00 57.79 C
+ATOM 2360 CG ASN C 20 20.506 23.342 26.851 1.00 69.03 C
+ATOM 2361 OD1 ASN C 20 20.952 24.378 26.361 1.00 79.05 O
+ATOM 2362 ND2 ASN C 20 21.277 22.471 27.444 1.00 62.37 N
+ATOM 2363 H ASN C 20 16.375 23.200 26.368 1.00 0.00 H
+ATOM 2364 HA ASN C 20 18.464 24.811 27.770 1.00 0.00 H
+ATOM 2365 1HB ASN C 20 18.853 22.368 27.689 1.00 0.00 H
+ATOM 2366 2HB ASN C 20 18.857 22.445 25.937 1.00 0.00 H
+ATOM 2367 1HD2 ASN C 20 22.266 22.643 27.509 1.00 0.00 H
+ATOM 2368 2HD2 ASN C 20 20.885 21.644 27.844 1.00 0.00 H
+ATOM 2369 N VAL C 21 18.652 26.427 25.950 1.00 45.31 N
+ATOM 2370 CA VAL C 21 18.851 27.370 24.857 1.00 44.09 C
+ATOM 2371 C VAL C 21 20.348 27.553 24.652 1.00 44.51 C
+ATOM 2372 O VAL C 21 21.082 27.937 25.565 1.00 44.39 O
+ATOM 2373 CB VAL C 21 18.184 28.714 25.139 1.00 37.50 C
+ATOM 2374 CG1 VAL C 21 18.441 29.643 23.965 1.00 33.43 C
+ATOM 2375 CG2 VAL C 21 16.707 28.489 25.377 1.00 37.61 C
+ATOM 2376 H VAL C 21 18.765 26.729 26.918 1.00 0.00 H
+ATOM 2377 HA VAL C 21 18.423 26.958 23.943 1.00 0.00 H
+ATOM 2378 HB VAL C 21 18.630 29.167 26.019 1.00 0.00 H
+ATOM 2379 1HG1 VAL C 21 17.988 30.608 24.146 1.00 0.00 H
+ATOM 2380 2HG1 VAL C 21 19.516 29.772 23.831 1.00 0.00 H
+ATOM 2381 3HG1 VAL C 21 18.018 29.209 23.062 1.00 0.00 H
+ATOM 2382 1HG2 VAL C 21 16.224 29.441 25.577 1.00 0.00 H
+ATOM 2383 2HG2 VAL C 21 16.267 28.032 24.497 1.00 0.00 H
+ATOM 2384 3HG2 VAL C 21 16.577 27.826 26.235 1.00 0.00 H
+ATOM 2385 N ILE C 22 20.803 27.224 23.456 1.00 44.34 N
+ATOM 2386 CA ILE C 22 22.215 27.154 23.157 1.00 44.61 C
+ATOM 2387 C ILE C 22 22.706 28.260 22.229 1.00 46.86 C
+ATOM 2388 O ILE C 22 22.155 28.479 21.149 1.00 48.54 O
+ATOM 2389 CB ILE C 22 22.494 25.794 22.507 1.00 49.06 C
+ATOM 2390 CG1 ILE C 22 22.063 24.676 23.453 1.00 42.22 C
+ATOM 2391 CG2 ILE C 22 23.961 25.670 22.185 1.00 33.83 C
+ATOM 2392 CD1 ILE C 22 21.994 23.313 22.808 1.00 42.92 C
+ATOM 2393 H ILE C 22 20.144 26.955 22.740 1.00 0.00 H
+ATOM 2394 HA ILE C 22 22.762 27.220 24.089 1.00 0.00 H
+ATOM 2395 HB ILE C 22 21.914 25.705 21.627 1.00 0.00 H
+ATOM 2396 1HG1 ILE C 22 22.766 24.635 24.285 1.00 0.00 H
+ATOM 2397 2HG1 ILE C 22 21.073 24.905 23.843 1.00 0.00 H
+ATOM 2398 1HG2 ILE C 22 24.154 24.703 21.728 1.00 0.00 H
+ATOM 2399 2HG2 ILE C 22 24.263 26.457 21.502 1.00 0.00 H
+ATOM 2400 3HG2 ILE C 22 24.522 25.761 23.117 1.00 0.00 H
+ATOM 2401 1HD1 ILE C 22 21.678 22.580 23.553 1.00 0.00 H
+ATOM 2402 2HD1 ILE C 22 21.270 23.336 21.988 1.00 0.00 H
+ATOM 2403 3HD1 ILE C 22 22.973 23.040 22.420 1.00 0.00 H
+ATOM 2404 N GLY C 23 23.749 28.967 22.661 1.00 45.85 N
+ATOM 2405 CA GLY C 23 24.360 30.000 21.833 1.00 43.18 C
+ATOM 2406 C GLY C 23 25.485 29.379 21.012 1.00 44.02 C
+ATOM 2407 O GLY C 23 26.379 28.729 21.573 1.00 43.17 O
+ATOM 2408 H GLY C 23 24.147 28.742 23.565 1.00 0.00 H
+ATOM 2409 1HA GLY C 23 23.616 30.447 21.171 1.00 0.00 H
+ATOM 2410 2HA GLY C 23 24.757 30.793 22.466 1.00 0.00 H
+ATOM 2411 N LEU C 24 25.449 29.621 19.693 1.00 41.08 N
+ATOM 2412 CA LEU C 24 26.438 29.119 18.731 1.00 36.52 C
+ATOM 2413 C LEU C 24 27.337 30.254 18.250 1.00 33.76 C
+ATOM 2414 O LEU C 24 26.844 31.323 17.847 1.00 30.27 O
+ATOM 2415 CB LEU C 24 25.732 28.495 17.523 1.00 33.51 C
+ATOM 2416 CG LEU C 24 25.078 27.104 17.720 1.00 40.65 C
+ATOM 2417 CD1 LEU C 24 23.798 27.252 18.534 1.00 45.92 C
+ATOM 2418 CD2 LEU C 24 24.762 26.488 16.355 1.00 32.06 C
+ATOM 2419 H LEU C 24 24.667 30.156 19.324 1.00 0.00 H
+ATOM 2420 HA LEU C 24 27.053 28.366 19.214 1.00 0.00 H
+ATOM 2421 1HB LEU C 24 24.958 29.168 17.243 1.00 0.00 H
+ATOM 2422 2HB LEU C 24 26.441 28.423 16.705 1.00 0.00 H
+ATOM 2423 HG LEU C 24 25.762 26.455 18.268 1.00 0.00 H
+ATOM 2424 1HD1 LEU C 24 23.358 26.273 18.675 1.00 0.00 H
+ATOM 2425 2HD1 LEU C 24 24.015 27.679 19.491 1.00 0.00 H
+ATOM 2426 3HD1 LEU C 24 23.096 27.896 18.006 1.00 0.00 H
+ATOM 2427 1HD2 LEU C 24 24.303 25.506 16.491 1.00 0.00 H
+ATOM 2428 2HD2 LEU C 24 24.075 27.130 15.813 1.00 0.00 H
+ATOM 2429 3HD2 LEU C 24 25.680 26.374 15.781 1.00 0.00 H
+ATOM 2430 N THR C 25 28.654 30.008 18.274 1.00 33.60 N
+ATOM 2431 CA THR C 25 29.632 31.055 17.985 1.00 33.73 C
+ATOM 2432 C THR C 25 29.598 31.628 16.586 1.00 35.96 C
+ATOM 2433 O THR C 25 29.368 30.922 15.601 1.00 35.72 O
+ATOM 2434 CB THR C 25 31.084 30.571 18.215 1.00 35.52 C
+ATOM 2435 OG1 THR C 25 31.370 29.434 17.378 1.00 36.91 O
+ATOM 2436 CG2 THR C 25 31.301 30.207 19.653 1.00 29.55 C
+ATOM 2437 H THR C 25 28.980 29.097 18.584 1.00 0.00 H
+ATOM 2438 HA THR C 25 29.444 31.858 18.680 1.00 0.00 H
+ATOM 2439 HB THR C 25 31.776 31.372 17.955 1.00 0.00 H
+ATOM 2440 HG1 THR C 25 31.803 29.714 16.535 1.00 0.00 H
+ATOM 2441 1HG2 THR C 25 32.327 29.874 19.788 1.00 0.00 H
+ATOM 2442 2HG2 THR C 25 31.113 31.086 20.269 1.00 0.00 H
+ATOM 2443 3HG2 THR C 25 30.632 29.423 19.941 1.00 0.00 H
+ATOM 2444 N ARG C 26 29.901 32.925 16.538 1.00 35.96 N
+ATOM 2445 CA ARG C 26 30.063 33.690 15.309 1.00 37.53 C
+ATOM 2446 C ARG C 26 31.516 33.679 14.847 1.00 39.57 C
+ATOM 2447 O ARG C 26 32.424 33.969 15.627 1.00 44.76 O
+ATOM 2448 CB ARG C 26 29.644 35.141 15.520 1.00 38.26 C
+ATOM 2449 CG ARG C 26 29.684 36.011 14.264 1.00 33.28 C
+ATOM 2450 CD ARG C 26 29.378 37.440 14.559 1.00 25.91 C
+ATOM 2451 NE ARG C 26 28.054 37.633 15.129 1.00 40.72 N
+ATOM 2452 CZ ARG C 26 26.920 37.760 14.425 1.00 37.03 C
+ATOM 2453 NH1 ARG C 26 26.944 37.719 13.111 1.00 39.54 N
+ATOM 2454 NH2 ARG C 26 25.795 37.934 15.076 1.00 30.21 N
+ATOM 2455 H ARG C 26 30.010 33.401 17.429 1.00 0.00 H
+ATOM 2456 HA ARG C 26 29.447 33.239 14.532 1.00 0.00 H
+ATOM 2457 1HB ARG C 26 28.631 35.176 15.914 1.00 0.00 H
+ATOM 2458 2HB ARG C 26 30.291 35.605 16.263 1.00 0.00 H
+ATOM 2459 1HG ARG C 26 30.684 35.971 13.838 1.00 0.00 H
+ATOM 2460 2HG ARG C 26 28.967 35.645 13.536 1.00 0.00 H
+ATOM 2461 1HD ARG C 26 30.110 37.827 15.256 1.00 0.00 H
+ATOM 2462 2HD ARG C 26 29.430 38.008 13.635 1.00 0.00 H
+ATOM 2463 HE ARG C 26 27.969 37.682 16.154 1.00 0.00 H
+ATOM 2464 1HH1 ARG C 26 27.822 37.594 12.636 1.00 0.00 H
+ATOM 2465 2HH1 ARG C 26 26.090 37.832 12.579 1.00 0.00 H
+ATOM 2466 1HH2 ARG C 26 25.823 37.974 16.101 1.00 0.00 H
+ATOM 2467 2HH2 ARG C 26 24.907 38.018 14.584 1.00 0.00 H
+ATOM 2468 N GLY C 27 31.737 33.362 13.576 1.00 39.14 N
+ATOM 2469 CA GLY C 27 33.087 33.367 13.016 1.00 37.80 C
+ATOM 2470 C GLY C 27 33.345 32.129 12.175 1.00 38.05 C
+ATOM 2471 O GLY C 27 32.424 31.398 11.822 1.00 34.46 O
+ATOM 2472 H GLY C 27 30.958 33.112 12.985 1.00 0.00 H
+ATOM 2473 1HA GLY C 27 33.212 34.258 12.402 1.00 0.00 H
+ATOM 2474 2HA GLY C 27 33.820 33.428 13.818 1.00 0.00 H
+ATOM 2475 N ALA C 28 34.619 31.899 11.844 1.00 39.91 N
+ATOM 2476 CA ALA C 28 35.013 30.765 11.011 1.00 43.70 C
+ATOM 2477 C ALA C 28 34.639 29.427 11.660 1.00 42.78 C
+ATOM 2478 O ALA C 28 34.293 28.470 10.964 1.00 45.98 O
+ATOM 2479 CB ALA C 28 36.514 30.816 10.759 1.00 40.95 C
+ATOM 2480 H ALA C 28 35.326 32.539 12.170 1.00 0.00 H
+ATOM 2481 HA ALA C 28 34.489 30.839 10.061 1.00 0.00 H
+ATOM 2482 1HB ALA C 28 36.807 29.988 10.116 1.00 0.00 H
+ATOM 2483 2HB ALA C 28 36.767 31.759 10.273 1.00 0.00 H
+ATOM 2484 3HB ALA C 28 37.046 30.741 11.708 1.00 0.00 H
+ATOM 2485 N ASP C 29 34.729 29.370 12.987 1.00 40.96 N
+ATOM 2486 CA ASP C 29 34.403 28.170 13.755 1.00 40.21 C
+ATOM 2487 C ASP C 29 33.041 28.271 14.436 1.00 35.80 C
+ATOM 2488 O ASP C 29 32.781 29.248 15.149 1.00 32.16 O
+ATOM 2489 CB ASP C 29 35.420 27.915 14.862 1.00 46.80 C
+ATOM 2490 CG ASP C 29 36.833 27.531 14.403 1.00 45.40 C
+ATOM 2491 OD1 ASP C 29 37.022 27.221 13.254 1.00 45.38 O
+ATOM 2492 OD2 ASP C 29 37.706 27.494 15.261 1.00 48.31 O
+ATOM 2493 H ASP C 29 35.020 30.198 13.480 1.00 0.00 H
+ATOM 2494 HA ASP C 29 34.390 27.316 13.077 1.00 0.00 H
+ATOM 2495 1HB ASP C 29 35.497 28.808 15.477 1.00 0.00 H
+ATOM 2496 2HB ASP C 29 35.031 27.123 15.496 1.00 0.00 H
+ATOM 2497 N THR C 30 32.195 27.249 14.267 1.00 38.68 N
+ATOM 2498 CA THR C 30 30.912 27.241 14.962 1.00 42.44 C
+ATOM 2499 C THR C 30 30.871 26.163 16.047 1.00 44.49 C
+ATOM 2500 O THR C 30 30.871 24.965 15.753 1.00 43.64 O
+ATOM 2501 CB THR C 30 29.729 27.034 14.005 1.00 36.73 C
+ATOM 2502 OG1 THR C 30 29.696 28.094 13.039 1.00 39.68 O
+ATOM 2503 CG2 THR C 30 28.425 27.047 14.797 1.00 40.11 C
+ATOM 2504 H THR C 30 32.449 26.481 13.659 1.00 0.00 H
+ATOM 2505 HA THR C 30 30.766 28.205 15.439 1.00 0.00 H
+ATOM 2506 HB THR C 30 29.837 26.083 13.491 1.00 0.00 H
+ATOM 2507 HG1 THR C 30 29.678 28.945 13.504 1.00 0.00 H
+ATOM 2508 1HG2 THR C 30 27.587 26.904 14.120 1.00 0.00 H
+ATOM 2509 2HG2 THR C 30 28.435 26.247 15.539 1.00 0.00 H
+ATOM 2510 3HG2 THR C 30 28.326 28.009 15.304 1.00 0.00 H
+ATOM 2511 N ARG C 31 30.826 26.610 17.293 1.00 46.21 N
+ATOM 2512 CA ARG C 31 30.786 25.760 18.484 1.00 47.76 C
+ATOM 2513 C ARG C 31 29.743 26.308 19.447 1.00 46.87 C
+ATOM 2514 O ARG C 31 29.429 27.485 19.418 1.00 44.89 O
+ATOM 2515 CB ARG C 31 32.146 25.725 19.187 1.00 47.87 C
+ATOM 2516 CG ARG C 31 33.259 24.933 18.472 1.00 47.53 C
+ATOM 2517 CD ARG C 31 34.551 24.946 19.257 1.00 51.74 C
+ATOM 2518 NE ARG C 31 35.217 26.247 19.214 1.00 59.73 N
+ATOM 2519 CZ ARG C 31 36.133 26.603 18.274 1.00 58.17 C
+ATOM 2520 NH1 ARG C 31 36.503 25.757 17.352 1.00 46.59 N
+ATOM 2521 NH2 ARG C 31 36.683 27.800 18.251 1.00 58.77 N
+ATOM 2522 H ARG C 31 30.854 27.615 17.425 1.00 0.00 H
+ATOM 2523 HA ARG C 31 30.511 24.751 18.190 1.00 0.00 H
+ATOM 2524 1HB ARG C 31 32.501 26.748 19.320 1.00 0.00 H
+ATOM 2525 2HB ARG C 31 32.019 25.297 20.185 1.00 0.00 H
+ATOM 2526 1HG ARG C 31 32.938 23.896 18.352 1.00 0.00 H
+ATOM 2527 2HG ARG C 31 33.444 25.368 17.491 1.00 0.00 H
+ATOM 2528 1HD ARG C 31 34.336 24.714 20.301 1.00 0.00 H
+ATOM 2529 2HD ARG C 31 35.233 24.198 18.854 1.00 0.00 H
+ATOM 2530 HE ARG C 31 34.955 26.936 19.907 1.00 0.00 H
+ATOM 2531 1HH1 ARG C 31 36.115 24.826 17.315 1.00 0.00 H
+ATOM 2532 2HH1 ARG C 31 37.199 26.071 16.656 1.00 0.00 H
+ATOM 2533 1HH2 ARG C 31 36.439 28.498 18.938 1.00 0.00 H
+ATOM 2534 2HH2 ARG C 31 37.351 28.003 17.491 1.00 0.00 H
+ATOM 2535 N PHE C 32 29.172 25.465 20.287 1.00 47.97 N
+ATOM 2536 CA PHE C 32 28.310 26.094 21.285 1.00 50.33 C
+ATOM 2537 C PHE C 32 29.250 26.866 22.203 1.00 50.37 C
+ATOM 2538 O PHE C 32 30.382 26.438 22.413 1.00 50.01 O
+ATOM 2539 CB PHE C 32 27.508 25.084 22.097 1.00 51.52 C
+ATOM 2540 CG PHE C 32 28.227 24.452 23.247 1.00 69.45 C
+ATOM 2541 CD1 PHE C 32 28.969 23.291 23.110 1.00 76.19 C
+ATOM 2542 CD2 PHE C 32 28.129 25.035 24.507 1.00 73.87 C
+ATOM 2543 CE1 PHE C 32 29.604 22.732 24.212 1.00 73.46 C
+ATOM 2544 CE2 PHE C 32 28.756 24.488 25.599 1.00 73.29 C
+ATOM 2545 CZ PHE C 32 29.495 23.332 25.455 1.00 79.03 C
+ATOM 2546 H PHE C 32 29.358 24.473 20.295 1.00 0.00 H
+ATOM 2547 HA PHE C 32 27.630 26.781 20.793 1.00 0.00 H
+ATOM 2548 1HB PHE C 32 26.664 25.599 22.505 1.00 0.00 H
+ATOM 2549 2HB PHE C 32 27.129 24.293 21.449 1.00 0.00 H
+ATOM 2550 HD1 PHE C 32 29.050 22.817 22.132 1.00 0.00 H
+ATOM 2551 HD2 PHE C 32 27.539 25.943 24.618 1.00 0.00 H
+ATOM 2552 HE1 PHE C 32 30.186 21.816 24.100 1.00 0.00 H
+ATOM 2553 HE2 PHE C 32 28.664 24.961 26.575 1.00 0.00 H
+ATOM 2554 HZ PHE C 32 29.992 22.892 26.319 1.00 0.00 H
+ATOM 2555 N HIS C 33 28.784 27.965 22.785 1.00 49.14 N
+ATOM 2556 CA HIS C 33 29.632 28.630 23.777 1.00 50.52 C
+ATOM 2557 C HIS C 33 28.855 28.866 25.060 1.00 51.24 C
+ATOM 2558 O HIS C 33 29.437 29.138 26.108 1.00 51.41 O
+ATOM 2559 CB HIS C 33 30.163 29.956 23.244 1.00 45.27 C
+ATOM 2560 CG HIS C 33 29.120 30.995 23.022 1.00 48.42 C
+ATOM 2561 ND1 HIS C 33 28.641 31.769 24.053 1.00 47.87 N
+ATOM 2562 CD2 HIS C 33 28.454 31.396 21.916 1.00 44.91 C
+ATOM 2563 CE1 HIS C 33 27.732 32.596 23.593 1.00 45.75 C
+ATOM 2564 NE2 HIS C 33 27.600 32.391 22.301 1.00 50.88 N
+ATOM 2565 H HIS C 33 27.871 28.314 22.543 1.00 0.00 H
+ATOM 2566 HA HIS C 33 30.481 27.999 24.022 1.00 0.00 H
+ATOM 2567 1HB HIS C 33 30.890 30.358 23.953 1.00 0.00 H
+ATOM 2568 2HB HIS C 33 30.683 29.782 22.318 1.00 0.00 H
+ATOM 2569 HD2 HIS C 33 28.570 31.004 20.910 1.00 0.00 H
+ATOM 2570 HE1 HIS C 33 27.185 33.328 24.185 1.00 0.00 H
+ATOM 2571 HE2 HIS C 33 26.967 32.902 21.709 1.00 0.00 H
+ATOM 2572 N HIS C 34 27.541 28.702 24.979 1.00 51.73 N
+ATOM 2573 CA HIS C 34 26.696 28.922 26.149 1.00 50.64 C
+ATOM 2574 C HIS C 34 25.434 28.095 26.093 1.00 53.40 C
+ATOM 2575 O HIS C 34 24.830 27.926 25.039 1.00 52.74 O
+ATOM 2576 CB HIS C 34 26.310 30.396 26.326 1.00 33.20 C
+ATOM 2577 CG HIS C 34 25.534 30.650 27.601 1.00 47.01 C
+ATOM 2578 ND1 HIS C 34 26.123 30.615 28.846 1.00 55.75 N
+ATOM 2579 CD2 HIS C 34 24.221 30.926 27.815 1.00 52.35 C
+ATOM 2580 CE1 HIS C 34 25.208 30.861 29.774 1.00 51.37 C
+ATOM 2581 NE2 HIS C 34 24.047 31.051 29.174 1.00 55.35 N
+ATOM 2582 H HIS C 34 27.131 28.487 24.073 1.00 0.00 H
+ATOM 2583 HA HIS C 34 27.236 28.618 27.044 1.00 0.00 H
+ATOM 2584 1HB HIS C 34 27.213 31.007 26.356 1.00 0.00 H
+ATOM 2585 2HB HIS C 34 25.713 30.728 25.478 1.00 0.00 H
+ATOM 2586 HD2 HIS C 34 23.448 31.024 27.056 1.00 0.00 H
+ATOM 2587 HE1 HIS C 34 25.384 30.895 30.848 1.00 0.00 H
+ATOM 2588 HE2 HIS C 34 23.154 31.253 29.649 1.00 0.00 H
+ATOM 2589 N SER C 35 25.036 27.582 27.247 1.00 52.37 N
+ATOM 2590 CA SER C 35 23.826 26.781 27.357 1.00 53.95 C
+ATOM 2591 C SER C 35 22.992 27.229 28.558 1.00 55.51 C
+ATOM 2592 O SER C 35 23.376 27.019 29.712 1.00 56.67 O
+ATOM 2593 CB SER C 35 24.242 25.327 27.460 1.00 46.66 C
+ATOM 2594 OG SER C 35 23.162 24.489 27.660 1.00 45.00 O
+ATOM 2595 H SER C 35 25.581 27.763 28.079 1.00 0.00 H
+ATOM 2596 HA SER C 35 23.226 26.917 26.458 1.00 0.00 H
+ATOM 2597 1HB SER C 35 24.748 25.044 26.533 1.00 0.00 H
+ATOM 2598 2HB SER C 35 24.958 25.206 28.271 1.00 0.00 H
+ATOM 2599 HG SER C 35 22.515 24.705 26.968 1.00 0.00 H
+ATOM 2600 N GLU C 36 21.864 27.885 28.270 1.00 55.44 N
+ATOM 2601 CA GLU C 36 21.003 28.457 29.298 1.00 54.50 C
+ATOM 2602 C GLU C 36 19.858 27.512 29.655 1.00 56.02 C
+ATOM 2603 O GLU C 36 19.029 27.174 28.806 1.00 53.95 O
+ATOM 2604 CB GLU C 36 20.439 29.812 28.848 1.00 52.67 C
+ATOM 2605 CG GLU C 36 19.648 30.550 29.924 1.00 60.27 C
+ATOM 2606 CD GLU C 36 20.519 31.072 31.030 1.00 62.27 C
+ATOM 2607 OE1 GLU C 36 21.660 31.420 30.768 1.00 52.28 O
+ATOM 2608 OE2 GLU C 36 20.050 31.126 32.152 1.00 55.76 O
+ATOM 2609 H GLU C 36 21.600 27.995 27.296 1.00 0.00 H
+ATOM 2610 HA GLU C 36 21.602 28.616 30.196 1.00 0.00 H
+ATOM 2611 1HB GLU C 36 21.246 30.458 28.515 1.00 0.00 H
+ATOM 2612 2HB GLU C 36 19.774 29.663 28.003 1.00 0.00 H
+ATOM 2613 1HG GLU C 36 19.133 31.391 29.480 1.00 0.00 H
+ATOM 2614 2HG GLU C 36 18.899 29.875 30.341 1.00 0.00 H
+ATOM 2615 N LYS C 37 19.826 27.067 30.905 1.00 55.64 N
+ATOM 2616 CA LYS C 37 18.793 26.136 31.340 1.00 54.47 C
+ATOM 2617 C LYS C 37 17.541 26.870 31.814 1.00 54.57 C
+ATOM 2618 O LYS C 37 17.601 27.683 32.741 1.00 53.88 O
+ATOM 2619 CB LYS C 37 19.331 25.245 32.458 1.00 55.28 C
+ATOM 2620 CG LYS C 37 18.361 24.179 32.944 1.00 43.79 C
+ATOM 2621 CD LYS C 37 18.988 23.329 34.054 1.00 47.23 C
+ATOM 2622 CE LYS C 37 18.005 22.300 34.587 1.00 46.33 C
+ATOM 2623 NZ LYS C 37 18.577 21.521 35.711 1.00 46.70 N
+ATOM 2624 H LYS C 37 20.532 27.375 31.559 1.00 0.00 H
+ATOM 2625 HA LYS C 37 18.514 25.505 30.497 1.00 0.00 H
+ATOM 2626 1HB LYS C 37 20.230 24.736 32.106 1.00 0.00 H
+ATOM 2627 2HB LYS C 37 19.615 25.859 33.310 1.00 0.00 H
+ATOM 2628 1HG LYS C 37 17.452 24.654 33.329 1.00 0.00 H
+ATOM 2629 2HG LYS C 37 18.081 23.536 32.106 1.00 0.00 H
+ATOM 2630 1HD LYS C 37 19.871 22.814 33.669 1.00 0.00 H
+ATOM 2631 2HD LYS C 37 19.295 23.974 34.876 1.00 0.00 H
+ATOM 2632 1HE LYS C 37 17.105 22.810 34.930 1.00 0.00 H
+ATOM 2633 2HE LYS C 37 17.740 21.614 33.789 1.00 0.00 H
+ATOM 2634 1HZ LYS C 37 17.891 20.853 36.037 1.00 0.00 H
+ATOM 2635 2HZ LYS C 37 19.405 21.034 35.403 1.00 0.00 H
+ATOM 2636 3HZ LYS C 37 18.812 22.153 36.462 1.00 0.00 H
+ATOM 2637 N LEU C 38 16.417 26.595 31.157 1.00 53.94 N
+ATOM 2638 CA LEU C 38 15.142 27.218 31.482 1.00 54.12 C
+ATOM 2639 C LEU C 38 14.168 26.154 31.993 1.00 55.84 C
+ATOM 2640 O LEU C 38 13.854 25.197 31.278 1.00 56.12 O
+ATOM 2641 CB LEU C 38 14.542 27.896 30.234 1.00 50.56 C
+ATOM 2642 CG LEU C 38 15.420 28.908 29.485 1.00 53.69 C
+ATOM 2643 CD1 LEU C 38 14.651 29.410 28.255 1.00 53.45 C
+ATOM 2644 CD2 LEU C 38 15.800 30.045 30.398 1.00 53.02 C
+ATOM 2645 H LEU C 38 16.451 25.922 30.402 1.00 0.00 H
+ATOM 2646 HA LEU C 38 15.290 27.959 32.269 1.00 0.00 H
+ATOM 2647 1HB LEU C 38 14.300 27.130 29.523 1.00 0.00 H
+ATOM 2648 2HB LEU C 38 13.622 28.406 30.522 1.00 0.00 H
+ATOM 2649 HG LEU C 38 16.330 28.405 29.136 1.00 0.00 H
+ATOM 2650 1HD1 LEU C 38 15.273 30.103 27.704 1.00 0.00 H
+ATOM 2651 2HD1 LEU C 38 14.401 28.563 27.616 1.00 0.00 H
+ATOM 2652 3HD1 LEU C 38 13.731 29.914 28.568 1.00 0.00 H
+ATOM 2653 1HD2 LEU C 38 16.434 30.743 29.861 1.00 0.00 H
+ATOM 2654 2HD2 LEU C 38 14.902 30.557 30.744 1.00 0.00 H
+ATOM 2655 3HD2 LEU C 38 16.345 29.648 31.252 1.00 0.00 H
+ATOM 2656 N ASP C 39 13.699 26.295 33.220 1.00 54.83 N
+ATOM 2657 CA ASP C 39 12.758 25.316 33.741 1.00 53.17 C
+ATOM 2658 C ASP C 39 11.359 25.756 33.374 1.00 52.25 C
+ATOM 2659 O ASP C 39 11.198 26.874 32.885 1.00 49.21 O
+ATOM 2660 CB ASP C 39 12.963 25.058 35.224 1.00 52.57 C
+ATOM 2661 CG ASP C 39 14.234 24.200 35.475 1.00 54.67 C
+ATOM 2662 OD1 ASP C 39 14.645 23.461 34.569 1.00 47.96 O
+ATOM 2663 OD2 ASP C 39 14.779 24.278 36.553 1.00 48.68 O
+ATOM 2664 H ASP C 39 13.980 27.098 33.785 1.00 0.00 H
+ATOM 2665 HA ASP C 39 12.945 24.378 33.236 1.00 0.00 H
+ATOM 2666 1HB ASP C 39 13.064 26.012 35.749 1.00 0.00 H
+ATOM 2667 2HB ASP C 39 12.088 24.539 35.631 1.00 0.00 H
+ATOM 2668 N LYS C 40 10.366 24.884 33.529 1.00 50.31 N
+ATOM 2669 CA LYS C 40 9.044 25.215 33.025 1.00 48.78 C
+ATOM 2670 C LYS C 40 8.568 26.579 33.478 1.00 47.84 C
+ATOM 2671 O LYS C 40 8.558 26.897 34.671 1.00 49.91 O
+ATOM 2672 CB LYS C 40 8.029 24.153 33.435 1.00 54.53 C
+ATOM 2673 CG LYS C 40 6.642 24.377 32.862 1.00 67.57 C
+ATOM 2674 CD LYS C 40 5.721 23.224 33.169 1.00 67.75 C
+ATOM 2675 CE LYS C 40 4.372 23.441 32.521 1.00 66.25 C
+ATOM 2676 NZ LYS C 40 3.442 22.325 32.793 1.00 69.77 N
+ATOM 2677 H LYS C 40 10.518 23.975 33.980 1.00 0.00 H
+ATOM 2678 HA LYS C 40 9.094 25.228 31.935 1.00 0.00 H
+ATOM 2679 1HB LYS C 40 8.378 23.179 33.125 1.00 0.00 H
+ATOM 2680 2HB LYS C 40 7.950 24.130 34.522 1.00 0.00 H
+ATOM 2681 1HG LYS C 40 6.219 25.284 33.295 1.00 0.00 H
+ATOM 2682 2HG LYS C 40 6.706 24.508 31.784 1.00 0.00 H
+ATOM 2683 1HD LYS C 40 6.157 22.303 32.773 1.00 0.00 H
+ATOM 2684 2HD LYS C 40 5.600 23.121 34.248 1.00 0.00 H
+ATOM 2685 1HE LYS C 40 3.939 24.366 32.898 1.00 0.00 H
+ATOM 2686 2HE LYS C 40 4.510 23.530 31.442 1.00 0.00 H
+ATOM 2687 1HZ LYS C 40 2.561 22.509 32.338 1.00 0.00 H
+ATOM 2688 2HZ LYS C 40 3.836 21.467 32.432 1.00 0.00 H
+ATOM 2689 3HZ LYS C 40 3.300 22.240 33.787 1.00 0.00 H
+ATOM 2690 N GLY C 41 8.160 27.382 32.501 1.00 42.64 N
+ATOM 2691 CA GLY C 41 7.642 28.712 32.733 1.00 39.28 C
+ATOM 2692 C GLY C 41 8.691 29.827 32.676 1.00 38.03 C
+ATOM 2693 O GLY C 41 8.326 31.007 32.658 1.00 38.26 O
+ATOM 2694 H GLY C 41 8.206 27.058 31.538 1.00 0.00 H
+ATOM 2695 1HA GLY C 41 6.872 28.911 31.991 1.00 0.00 H
+ATOM 2696 2HA GLY C 41 7.145 28.723 33.699 1.00 0.00 H
+ATOM 2697 N GLU C 42 9.984 29.502 32.669 1.00 39.23 N
+ATOM 2698 CA GLU C 42 10.971 30.583 32.605 1.00 44.19 C
+ATOM 2699 C GLU C 42 11.014 31.179 31.204 1.00 44.96 C
+ATOM 2700 O GLU C 42 10.887 30.461 30.204 1.00 45.65 O
+ATOM 2701 CB GLU C 42 12.376 30.129 33.051 1.00 46.31 C
+ATOM 2702 CG GLU C 42 12.504 29.822 34.558 1.00 57.46 C
+ATOM 2703 CD GLU C 42 13.942 29.551 35.029 1.00 64.89 C
+ATOM 2704 OE1 GLU C 42 14.505 28.551 34.674 1.00 56.58 O
+ATOM 2705 OE2 GLU C 42 14.468 30.371 35.748 1.00 66.75 O
+ATOM 2706 H GLU C 42 10.283 28.527 32.705 1.00 0.00 H
+ATOM 2707 HA GLU C 42 10.662 31.376 33.288 1.00 0.00 H
+ATOM 2708 1HB GLU C 42 12.644 29.217 32.517 1.00 0.00 H
+ATOM 2709 2HB GLU C 42 13.116 30.896 32.795 1.00 0.00 H
+ATOM 2710 1HG GLU C 42 12.107 30.661 35.129 1.00 0.00 H
+ATOM 2711 2HG GLU C 42 11.888 28.948 34.772 1.00 0.00 H
+ATOM 2712 N VAL C 43 11.201 32.501 31.128 1.00 41.60 N
+ATOM 2713 CA VAL C 43 11.281 33.164 29.825 1.00 43.11 C
+ATOM 2714 C VAL C 43 12.622 33.827 29.591 1.00 43.91 C
+ATOM 2715 O VAL C 43 13.131 34.561 30.438 1.00 41.33 O
+ATOM 2716 CB VAL C 43 10.146 34.209 29.645 1.00 38.08 C
+ATOM 2717 CG1 VAL C 43 10.317 34.968 28.316 1.00 35.22 C
+ATOM 2718 CG2 VAL C 43 8.812 33.493 29.613 1.00 39.31 C
+ATOM 2719 H VAL C 43 11.296 33.047 31.987 1.00 0.00 H
+ATOM 2720 HA VAL C 43 11.145 32.409 29.055 1.00 0.00 H
+ATOM 2721 HB VAL C 43 10.174 34.924 30.465 1.00 0.00 H
+ATOM 2722 1HG1 VAL C 43 9.510 35.691 28.195 1.00 0.00 H
+ATOM 2723 2HG1 VAL C 43 11.271 35.493 28.313 1.00 0.00 H
+ATOM 2724 3HG1 VAL C 43 10.292 34.253 27.490 1.00 0.00 H
+ATOM 2725 1HG2 VAL C 43 8.006 34.214 29.480 1.00 0.00 H
+ATOM 2726 2HG2 VAL C 43 8.818 32.807 28.790 1.00 0.00 H
+ATOM 2727 3HG2 VAL C 43 8.664 32.946 30.539 1.00 0.00 H
+ATOM 2728 N LEU C 44 13.198 33.543 28.432 1.00 42.09 N
+ATOM 2729 CA LEU C 44 14.469 34.122 28.037 1.00 40.57 C
+ATOM 2730 C LEU C 44 14.324 34.961 26.781 1.00 39.56 C
+ATOM 2731 O LEU C 44 13.842 34.488 25.753 1.00 38.05 O
+ATOM 2732 CB LEU C 44 15.486 33.019 27.775 1.00 31.21 C
+ATOM 2733 CG LEU C 44 16.862 33.470 27.297 1.00 34.55 C
+ATOM 2734 CD1 LEU C 44 17.563 34.274 28.415 1.00 27.62 C
+ATOM 2735 CD2 LEU C 44 17.656 32.238 26.890 1.00 29.80 C
+ATOM 2736 H LEU C 44 12.727 32.901 27.800 1.00 0.00 H
+ATOM 2737 HA LEU C 44 14.830 34.763 28.837 1.00 0.00 H
+ATOM 2738 1HB LEU C 44 15.622 32.473 28.692 1.00 0.00 H
+ATOM 2739 2HB LEU C 44 15.078 32.344 27.025 1.00 0.00 H
+ATOM 2740 HG LEU C 44 16.752 34.128 26.433 1.00 0.00 H
+ATOM 2741 1HD1 LEU C 44 18.539 34.601 28.067 1.00 0.00 H
+ATOM 2742 2HD1 LEU C 44 16.961 35.147 28.671 1.00 0.00 H
+ATOM 2743 3HD1 LEU C 44 17.686 33.648 29.299 1.00 0.00 H
+ATOM 2744 1HD2 LEU C 44 18.642 32.536 26.534 1.00 0.00 H
+ATOM 2745 2HD2 LEU C 44 17.763 31.575 27.738 1.00 0.00 H
+ATOM 2746 3HD2 LEU C 44 17.125 31.719 26.098 1.00 0.00 H
+ATOM 2747 N ILE C 45 14.730 36.214 26.862 1.00 40.23 N
+ATOM 2748 CA ILE C 45 14.670 37.087 25.710 1.00 41.97 C
+ATOM 2749 C ILE C 45 16.114 37.374 25.325 1.00 43.17 C
+ATOM 2750 O ILE C 45 16.868 37.908 26.135 1.00 45.22 O
+ATOM 2751 CB ILE C 45 13.935 38.382 26.053 1.00 40.16 C
+ATOM 2752 CG1 ILE C 45 12.533 38.048 26.595 1.00 48.10 C
+ATOM 2753 CG2 ILE C 45 13.819 39.170 24.794 1.00 33.81 C
+ATOM 2754 CD1 ILE C 45 11.789 39.205 27.170 1.00 47.38 C
+ATOM 2755 H ILE C 45 15.088 36.572 27.739 1.00 0.00 H
+ATOM 2756 HA ILE C 45 14.174 36.588 24.885 1.00 0.00 H
+ATOM 2757 HB ILE C 45 14.478 38.944 26.808 1.00 0.00 H
+ATOM 2758 1HG1 ILE C 45 11.949 37.630 25.805 1.00 0.00 H
+ATOM 2759 2HG1 ILE C 45 12.638 37.303 27.381 1.00 0.00 H
+ATOM 2760 1HG2 ILE C 45 13.292 40.096 24.972 1.00 0.00 H
+ATOM 2761 2HG2 ILE C 45 14.809 39.374 24.406 1.00 0.00 H
+ATOM 2762 3HG2 ILE C 45 13.283 38.585 24.078 1.00 0.00 H
+ATOM 2763 1HD1 ILE C 45 10.829 38.859 27.527 1.00 0.00 H
+ATOM 2764 2HD1 ILE C 45 12.353 39.638 27.999 1.00 0.00 H
+ATOM 2765 3HD1 ILE C 45 11.640 39.946 26.402 1.00 0.00 H
+ATOM 2766 N ALA C 46 16.535 36.999 24.119 1.00 40.37 N
+ATOM 2767 CA ALA C 46 17.968 37.130 23.852 1.00 40.54 C
+ATOM 2768 C ALA C 46 18.320 37.558 22.447 1.00 41.72 C
+ATOM 2769 O ALA C 46 17.739 37.090 21.463 1.00 39.57 O
+ATOM 2770 CB ALA C 46 18.642 35.795 24.136 1.00 31.74 C
+ATOM 2771 H ALA C 46 15.882 36.604 23.445 1.00 0.00 H
+ATOM 2772 HA ALA C 46 18.366 37.889 24.520 1.00 0.00 H
+ATOM 2773 1HB ALA C 46 19.718 35.896 23.985 1.00 0.00 H
+ATOM 2774 2HB ALA C 46 18.444 35.499 25.163 1.00 0.00 H
+ATOM 2775 3HB ALA C 46 18.248 35.039 23.459 1.00 0.00 H
+ATOM 2776 N GLN C 47 19.313 38.447 22.373 1.00 41.41 N
+ATOM 2777 CA GLN C 47 19.834 38.985 21.124 1.00 38.17 C
+ATOM 2778 C GLN C 47 20.916 38.151 20.483 1.00 38.21 C
+ATOM 2779 O GLN C 47 21.648 37.417 21.152 1.00 37.20 O
+ATOM 2780 CB GLN C 47 20.403 40.400 21.314 1.00 26.30 C
+ATOM 2781 CG GLN C 47 19.395 41.487 21.619 1.00 33.32 C
+ATOM 2782 CD GLN C 47 20.045 42.838 21.750 1.00 35.83 C
+ATOM 2783 OE1 GLN C 47 20.954 43.025 22.570 1.00 35.90 O
+ATOM 2784 NE2 GLN C 47 19.600 43.802 20.934 1.00 39.82 N
+ATOM 2785 H GLN C 47 19.732 38.787 23.242 1.00 0.00 H
+ATOM 2786 HA GLN C 47 19.021 39.051 20.414 1.00 0.00 H
+ATOM 2787 1HB GLN C 47 21.127 40.386 22.131 1.00 0.00 H
+ATOM 2788 2HB GLN C 47 20.942 40.694 20.411 1.00 0.00 H
+ATOM 2789 1HG GLN C 47 18.719 41.559 20.774 1.00 0.00 H
+ATOM 2790 2HG GLN C 47 18.854 41.256 22.538 1.00 0.00 H
+ATOM 2791 1HE2 GLN C 47 19.998 44.716 20.980 1.00 0.00 H
+ATOM 2792 2HE2 GLN C 47 18.868 43.600 20.250 1.00 0.00 H
+ATOM 2793 N PHE C 48 21.063 38.346 19.183 1.00 34.87 N
+ATOM 2794 CA PHE C 48 22.204 37.804 18.462 1.00 37.48 C
+ATOM 2795 C PHE C 48 23.308 38.828 18.698 1.00 35.71 C
+ATOM 2796 O PHE C 48 23.020 40.020 18.813 1.00 35.52 O
+ATOM 2797 CB PHE C 48 21.885 37.635 16.990 1.00 36.93 C
+ATOM 2798 CG PHE C 48 20.840 36.584 16.737 1.00 28.54 C
+ATOM 2799 CD1 PHE C 48 21.162 35.235 16.607 1.00 25.88 C
+ATOM 2800 CD2 PHE C 48 19.510 36.963 16.653 1.00 26.10 C
+ATOM 2801 CE1 PHE C 48 20.156 34.308 16.398 1.00 25.09 C
+ATOM 2802 CE2 PHE C 48 18.523 36.041 16.450 1.00 26.06 C
+ATOM 2803 CZ PHE C 48 18.847 34.718 16.329 1.00 26.10 C
+ATOM 2804 H PHE C 48 20.370 38.918 18.696 1.00 0.00 H
+ATOM 2805 HA PHE C 48 22.504 36.846 18.889 1.00 0.00 H
+ATOM 2806 1HB PHE C 48 21.544 38.581 16.576 1.00 0.00 H
+ATOM 2807 2HB PHE C 48 22.796 37.344 16.463 1.00 0.00 H
+ATOM 2808 HD1 PHE C 48 22.207 34.918 16.677 1.00 0.00 H
+ATOM 2809 HD2 PHE C 48 19.256 38.017 16.765 1.00 0.00 H
+ATOM 2810 HE1 PHE C 48 20.386 33.259 16.299 1.00 0.00 H
+ATOM 2811 HE2 PHE C 48 17.483 36.358 16.394 1.00 0.00 H
+ATOM 2812 HZ PHE C 48 18.072 33.999 16.192 1.00 0.00 H
+ATOM 2813 N THR C 49 24.542 38.375 18.871 1.00 34.25 N
+ATOM 2814 CA THR C 49 25.614 39.292 19.262 1.00 34.74 C
+ATOM 2815 C THR C 49 26.876 39.154 18.438 1.00 37.62 C
+ATOM 2816 O THR C 49 26.976 38.340 17.523 1.00 40.71 O
+ATOM 2817 CB THR C 49 26.030 39.090 20.736 1.00 27.72 C
+ATOM 2818 OG1 THR C 49 26.717 37.840 20.861 1.00 37.18 O
+ATOM 2819 CG2 THR C 49 24.813 39.079 21.658 1.00 26.73 C
+ATOM 2820 H THR C 49 24.738 37.392 18.704 1.00 0.00 H
+ATOM 2821 HA THR C 49 25.254 40.312 19.139 1.00 0.00 H
+ATOM 2822 HB THR C 49 26.692 39.896 21.041 1.00 0.00 H
+ATOM 2823 HG1 THR C 49 26.056 37.140 20.937 1.00 0.00 H
+ATOM 2824 1HG2 THR C 49 25.146 38.934 22.683 1.00 0.00 H
+ATOM 2825 2HG2 THR C 49 24.274 40.021 21.581 1.00 0.00 H
+ATOM 2826 3HG2 THR C 49 24.147 38.263 21.381 1.00 0.00 H
+ATOM 2827 N GLU C 50 27.879 39.921 18.838 1.00 36.57 N
+ATOM 2828 CA GLU C 50 29.220 39.859 18.283 1.00 39.88 C
+ATOM 2829 C GLU C 50 29.817 38.453 18.398 1.00 41.06 C
+ATOM 2830 O GLU C 50 30.690 38.086 17.613 1.00 40.75 O
+ATOM 2831 CB GLU C 50 30.127 40.866 18.998 1.00 42.48 C
+ATOM 2832 CG GLU C 50 31.542 40.954 18.456 1.00 42.99 C
+ATOM 2833 CD GLU C 50 32.351 42.061 19.100 1.00 60.03 C
+ATOM 2834 OE1 GLU C 50 31.824 42.750 19.942 1.00 66.29 O
+ATOM 2835 OE2 GLU C 50 33.495 42.216 18.746 1.00 55.71 O
+ATOM 2836 H GLU C 50 27.710 40.576 19.584 1.00 0.00 H
+ATOM 2837 HA GLU C 50 29.169 40.119 17.227 1.00 0.00 H
+ATOM 2838 1HB GLU C 50 29.686 41.859 18.940 1.00 0.00 H
+ATOM 2839 2HB GLU C 50 30.199 40.598 20.053 1.00 0.00 H
+ATOM 2840 1HG GLU C 50 32.041 40.000 18.643 1.00 0.00 H
+ATOM 2841 2HG GLU C 50 31.502 41.109 17.379 1.00 0.00 H
+ATOM 2842 N HIS C 51 29.400 37.686 19.415 1.00 39.36 N
+ATOM 2843 CA HIS C 51 29.958 36.358 19.617 1.00 40.36 C
+ATOM 2844 C HIS C 51 28.967 35.231 19.306 1.00 39.51 C
+ATOM 2845 O HIS C 51 29.380 34.079 19.198 1.00 41.95 O
+ATOM 2846 CB HIS C 51 30.469 36.211 21.057 1.00 41.61 C
+ATOM 2847 CG HIS C 51 31.608 37.136 21.385 1.00 39.04 C
+ATOM 2848 ND1 HIS C 51 31.417 38.451 21.746 1.00 42.30 N
+ATOM 2849 CD2 HIS C 51 32.946 36.929 21.408 1.00 31.92 C
+ATOM 2850 CE1 HIS C 51 32.590 39.019 21.964 1.00 40.69 C
+ATOM 2851 NE2 HIS C 51 33.534 38.117 21.772 1.00 37.75 N
+ATOM 2852 H HIS C 51 28.651 37.999 20.027 1.00 0.00 H
+ATOM 2853 HA HIS C 51 30.811 36.228 18.953 1.00 0.00 H
+ATOM 2854 1HB HIS C 51 29.653 36.414 21.756 1.00 0.00 H
+ATOM 2855 2HB HIS C 51 30.796 35.185 21.224 1.00 0.00 H
+ATOM 2856 HD2 HIS C 51 33.463 35.997 21.180 1.00 0.00 H
+ATOM 2857 HE1 HIS C 51 32.747 40.059 22.256 1.00 0.00 H
+ATOM 2858 HE2 HIS C 51 34.529 38.269 21.870 1.00 0.00 H
+ATOM 2859 N THR C 52 27.674 35.559 19.150 1.00 39.16 N
+ATOM 2860 CA THR C 52 26.628 34.550 18.879 1.00 38.46 C
+ATOM 2861 C THR C 52 25.925 34.793 17.546 1.00 35.80 C
+ATOM 2862 O THR C 52 25.248 35.812 17.376 1.00 31.58 O
+ATOM 2863 CB THR C 52 25.518 34.541 19.960 1.00 35.82 C
+ATOM 2864 OG1 THR C 52 26.074 34.263 21.248 1.00 31.10 O
+ATOM 2865 CG2 THR C 52 24.443 33.478 19.618 1.00 42.66 C
+ATOM 2866 H THR C 52 27.417 36.533 19.227 1.00 0.00 H
+ATOM 2867 HA THR C 52 27.097 33.567 18.841 1.00 0.00 H
+ATOM 2868 HB THR C 52 25.040 35.519 19.991 1.00 0.00 H
+ATOM 2869 HG1 THR C 52 26.635 34.991 21.525 1.00 0.00 H
+ATOM 2870 1HG2 THR C 52 23.662 33.485 20.376 1.00 0.00 H
+ATOM 2871 2HG2 THR C 52 24.000 33.699 18.647 1.00 0.00 H
+ATOM 2872 3HG2 THR C 52 24.905 32.489 19.585 1.00 0.00 H
+ATOM 2873 N SER C 53 26.026 33.829 16.628 1.00 35.13 N
+ATOM 2874 CA SER C 53 25.396 33.966 15.311 1.00 38.19 C
+ATOM 2875 C SER C 53 24.146 33.116 15.182 1.00 38.45 C
+ATOM 2876 O SER C 53 23.344 33.303 14.263 1.00 38.29 O
+ATOM 2877 CB SER C 53 26.342 33.601 14.198 1.00 37.14 C
+ATOM 2878 OG SER C 53 26.741 32.269 14.283 1.00 33.11 O
+ATOM 2879 H SER C 53 26.556 32.989 16.862 1.00 0.00 H
+ATOM 2880 HA SER C 53 25.102 35.007 15.177 1.00 0.00 H
+ATOM 2881 1HB SER C 53 25.832 33.765 13.253 1.00 0.00 H
+ATOM 2882 2HB SER C 53 27.198 34.246 14.216 1.00 0.00 H
+ATOM 2883 HG SER C 53 25.966 31.778 14.569 1.00 0.00 H
+ATOM 2884 N ALA C 54 23.979 32.172 16.098 1.00 35.83 N
+ATOM 2885 CA ALA C 54 22.795 31.332 16.026 1.00 39.38 C
+ATOM 2886 C ALA C 54 22.359 30.881 17.407 1.00 39.83 C
+ATOM 2887 O ALA C 54 23.170 30.728 18.324 1.00 38.55 O
+ATOM 2888 CB ALA C 54 23.034 30.137 15.117 1.00 28.30 C
+ATOM 2889 H ALA C 54 24.683 32.029 16.820 1.00 0.00 H
+ATOM 2890 HA ALA C 54 21.989 31.924 15.607 1.00 0.00 H
+ATOM 2891 1HB ALA C 54 22.118 29.552 15.059 1.00 0.00 H
+ATOM 2892 2HB ALA C 54 23.304 30.491 14.125 1.00 0.00 H
+ATOM 2893 3HB ALA C 54 23.818 29.524 15.489 1.00 0.00 H
+ATOM 2894 N ILE C 55 21.057 30.645 17.524 1.00 38.20 N
+ATOM 2895 CA ILE C 55 20.447 30.148 18.743 1.00 39.77 C
+ATOM 2896 C ILE C 55 19.745 28.819 18.490 1.00 40.03 C
+ATOM 2897 O ILE C 55 18.910 28.697 17.593 1.00 36.79 O
+ATOM 2898 CB ILE C 55 19.451 31.181 19.319 1.00 39.02 C
+ATOM 2899 CG1 ILE C 55 20.203 32.500 19.678 1.00 25.11 C
+ATOM 2900 CG2 ILE C 55 18.746 30.603 20.531 1.00 29.36 C
+ATOM 2901 CD1 ILE C 55 19.290 33.663 20.052 1.00 19.94 C
+ATOM 2902 H ILE C 55 20.471 30.798 16.709 1.00 0.00 H
+ATOM 2903 HA ILE C 55 21.228 29.984 19.481 1.00 0.00 H
+ATOM 2904 HB ILE C 55 18.711 31.429 18.558 1.00 0.00 H
+ATOM 2905 1HG1 ILE C 55 20.875 32.301 20.513 1.00 0.00 H
+ATOM 2906 2HG1 ILE C 55 20.799 32.807 18.826 1.00 0.00 H
+ATOM 2907 1HG2 ILE C 55 18.041 31.331 20.925 1.00 0.00 H
+ATOM 2908 2HG2 ILE C 55 18.210 29.697 20.247 1.00 0.00 H
+ATOM 2909 3HG2 ILE C 55 19.489 30.362 21.291 1.00 0.00 H
+ATOM 2910 1HD1 ILE C 55 19.894 34.545 20.284 1.00 0.00 H
+ATOM 2911 2HD1 ILE C 55 18.626 33.892 19.218 1.00 0.00 H
+ATOM 2912 3HD1 ILE C 55 18.695 33.395 20.924 1.00 0.00 H
+ATOM 2913 N LYS C 56 20.094 27.812 19.267 1.00 40.35 N
+ATOM 2914 CA LYS C 56 19.498 26.494 19.108 1.00 43.44 C
+ATOM 2915 C LYS C 56 18.671 26.157 20.337 1.00 44.14 C
+ATOM 2916 O LYS C 56 19.110 26.379 21.461 1.00 42.08 O
+ATOM 2917 CB LYS C 56 20.591 25.467 18.839 1.00 34.94 C
+ATOM 2918 CG LYS C 56 20.157 24.052 18.622 1.00 37.03 C
+ATOM 2919 CD LYS C 56 21.393 23.206 18.361 1.00 44.36 C
+ATOM 2920 CE LYS C 56 21.069 21.748 18.156 1.00 59.05 C
+ATOM 2921 NZ LYS C 56 22.299 20.963 17.880 1.00 56.61 N
+ATOM 2922 H LYS C 56 20.799 27.967 19.986 1.00 0.00 H
+ATOM 2923 HA LYS C 56 18.828 26.510 18.255 1.00 0.00 H
+ATOM 2924 1HB LYS C 56 21.123 25.762 17.942 1.00 0.00 H
+ATOM 2925 2HB LYS C 56 21.298 25.470 19.633 1.00 0.00 H
+ATOM 2926 1HG LYS C 56 19.623 23.674 19.495 1.00 0.00 H
+ATOM 2927 2HG LYS C 56 19.492 24.004 17.753 1.00 0.00 H
+ATOM 2928 1HD LYS C 56 21.903 23.575 17.465 1.00 0.00 H
+ATOM 2929 2HD LYS C 56 22.077 23.294 19.206 1.00 0.00 H
+ATOM 2930 1HE LYS C 56 20.580 21.347 19.044 1.00 0.00 H
+ATOM 2931 2HE LYS C 56 20.401 21.652 17.324 1.00 0.00 H
+ATOM 2932 1HZ LYS C 56 22.067 19.989 17.725 1.00 0.00 H
+ATOM 2933 2HZ LYS C 56 22.769 21.332 17.055 1.00 0.00 H
+ATOM 2934 3HZ LYS C 56 22.923 21.038 18.654 1.00 0.00 H
+ATOM 2935 N VAL C 57 17.448 25.682 20.136 1.00 45.58 N
+ATOM 2936 CA VAL C 57 16.602 25.390 21.278 1.00 48.41 C
+ATOM 2937 C VAL C 57 16.236 23.914 21.346 1.00 48.65 C
+ATOM 2938 O VAL C 57 15.723 23.322 20.382 1.00 50.27 O
+ATOM 2939 CB VAL C 57 15.326 26.243 21.232 1.00 48.46 C
+ATOM 2940 CG1 VAL C 57 14.460 25.950 22.474 1.00 29.48 C
+ATOM 2941 CG2 VAL C 57 15.712 27.699 21.139 1.00 37.55 C
+ATOM 2942 H VAL C 57 17.114 25.532 19.191 1.00 0.00 H
+ATOM 2943 HA VAL C 57 17.143 25.647 22.189 1.00 0.00 H
+ATOM 2944 HB VAL C 57 14.739 25.970 20.357 1.00 0.00 H
+ATOM 2945 1HG1 VAL C 57 13.552 26.544 22.441 1.00 0.00 H
+ATOM 2946 2HG1 VAL C 57 14.191 24.891 22.498 1.00 0.00 H
+ATOM 2947 3HG1 VAL C 57 15.021 26.198 23.375 1.00 0.00 H
+ATOM 2948 1HG2 VAL C 57 14.814 28.310 21.096 1.00 0.00 H
+ATOM 2949 2HG2 VAL C 57 16.299 27.956 22.009 1.00 0.00 H
+ATOM 2950 3HG2 VAL C 57 16.304 27.867 20.238 1.00 0.00 H
+ATOM 2951 N ARG C 58 16.523 23.326 22.503 1.00 48.79 N
+ATOM 2952 CA ARG C 58 16.274 21.925 22.805 1.00 48.92 C
+ATOM 2953 C ARG C 58 15.303 21.764 23.974 1.00 48.15 C
+ATOM 2954 O ARG C 58 15.454 22.388 25.027 1.00 47.10 O
+ATOM 2955 CB ARG C 58 17.596 21.253 23.124 1.00 49.41 C
+ATOM 2956 CG ARG C 58 17.521 19.822 23.568 1.00 66.71 C
+ATOM 2957 CD ARG C 58 18.875 19.295 23.837 1.00 74.53 C
+ATOM 2958 NE ARG C 58 19.629 19.121 22.617 1.00 80.47 N
+ATOM 2959 CZ ARG C 58 20.946 18.877 22.544 1.00 79.66 C
+ATOM 2960 NH1 ARG C 58 21.683 18.789 23.631 1.00 77.54 N
+ATOM 2961 NH2 ARG C 58 21.478 18.724 21.355 1.00 79.86 N
+ATOM 2962 H ARG C 58 16.970 23.889 23.226 1.00 0.00 H
+ATOM 2963 HA ARG C 58 15.840 21.456 21.922 1.00 0.00 H
+ATOM 2964 1HB ARG C 58 18.229 21.279 22.232 1.00 0.00 H
+ATOM 2965 2HB ARG C 58 18.107 21.817 23.896 1.00 0.00 H
+ATOM 2966 1HG ARG C 58 16.927 19.745 24.480 1.00 0.00 H
+ATOM 2967 2HG ARG C 58 17.067 19.219 22.776 1.00 0.00 H
+ATOM 2968 1HD ARG C 58 19.412 20.006 24.468 1.00 0.00 H
+ATOM 2969 2HD ARG C 58 18.813 18.334 24.343 1.00 0.00 H
+ATOM 2970 HE ARG C 58 19.127 19.182 21.722 1.00 0.00 H
+ATOM 2971 1HH1 ARG C 58 21.259 18.906 24.539 1.00 0.00 H
+ATOM 2972 2HH1 ARG C 58 22.671 18.603 23.554 1.00 0.00 H
+ATOM 2973 1HH2 ARG C 58 20.858 18.785 20.543 1.00 0.00 H
+ATOM 2974 2HH2 ARG C 58 22.458 18.534 21.251 1.00 0.00 H
+ATOM 2975 N GLY C 59 14.305 20.913 23.814 1.00 47.87 N
+ATOM 2976 CA GLY C 59 13.292 20.738 24.855 1.00 48.38 C
+ATOM 2977 C GLY C 59 12.060 21.484 24.398 1.00 48.06 C
+ATOM 2978 O GLY C 59 12.159 22.328 23.511 1.00 49.66 O
+ATOM 2979 H GLY C 59 14.213 20.399 22.941 1.00 0.00 H
+ATOM 2980 1HA GLY C 59 13.073 19.680 24.996 1.00 0.00 H
+ATOM 2981 2HA GLY C 59 13.643 21.135 25.799 1.00 0.00 H
+ATOM 2982 N LYS C 60 10.913 21.153 24.944 1.00 48.30 N
+ATOM 2983 CA LYS C 60 9.682 21.785 24.492 1.00 46.34 C
+ATOM 2984 C LYS C 60 9.674 23.259 24.888 1.00 46.84 C
+ATOM 2985 O LYS C 60 9.889 23.585 26.063 1.00 43.99 O
+ATOM 2986 CB LYS C 60 8.460 21.060 25.030 1.00 46.02 C
+ATOM 2987 CG LYS C 60 7.164 21.386 24.308 1.00 41.19 C
+ATOM 2988 CD LYS C 60 5.990 20.621 24.899 1.00 58.47 C
+ATOM 2989 CE LYS C 60 4.780 20.614 23.951 1.00 55.85 C
+ATOM 2990 NZ LYS C 60 4.254 21.964 23.676 1.00 57.57 N
+ATOM 2991 H LYS C 60 10.871 20.438 25.681 1.00 0.00 H
+ATOM 2992 HA LYS C 60 9.667 21.750 23.414 1.00 0.00 H
+ATOM 2993 1HB LYS C 60 8.622 19.984 24.980 1.00 0.00 H
+ATOM 2994 2HB LYS C 60 8.315 21.314 26.084 1.00 0.00 H
+ATOM 2995 1HG LYS C 60 6.979 22.448 24.354 1.00 0.00 H
+ATOM 2996 2HG LYS C 60 7.271 21.112 23.256 1.00 0.00 H
+ATOM 2997 1HD LYS C 60 6.295 19.587 25.086 1.00 0.00 H
+ATOM 2998 2HD LYS C 60 5.702 21.072 25.851 1.00 0.00 H
+ATOM 2999 1HE LYS C 60 5.079 20.154 23.008 1.00 0.00 H
+ATOM 3000 2HE LYS C 60 3.990 20.017 24.400 1.00 0.00 H
+ATOM 3001 1HZ LYS C 60 3.460 21.908 23.048 1.00 0.00 H
+ATOM 3002 2HZ LYS C 60 3.962 22.400 24.534 1.00 0.00 H
+ATOM 3003 3HZ LYS C 60 4.991 22.514 23.239 1.00 0.00 H
+ATOM 3004 N ALA C 61 9.411 24.148 23.931 1.00 46.44 N
+ATOM 3005 CA ALA C 61 9.412 25.577 24.257 1.00 43.34 C
+ATOM 3006 C ALA C 61 8.592 26.394 23.259 1.00 43.81 C
+ATOM 3007 O ALA C 61 8.524 26.066 22.075 1.00 44.14 O
+ATOM 3008 CB ALA C 61 10.822 26.127 24.300 1.00 35.62 C
+ATOM 3009 H ALA C 61 9.217 23.811 22.996 1.00 0.00 H
+ATOM 3010 HA ALA C 61 8.976 25.695 25.238 1.00 0.00 H
+ATOM 3011 1HB ALA C 61 10.794 27.178 24.587 1.00 0.00 H
+ATOM 3012 2HB ALA C 61 11.395 25.568 25.025 1.00 0.00 H
+ATOM 3013 3HB ALA C 61 11.289 26.038 23.325 1.00 0.00 H
+ATOM 3014 N TYR C 62 8.035 27.499 23.733 1.00 42.69 N
+ATOM 3015 CA TYR C 62 7.342 28.424 22.835 1.00 41.40 C
+ATOM 3016 C TYR C 62 8.332 29.476 22.399 1.00 42.17 C
+ATOM 3017 O TYR C 62 8.943 30.142 23.236 1.00 43.56 O
+ATOM 3018 CB TYR C 62 6.122 29.042 23.520 1.00 39.53 C
+ATOM 3019 CG TYR C 62 5.342 30.036 22.681 1.00 36.48 C
+ATOM 3020 CD1 TYR C 62 4.591 29.612 21.588 1.00 35.38 C
+ATOM 3021 CD2 TYR C 62 5.340 31.369 23.038 1.00 35.55 C
+ATOM 3022 CE1 TYR C 62 3.848 30.528 20.866 1.00 36.14 C
+ATOM 3023 CE2 TYR C 62 4.597 32.278 22.325 1.00 36.57 C
+ATOM 3024 CZ TYR C 62 3.852 31.864 21.246 1.00 39.16 C
+ATOM 3025 OH TYR C 62 3.091 32.772 20.557 1.00 45.76 O
+ATOM 3026 H TYR C 62 8.132 27.713 24.720 1.00 0.00 H
+ATOM 3027 HA TYR C 62 7.013 27.886 21.950 1.00 0.00 H
+ATOM 3028 1HB TYR C 62 5.440 28.259 23.823 1.00 0.00 H
+ATOM 3029 2HB TYR C 62 6.437 29.549 24.414 1.00 0.00 H
+ATOM 3030 HD1 TYR C 62 4.580 28.562 21.307 1.00 0.00 H
+ATOM 3031 HD2 TYR C 62 5.918 31.691 23.893 1.00 0.00 H
+ATOM 3032 HE1 TYR C 62 3.252 30.197 20.014 1.00 0.00 H
+ATOM 3033 HE2 TYR C 62 4.591 33.325 22.622 1.00 0.00 H
+ATOM 3034 HH TYR C 62 3.040 33.590 21.057 1.00 0.00 H
+ATOM 3035 N ILE C 63 8.534 29.608 21.091 1.00 39.49 N
+ATOM 3036 CA ILE C 63 9.540 30.526 20.599 1.00 39.77 C
+ATOM 3037 C ILE C 63 8.932 31.628 19.722 1.00 38.49 C
+ATOM 3038 O ILE C 63 8.171 31.356 18.791 1.00 40.08 O
+ATOM 3039 CB ILE C 63 10.571 29.753 19.762 1.00 47.08 C
+ATOM 3040 CG1 ILE C 63 11.195 28.639 20.589 1.00 42.16 C
+ATOM 3041 CG2 ILE C 63 11.662 30.702 19.292 1.00 39.85 C
+ATOM 3042 CD1 ILE C 63 11.996 27.681 19.760 1.00 34.45 C
+ATOM 3043 H ILE C 63 8.023 29.038 20.423 1.00 0.00 H
+ATOM 3044 HA ILE C 63 10.039 30.983 21.439 1.00 0.00 H
+ATOM 3045 HB ILE C 63 10.086 29.305 18.921 1.00 0.00 H
+ATOM 3046 1HG1 ILE C 63 11.829 29.068 21.344 1.00 0.00 H
+ATOM 3047 2HG1 ILE C 63 10.407 28.070 21.080 1.00 0.00 H
+ATOM 3048 1HG2 ILE C 63 12.374 30.142 18.710 1.00 0.00 H
+ATOM 3049 2HG2 ILE C 63 11.230 31.487 18.680 1.00 0.00 H
+ATOM 3050 3HG2 ILE C 63 12.158 31.148 20.151 1.00 0.00 H
+ATOM 3051 1HD1 ILE C 63 12.405 26.912 20.399 1.00 0.00 H
+ATOM 3052 2HD1 ILE C 63 11.350 27.222 19.008 1.00 0.00 H
+ATOM 3053 3HD1 ILE C 63 12.806 28.213 19.267 1.00 0.00 H
+ATOM 3054 N GLN C 64 9.276 32.878 20.019 1.00 37.97 N
+ATOM 3055 CA GLN C 64 8.800 33.981 19.198 1.00 38.05 C
+ATOM 3056 C GLN C 64 9.993 34.596 18.488 1.00 39.65 C
+ATOM 3057 O GLN C 64 11.021 34.867 19.113 1.00 39.82 O
+ATOM 3058 CB GLN C 64 8.142 35.070 20.043 1.00 30.64 C
+ATOM 3059 CG GLN C 64 7.005 34.607 20.938 1.00 35.74 C
+ATOM 3060 CD GLN C 64 6.404 35.744 21.746 1.00 46.43 C
+ATOM 3061 OE1 GLN C 64 7.090 36.424 22.510 1.00 45.64 O
+ATOM 3062 NE2 GLN C 64 5.109 35.952 21.574 1.00 44.38 N
+ATOM 3063 H GLN C 64 9.876 33.053 20.814 1.00 0.00 H
+ATOM 3064 HA GLN C 64 8.109 33.609 18.450 1.00 0.00 H
+ATOM 3065 1HB GLN C 64 8.881 35.594 20.603 1.00 0.00 H
+ATOM 3066 2HB GLN C 64 7.707 35.798 19.363 1.00 0.00 H
+ATOM 3067 1HG GLN C 64 6.225 34.162 20.337 1.00 0.00 H
+ATOM 3068 2HG GLN C 64 7.400 33.867 21.641 1.00 0.00 H
+ATOM 3069 1HE2 GLN C 64 4.644 36.682 22.080 1.00 0.00 H
+ATOM 3070 2HE2 GLN C 64 4.592 35.388 20.930 1.00 0.00 H
+ATOM 3071 N THR C 65 9.855 34.838 17.189 1.00 40.44 N
+ATOM 3072 CA THR C 65 10.921 35.475 16.435 1.00 38.31 C
+ATOM 3073 C THR C 65 10.311 36.570 15.570 1.00 39.50 C
+ATOM 3074 O THR C 65 9.094 36.713 15.476 1.00 40.57 O
+ATOM 3075 CB THR C 65 11.656 34.498 15.491 1.00 41.51 C
+ATOM 3076 OG1 THR C 65 10.815 34.201 14.374 1.00 36.87 O
+ATOM 3077 CG2 THR C 65 11.987 33.192 16.212 1.00 29.54 C
+ATOM 3078 H THR C 65 9.001 34.572 16.706 1.00 0.00 H
+ATOM 3079 HA THR C 65 11.636 35.932 17.115 1.00 0.00 H
+ATOM 3080 HB THR C 65 12.578 34.950 15.152 1.00 0.00 H
+ATOM 3081 HG1 THR C 65 9.960 33.868 14.705 1.00 0.00 H
+ATOM 3082 1HG2 THR C 65 12.502 32.520 15.529 1.00 0.00 H
+ATOM 3083 2HG2 THR C 65 12.624 33.394 17.072 1.00 0.00 H
+ATOM 3084 3HG2 THR C 65 11.066 32.720 16.547 1.00 0.00 H
+ATOM 3085 N ARG C 66 11.162 37.289 14.870 1.00 38.71 N
+ATOM 3086 CA ARG C 66 10.713 38.315 13.944 1.00 38.26 C
+ATOM 3087 C ARG C 66 9.819 37.765 12.824 1.00 41.69 C
+ATOM 3088 O ARG C 66 9.088 38.523 12.190 1.00 41.39 O
+ATOM 3089 CB ARG C 66 11.889 39.048 13.324 1.00 44.82 C
+ATOM 3090 CG ARG C 66 11.498 40.304 12.568 1.00 58.03 C
+ATOM 3091 CD ARG C 66 12.671 41.087 12.123 1.00 73.64 C
+ATOM 3092 NE ARG C 66 12.262 42.328 11.459 1.00 83.43 N
+ATOM 3093 CZ ARG C 66 12.011 42.452 10.145 1.00 88.31 C
+ATOM 3094 NH1 ARG C 66 12.146 41.417 9.361 1.00 82.32 N
+ATOM 3095 NH2 ARG C 66 11.632 43.618 9.643 1.00 82.28 N
+ATOM 3096 H ARG C 66 12.150 37.132 14.993 1.00 0.00 H
+ATOM 3097 HA ARG C 66 10.127 39.041 14.508 1.00 0.00 H
+ATOM 3098 1HB ARG C 66 12.631 39.302 14.080 1.00 0.00 H
+ATOM 3099 2HB ARG C 66 12.363 38.388 12.596 1.00 0.00 H
+ATOM 3100 1HG ARG C 66 10.910 40.036 11.690 1.00 0.00 H
+ATOM 3101 2HG ARG C 66 10.905 40.940 13.227 1.00 0.00 H
+ATOM 3102 1HD ARG C 66 13.279 41.352 12.996 1.00 0.00 H
+ATOM 3103 2HD ARG C 66 13.269 40.502 11.423 1.00 0.00 H
+ATOM 3104 HE ARG C 66 12.149 43.144 12.035 1.00 0.00 H
+ATOM 3105 1HH1 ARG C 66 12.441 40.533 9.750 1.00 0.00 H
+ATOM 3106 2HH1 ARG C 66 11.958 41.503 8.376 1.00 0.00 H
+ATOM 3107 1HH2 ARG C 66 11.525 44.422 10.247 1.00 0.00 H
+ATOM 3108 2HH2 ARG C 66 11.446 43.703 8.656 1.00 0.00 H
+ATOM 3109 N HIS C 67 9.916 36.456 12.532 1.00 40.86 N
+ATOM 3110 CA HIS C 67 9.187 35.893 11.406 1.00 41.31 C
+ATOM 3111 C HIS C 67 7.905 35.179 11.841 1.00 42.91 C
+ATOM 3112 O HIS C 67 7.296 34.456 11.048 1.00 45.91 O
+ATOM 3113 CB HIS C 67 10.059 34.873 10.665 1.00 34.66 C
+ATOM 3114 CG HIS C 67 11.351 35.425 10.190 1.00 30.35 C
+ATOM 3115 ND1 HIS C 67 11.478 36.691 9.658 1.00 33.12 N
+ATOM 3116 CD2 HIS C 67 12.575 34.869 10.144 1.00 28.68 C
+ATOM 3117 CE1 HIS C 67 12.739 36.889 9.331 1.00 33.65 C
+ATOM 3118 NE2 HIS C 67 13.418 35.797 9.604 1.00 42.05 N
+ATOM 3119 H HIS C 67 10.476 35.835 13.110 1.00 0.00 H
+ATOM 3120 HA HIS C 67 8.914 36.684 10.712 1.00 0.00 H
+ATOM 3121 1HB HIS C 67 10.268 34.024 11.322 1.00 0.00 H
+ATOM 3122 2HB HIS C 67 9.518 34.492 9.798 1.00 0.00 H
+ATOM 3123 HD2 HIS C 67 12.846 33.864 10.469 1.00 0.00 H
+ATOM 3124 HE1 HIS C 67 13.146 37.795 8.896 1.00 0.00 H
+ATOM 3125 HE2 HIS C 67 14.413 35.642 9.439 1.00 0.00 H
+ATOM 3126 N GLY C 68 7.498 35.361 13.097 1.00 41.76 N
+ATOM 3127 CA GLY C 68 6.308 34.679 13.605 1.00 39.71 C
+ATOM 3128 C GLY C 68 6.695 33.780 14.768 1.00 41.27 C
+ATOM 3129 O GLY C 68 7.709 34.016 15.424 1.00 42.17 O
+ATOM 3130 H GLY C 68 8.024 35.973 13.721 1.00 0.00 H
+ATOM 3131 1HA GLY C 68 5.574 35.414 13.932 1.00 0.00 H
+ATOM 3132 2HA GLY C 68 5.852 34.087 12.813 1.00 0.00 H
+ATOM 3133 N VAL C 69 5.879 32.767 15.051 1.00 40.83 N
+ATOM 3134 CA VAL C 69 6.182 31.925 16.204 1.00 41.76 C
+ATOM 3135 C VAL C 69 6.340 30.471 15.792 1.00 42.52 C
+ATOM 3136 O VAL C 69 5.902 30.067 14.711 1.00 43.09 O
+ATOM 3137 CB VAL C 69 5.074 32.042 17.267 1.00 43.48 C
+ATOM 3138 CG1 VAL C 69 4.950 33.495 17.714 1.00 26.57 C
+ATOM 3139 CG2 VAL C 69 3.764 31.517 16.716 1.00 35.18 C
+ATOM 3140 H VAL C 69 5.060 32.592 14.489 1.00 0.00 H
+ATOM 3141 HA VAL C 69 7.119 32.255 16.646 1.00 0.00 H
+ATOM 3142 HB VAL C 69 5.362 31.454 18.143 1.00 0.00 H
+ATOM 3143 1HG1 VAL C 69 4.191 33.579 18.483 1.00 0.00 H
+ATOM 3144 2HG1 VAL C 69 5.893 33.832 18.103 1.00 0.00 H
+ATOM 3145 3HG1 VAL C 69 4.671 34.118 16.869 1.00 0.00 H
+ATOM 3146 1HG2 VAL C 69 2.994 31.591 17.485 1.00 0.00 H
+ATOM 3147 2HG2 VAL C 69 3.468 32.103 15.847 1.00 0.00 H
+ATOM 3148 3HG2 VAL C 69 3.889 30.471 16.427 1.00 0.00 H
+ATOM 3149 N ILE C 70 7.005 29.703 16.648 1.00 43.31 N
+ATOM 3150 CA ILE C 70 7.229 28.285 16.406 1.00 43.11 C
+ATOM 3151 C ILE C 70 7.410 27.561 17.741 1.00 46.44 C
+ATOM 3152 O ILE C 70 7.850 28.167 18.714 1.00 46.93 O
+ATOM 3153 CB ILE C 70 8.462 28.098 15.490 1.00 41.28 C
+ATOM 3154 CG1 ILE C 70 8.538 26.679 14.948 1.00 43.43 C
+ATOM 3155 CG2 ILE C 70 9.733 28.425 16.268 1.00 32.04 C
+ATOM 3156 CD1 ILE C 70 9.471 26.562 13.768 1.00 35.70 C
+ATOM 3157 H ILE C 70 7.365 30.130 17.498 1.00 0.00 H
+ATOM 3158 HA ILE C 70 6.355 27.871 15.906 1.00 0.00 H
+ATOM 3159 HB ILE C 70 8.385 28.767 14.637 1.00 0.00 H
+ATOM 3160 1HG1 ILE C 70 8.891 26.004 15.731 1.00 0.00 H
+ATOM 3161 2HG1 ILE C 70 7.543 26.362 14.636 1.00 0.00 H
+ATOM 3162 1HG2 ILE C 70 10.597 28.306 15.627 1.00 0.00 H
+ATOM 3163 2HG2 ILE C 70 9.683 29.454 16.624 1.00 0.00 H
+ATOM 3164 3HG2 ILE C 70 9.814 27.743 17.115 1.00 0.00 H
+ATOM 3165 1HD1 ILE C 70 9.467 25.543 13.416 1.00 0.00 H
+ATOM 3166 2HD1 ILE C 70 9.126 27.217 12.967 1.00 0.00 H
+ATOM 3167 3HD1 ILE C 70 10.475 26.852 14.063 1.00 0.00 H
+ATOM 3168 N GLU C 71 7.053 26.284 17.809 1.00 45.83 N
+ATOM 3169 CA GLU C 71 7.316 25.542 19.041 1.00 43.92 C
+ATOM 3170 C GLU C 71 8.360 24.455 18.835 1.00 45.49 C
+ATOM 3171 O GLU C 71 8.327 23.727 17.834 1.00 44.53 O
+ATOM 3172 CB GLU C 71 6.032 24.905 19.602 1.00 35.87 C
+ATOM 3173 CG GLU C 71 4.987 25.902 20.113 1.00 44.07 C
+ATOM 3174 CD GLU C 71 3.730 25.248 20.689 1.00 52.30 C
+ATOM 3175 OE1 GLU C 71 3.833 24.195 21.293 1.00 52.96 O
+ATOM 3176 OE2 GLU C 71 2.673 25.807 20.521 1.00 51.78 O
+ATOM 3177 H GLU C 71 6.650 25.826 17.006 1.00 0.00 H
+ATOM 3178 HA GLU C 71 7.705 26.234 19.787 1.00 0.00 H
+ATOM 3179 1HB GLU C 71 5.563 24.290 18.833 1.00 0.00 H
+ATOM 3180 2HB GLU C 71 6.298 24.245 20.432 1.00 0.00 H
+ATOM 3181 1HG GLU C 71 5.452 26.483 20.901 1.00 0.00 H
+ATOM 3182 2HG GLU C 71 4.712 26.582 19.310 1.00 0.00 H
+ATOM 3183 N SER C 72 9.272 24.343 19.800 1.00 42.20 N
+ATOM 3184 CA SER C 72 10.291 23.293 19.805 1.00 44.59 C
+ATOM 3185 C SER C 72 9.738 22.135 20.609 1.00 47.43 C
+ATOM 3186 O SER C 72 8.762 22.327 21.339 1.00 45.56 O
+ATOM 3187 CB SER C 72 11.594 23.810 20.381 1.00 41.99 C
+ATOM 3188 OG SER C 72 11.459 24.121 21.731 1.00 42.26 O
+ATOM 3189 H SER C 72 9.216 24.989 20.584 1.00 0.00 H
+ATOM 3190 HA SER C 72 10.470 22.949 18.785 1.00 0.00 H
+ATOM 3191 1HB SER C 72 12.387 23.066 20.244 1.00 0.00 H
+ATOM 3192 2HB SER C 72 11.885 24.698 19.840 1.00 0.00 H
+ATOM 3193 HG SER C 72 11.627 23.300 22.231 1.00 0.00 H
+ATOM 3194 N GLU C 73 10.356 20.957 20.506 1.00 49.46 N
+ATOM 3195 CA GLU C 73 9.874 19.777 21.233 1.00 53.46 C
+ATOM 3196 C GLU C 73 10.972 19.048 22.018 1.00 56.19 C
+ATOM 3197 O GLU C 73 12.164 19.223 21.769 1.00 55.05 O
+ATOM 3198 CB GLU C 73 9.194 18.809 20.266 1.00 56.84 C
+ATOM 3199 CG GLU C 73 7.987 19.405 19.547 1.00 67.74 C
+ATOM 3200 CD GLU C 73 7.334 18.467 18.583 1.00 79.50 C
+ATOM 3201 OE1 GLU C 73 7.152 17.319 18.917 1.00 89.37 O
+ATOM 3202 OE2 GLU C 73 7.025 18.906 17.488 1.00 76.90 O
+ATOM 3203 H GLU C 73 11.163 20.875 19.889 1.00 0.00 H
+ATOM 3204 HA GLU C 73 9.121 20.103 21.946 1.00 0.00 H
+ATOM 3205 1HB GLU C 73 9.894 18.486 19.522 1.00 0.00 H
+ATOM 3206 2HB GLU C 73 8.864 17.922 20.807 1.00 0.00 H
+ATOM 3207 1HG GLU C 73 7.255 19.716 20.295 1.00 0.00 H
+ATOM 3208 2HG GLU C 73 8.306 20.293 19.005 1.00 0.00 H
+ATOM 3209 N GLY C 74 10.548 18.261 23.005 1.00 59.34 N
+ATOM 3210 CA GLY C 74 11.476 17.473 23.810 1.00 64.50 C
+ATOM 3211 C GLY C 74 11.520 16.015 23.380 1.00 69.16 C
+ATOM 3212 O GLY C 74 11.056 15.679 22.292 1.00 69.08 O
+ATOM 3213 H GLY C 74 9.559 18.181 23.179 1.00 0.00 H
+ATOM 3214 1HA GLY C 74 12.476 17.893 23.721 1.00 0.00 H
+ATOM 3215 2HA GLY C 74 11.192 17.532 24.860 1.00 0.00 H
+ATOM 3216 N LYS C 75 12.059 15.174 24.267 1.00 72.76 N
+ATOM 3217 CA LYS C 75 12.243 13.739 24.047 1.00 75.35 C
+ATOM 3218 C LYS C 75 13.261 13.500 22.935 1.00 76.88 C
+ATOM 3219 O LYS C 75 14.196 14.274 22.801 1.00 78.56 O
+ATOM 3220 OXT LYS C 75 13.360 12.376 22.474 1.00 0.00 O
+ATOM 3221 CB LYS C 75 10.906 13.044 23.742 1.00 74.42 C
+ATOM 3222 CG LYS C 75 10.990 11.518 23.620 1.00 76.10 C
+ATOM 3223 CD LYS C 75 9.606 10.894 23.429 1.00 76.24 C
+ATOM 3224 CE LYS C 75 9.698 9.377 23.310 1.00 66.64 C
+ATOM 3225 NZ LYS C 75 8.357 8.744 23.121 1.00 0.00 N
+ATOM 3226 H LYS C 75 12.382 15.562 25.140 1.00 0.00 H
+ATOM 3227 HA LYS C 75 12.652 13.301 24.958 1.00 0.00 H
+ATOM 3228 1HB LYS C 75 10.186 13.283 24.524 1.00 0.00 H
+ATOM 3229 2HB LYS C 75 10.496 13.405 22.802 1.00 0.00 H
+ATOM 3230 1HG LYS C 75 11.610 11.258 22.761 1.00 0.00 H
+ATOM 3231 2HG LYS C 75 11.451 11.102 24.516 1.00 0.00 H
+ATOM 3232 1HD LYS C 75 8.970 11.150 24.279 1.00 0.00 H
+ATOM 3233 2HD LYS C 75 9.151 11.294 22.524 1.00 0.00 H
+ATOM 3234 1HE LYS C 75 10.332 9.129 22.462 1.00 0.00 H
+ATOM 3235 2HE LYS C 75 10.152 8.980 24.219 1.00 0.00 H
+ATOM 3236 1HZ LYS C 75 8.465 7.741 23.048 1.00 0.00 H
+ATOM 3237 2HZ LYS C 75 7.765 8.961 23.912 1.00 0.00 H
+ATOM 3238 3HZ LYS C 75 7.932 9.098 22.277 1.00 0.00 H
+TER
+ATOM 3240 N SER D 7 21.063 42.301 10.345 1.00 43.46 N
+ATOM 3241 CA SER D 7 21.161 41.296 9.295 1.00 44.35 C
+ATOM 3242 C SER D 7 20.013 40.297 9.396 1.00 43.57 C
+ATOM 3243 O SER D 7 19.316 40.238 10.405 1.00 45.95 O
+ATOM 3244 CB SER D 7 22.481 40.565 9.404 1.00 44.62 C
+ATOM 3245 OG SER D 7 22.508 39.801 10.567 1.00 56.14 O
+ATOM 3246 1H SER D 7 21.187 43.220 9.949 1.00 0.00 H
+ATOM 3247 2H SER D 7 20.150 42.241 10.774 1.00 0.00 H
+ATOM 3248 3H SER D 7 21.772 42.134 11.042 1.00 0.00 H
+ATOM 3249 HA SER D 7 21.105 41.793 8.327 1.00 0.00 H
+ATOM 3250 1HB SER D 7 22.620 39.919 8.533 1.00 0.00 H
+ATOM 3251 2HB SER D 7 23.299 41.280 9.412 1.00 0.00 H
+ATOM 3252 HG SER D 7 21.788 39.169 10.468 1.00 0.00 H
+ATOM 3253 N ASP D 8 19.830 39.505 8.343 1.00 39.44 N
+ATOM 3254 CA ASP D 8 18.766 38.501 8.302 1.00 39.18 C
+ATOM 3255 C ASP D 8 19.118 37.196 8.987 1.00 38.63 C
+ATOM 3256 O ASP D 8 20.293 36.831 9.106 1.00 39.02 O
+ATOM 3257 CB ASP D 8 18.381 38.177 6.856 1.00 49.75 C
+ATOM 3258 CG ASP D 8 17.543 39.238 6.176 1.00 60.47 C
+ATOM 3259 OD1 ASP D 8 16.584 39.693 6.757 1.00 49.29 O
+ATOM 3260 OD2 ASP D 8 17.858 39.588 5.065 1.00 57.68 O
+ATOM 3261 H ASP D 8 20.437 39.596 7.545 1.00 0.00 H
+ATOM 3262 HA ASP D 8 17.894 38.916 8.802 1.00 0.00 H
+ATOM 3263 1HB ASP D 8 19.281 38.027 6.262 1.00 0.00 H
+ATOM 3264 2HB ASP D 8 17.823 37.233 6.835 1.00 0.00 H
+ATOM 3265 N PHE D 9 18.061 36.475 9.369 1.00 36.18 N
+ATOM 3266 CA PHE D 9 18.159 35.135 9.931 1.00 35.42 C
+ATOM 3267 C PHE D 9 17.000 34.293 9.458 1.00 32.78 C
+ATOM 3268 O PHE D 9 15.980 34.821 9.009 1.00 32.52 O
+ATOM 3269 CB PHE D 9 18.125 35.134 11.472 1.00 36.33 C
+ATOM 3270 CG PHE D 9 16.822 35.550 12.097 1.00 39.29 C
+ATOM 3271 CD1 PHE D 9 15.854 34.598 12.394 1.00 33.12 C
+ATOM 3272 CD2 PHE D 9 16.567 36.869 12.419 1.00 35.19 C
+ATOM 3273 CE1 PHE D 9 14.664 34.953 12.988 1.00 37.08 C
+ATOM 3274 CE2 PHE D 9 15.375 37.227 13.013 1.00 34.95 C
+ATOM 3275 CZ PHE D 9 14.425 36.265 13.295 1.00 38.34 C
+ATOM 3276 H PHE D 9 17.145 36.879 9.247 1.00 0.00 H
+ATOM 3277 HA PHE D 9 19.074 34.673 9.573 1.00 0.00 H
+ATOM 3278 1HB PHE D 9 18.351 34.136 11.835 1.00 0.00 H
+ATOM 3279 2HB PHE D 9 18.876 35.780 11.843 1.00 0.00 H
+ATOM 3280 HD1 PHE D 9 16.047 33.557 12.144 1.00 0.00 H
+ATOM 3281 HD2 PHE D 9 17.317 37.631 12.200 1.00 0.00 H
+ATOM 3282 HE1 PHE D 9 13.916 34.193 13.209 1.00 0.00 H
+ATOM 3283 HE2 PHE D 9 15.188 38.276 13.258 1.00 0.00 H
+ATOM 3284 HZ PHE D 9 13.499 36.548 13.753 1.00 0.00 H
+ATOM 3285 N VAL D 10 17.170 32.983 9.581 1.00 28.05 N
+ATOM 3286 CA VAL D 10 16.122 32.039 9.232 1.00 32.83 C
+ATOM 3287 C VAL D 10 15.900 31.064 10.389 1.00 34.11 C
+ATOM 3288 O VAL D 10 16.801 30.840 11.201 1.00 37.24 O
+ATOM 3289 CB VAL D 10 16.522 31.282 7.949 1.00 33.10 C
+ATOM 3290 CG1 VAL D 10 16.712 32.271 6.789 1.00 33.15 C
+ATOM 3291 CG2 VAL D 10 17.796 30.521 8.193 1.00 36.84 C
+ATOM 3292 H VAL D 10 18.063 32.651 9.933 1.00 0.00 H
+ATOM 3293 HA VAL D 10 15.195 32.581 9.050 1.00 0.00 H
+ATOM 3294 HB VAL D 10 15.723 30.589 7.679 1.00 0.00 H
+ATOM 3295 1HG1 VAL D 10 16.988 31.732 5.903 1.00 0.00 H
+ATOM 3296 2HG1 VAL D 10 15.787 32.817 6.615 1.00 0.00 H
+ATOM 3297 3HG1 VAL D 10 17.502 32.970 7.034 1.00 0.00 H
+ATOM 3298 1HG2 VAL D 10 18.071 29.975 7.287 1.00 0.00 H
+ATOM 3299 2HG2 VAL D 10 18.594 31.216 8.460 1.00 0.00 H
+ATOM 3300 3HG2 VAL D 10 17.639 29.827 9.009 1.00 0.00 H
+ATOM 3301 N VAL D 11 14.711 30.467 10.450 1.00 32.50 N
+ATOM 3302 CA VAL D 11 14.405 29.491 11.501 1.00 32.94 C
+ATOM 3303 C VAL D 11 14.189 28.112 10.897 1.00 34.25 C
+ATOM 3304 O VAL D 11 13.381 27.976 9.983 1.00 32.81 O
+ATOM 3305 CB VAL D 11 13.098 29.865 12.234 1.00 35.78 C
+ATOM 3306 CG1 VAL D 11 12.805 28.857 13.341 1.00 29.51 C
+ATOM 3307 CG2 VAL D 11 13.154 31.303 12.749 1.00 23.36 C
+ATOM 3308 H VAL D 11 13.999 30.714 9.767 1.00 0.00 H
+ATOM 3309 HA VAL D 11 15.231 29.446 12.207 1.00 0.00 H
+ATOM 3310 HB VAL D 11 12.292 29.773 11.548 1.00 0.00 H
+ATOM 3311 1HG1 VAL D 11 11.861 29.118 13.817 1.00 0.00 H
+ATOM 3312 2HG1 VAL D 11 12.732 27.857 12.916 1.00 0.00 H
+ATOM 3313 3HG1 VAL D 11 13.597 28.875 14.073 1.00 0.00 H
+ATOM 3314 1HG2 VAL D 11 12.205 31.547 13.236 1.00 0.00 H
+ATOM 3315 2HG2 VAL D 11 13.944 31.412 13.446 1.00 0.00 H
+ATOM 3316 3HG2 VAL D 11 13.317 31.984 11.914 1.00 0.00 H
+ATOM 3317 N ILE D 12 14.898 27.096 11.382 1.00 36.40 N
+ATOM 3318 CA ILE D 12 14.709 25.729 10.894 1.00 36.64 C
+ATOM 3319 C ILE D 12 14.284 24.768 12.000 1.00 38.51 C
+ATOM 3320 O ILE D 12 15.007 24.591 12.986 1.00 39.51 O
+ATOM 3321 CB ILE D 12 15.994 25.152 10.273 1.00 38.82 C
+ATOM 3322 CG1 ILE D 12 16.529 26.052 9.184 1.00 36.93 C
+ATOM 3323 CG2 ILE D 12 15.702 23.756 9.693 1.00 27.64 C
+ATOM 3324 CD1 ILE D 12 17.589 27.002 9.677 1.00 33.40 C
+ATOM 3325 H ILE D 12 15.575 27.275 12.119 1.00 0.00 H
+ATOM 3326 HA ILE D 12 13.921 25.737 10.139 1.00 0.00 H
+ATOM 3327 HB ILE D 12 16.765 25.070 11.042 1.00 0.00 H
+ATOM 3328 1HG1 ILE D 12 16.963 25.433 8.414 1.00 0.00 H
+ATOM 3329 2HG1 ILE D 12 15.713 26.627 8.751 1.00 0.00 H
+ATOM 3330 1HG2 ILE D 12 16.603 23.336 9.264 1.00 0.00 H
+ATOM 3331 2HG2 ILE D 12 15.343 23.095 10.483 1.00 0.00 H
+ATOM 3332 3HG2 ILE D 12 14.941 23.838 8.920 1.00 0.00 H
+ATOM 3333 1HD1 ILE D 12 17.947 27.598 8.848 1.00 0.00 H
+ATOM 3334 2HD1 ILE D 12 17.175 27.656 10.451 1.00 0.00 H
+ATOM 3335 3HD1 ILE D 12 18.405 26.433 10.095 1.00 0.00 H
+ATOM 3336 N LYS D 13 13.135 24.119 11.833 1.00 37.80 N
+ATOM 3337 CA LYS D 13 12.694 23.117 12.797 1.00 37.27 C
+ATOM 3338 C LYS D 13 12.772 21.716 12.244 1.00 38.41 C
+ATOM 3339 O LYS D 13 12.212 21.417 11.193 1.00 36.48 O
+ATOM 3340 CB LYS D 13 11.279 23.355 13.269 1.00 35.40 C
+ATOM 3341 CG LYS D 13 10.816 22.272 14.232 1.00 28.98 C
+ATOM 3342 CD LYS D 13 9.432 22.503 14.763 1.00 34.48 C
+ATOM 3343 CE LYS D 13 8.998 21.299 15.596 1.00 34.48 C
+ATOM 3344 NZ LYS D 13 7.667 21.483 16.194 1.00 34.21 N
+ATOM 3345 H LYS D 13 12.554 24.334 11.026 1.00 0.00 H
+ATOM 3346 HA LYS D 13 13.351 23.156 13.664 1.00 0.00 H
+ATOM 3347 1HB LYS D 13 11.243 24.302 13.780 1.00 0.00 H
+ATOM 3348 2HB LYS D 13 10.604 23.394 12.422 1.00 0.00 H
+ATOM 3349 1HG LYS D 13 10.821 21.316 13.714 1.00 0.00 H
+ATOM 3350 2HG LYS D 13 11.513 22.203 15.067 1.00 0.00 H
+ATOM 3351 1HD LYS D 13 9.424 23.394 15.396 1.00 0.00 H
+ATOM 3352 2HD LYS D 13 8.733 22.649 13.938 1.00 0.00 H
+ATOM 3353 1HE LYS D 13 8.980 20.415 14.957 1.00 0.00 H
+ATOM 3354 2HE LYS D 13 9.723 21.140 16.400 1.00 0.00 H
+ATOM 3355 1HZ LYS D 13 7.423 20.641 16.747 1.00 0.00 H
+ATOM 3356 2HZ LYS D 13 7.721 22.312 16.811 1.00 0.00 H
+ATOM 3357 3HZ LYS D 13 6.977 21.625 15.480 1.00 0.00 H
+ATOM 3358 N ALA D 14 13.456 20.835 12.950 1.00 40.23 N
+ATOM 3359 CA ALA D 14 13.578 19.469 12.468 1.00 42.70 C
+ATOM 3360 C ALA D 14 12.269 18.705 12.622 1.00 45.23 C
+ATOM 3361 O ALA D 14 11.730 18.581 13.726 1.00 45.51 O
+ATOM 3362 CB ALA D 14 14.668 18.760 13.229 1.00 33.48 C
+ATOM 3363 H ALA D 14 13.898 21.116 13.828 1.00 0.00 H
+ATOM 3364 HA ALA D 14 13.828 19.504 11.410 1.00 0.00 H
+ATOM 3365 1HB ALA D 14 14.782 17.739 12.870 1.00 0.00 H
+ATOM 3366 2HB ALA D 14 15.589 19.285 13.102 1.00 0.00 H
+ATOM 3367 3HB ALA D 14 14.395 18.755 14.268 1.00 0.00 H
+ATOM 3368 N LEU D 15 11.765 18.149 11.518 1.00 46.85 N
+ATOM 3369 CA LEU D 15 10.540 17.348 11.562 1.00 48.23 C
+ATOM 3370 C LEU D 15 10.871 15.858 11.612 1.00 51.18 C
+ATOM 3371 O LEU D 15 9.993 15.010 11.796 1.00 53.93 O
+ATOM 3372 CB LEU D 15 9.646 17.697 10.373 1.00 42.82 C
+ATOM 3373 CG LEU D 15 8.643 18.879 10.585 1.00 45.70 C
+ATOM 3374 CD1 LEU D 15 9.312 20.035 11.299 1.00 38.41 C
+ATOM 3375 CD2 LEU D 15 8.153 19.348 9.223 1.00 33.40 C
+ATOM 3376 H LEU D 15 12.229 18.275 10.616 1.00 0.00 H
+ATOM 3377 HA LEU D 15 9.997 17.601 12.472 1.00 0.00 H
+ATOM 3378 1HB LEU D 15 10.285 17.963 9.552 1.00 0.00 H
+ATOM 3379 2HB LEU D 15 9.074 16.811 10.097 1.00 0.00 H
+ATOM 3380 HG LEU D 15 7.802 18.541 11.187 1.00 0.00 H
+ATOM 3381 1HD1 LEU D 15 8.597 20.846 11.430 1.00 0.00 H
+ATOM 3382 2HD1 LEU D 15 9.664 19.707 12.273 1.00 0.00 H
+ATOM 3383 3HD1 LEU D 15 10.126 20.378 10.723 1.00 0.00 H
+ATOM 3384 1HD2 LEU D 15 7.448 20.168 9.347 1.00 0.00 H
+ATOM 3385 2HD2 LEU D 15 8.997 19.686 8.629 1.00 0.00 H
+ATOM 3386 3HD2 LEU D 15 7.665 18.537 8.721 1.00 0.00 H
+ATOM 3387 N GLU D 16 12.161 15.564 11.489 1.00 51.16 N
+ATOM 3388 CA GLU D 16 12.689 14.207 11.547 1.00 51.98 C
+ATOM 3389 C GLU D 16 14.109 14.231 12.105 1.00 53.04 C
+ATOM 3390 O GLU D 16 14.738 15.279 12.184 1.00 54.38 O
+ATOM 3391 CB GLU D 16 12.654 13.510 10.174 1.00 46.81 C
+ATOM 3392 CG GLU D 16 13.528 14.118 9.066 1.00 57.46 C
+ATOM 3393 CD GLU D 16 13.393 13.345 7.739 1.00 58.84 C
+ATOM 3394 OE1 GLU D 16 12.769 12.310 7.745 1.00 62.13 O
+ATOM 3395 OE2 GLU D 16 13.868 13.818 6.721 1.00 57.95 O
+ATOM 3396 H GLU D 16 12.802 16.328 11.337 1.00 0.00 H
+ATOM 3397 HA GLU D 16 12.074 13.623 12.231 1.00 0.00 H
+ATOM 3398 1HB GLU D 16 12.956 12.467 10.292 1.00 0.00 H
+ATOM 3399 2HB GLU D 16 11.628 13.510 9.803 1.00 0.00 H
+ATOM 3400 1HG GLU D 16 13.254 15.156 8.914 1.00 0.00 H
+ATOM 3401 2HG GLU D 16 14.568 14.094 9.392 1.00 0.00 H
+ATOM 3402 N ASP D 17 14.596 13.087 12.556 1.00 51.76 N
+ATOM 3403 CA ASP D 17 15.964 13.009 13.057 1.00 51.67 C
+ATOM 3404 C ASP D 17 16.987 13.250 11.951 1.00 51.06 C
+ATOM 3405 O ASP D 17 16.754 12.875 10.802 1.00 49.67 O
+ATOM 3406 CB ASP D 17 16.201 11.667 13.735 1.00 48.09 C
+ATOM 3407 CG ASP D 17 15.444 11.568 15.047 1.00 50.66 C
+ATOM 3408 OD1 ASP D 17 14.960 12.591 15.512 1.00 54.71 O
+ATOM 3409 OD2 ASP D 17 15.336 10.486 15.573 1.00 54.92 O
+ATOM 3410 H ASP D 17 14.029 12.252 12.508 1.00 0.00 H
+ATOM 3411 HA ASP D 17 16.094 13.777 13.800 1.00 0.00 H
+ATOM 3412 1HB ASP D 17 15.898 10.855 13.076 1.00 0.00 H
+ATOM 3413 2HB ASP D 17 17.271 11.553 13.939 1.00 0.00 H
+ATOM 3414 N GLY D 18 18.135 13.841 12.297 1.00 49.07 N
+ATOM 3415 CA GLY D 18 19.200 14.020 11.314 1.00 49.54 C
+ATOM 3416 C GLY D 18 19.021 15.148 10.284 1.00 49.67 C
+ATOM 3417 O GLY D 18 19.510 15.029 9.160 1.00 49.84 O
+ATOM 3418 H GLY D 18 18.304 14.132 13.267 1.00 0.00 H
+ATOM 3419 1HA GLY D 18 20.122 14.205 11.859 1.00 0.00 H
+ATOM 3420 2HA GLY D 18 19.344 13.079 10.788 1.00 0.00 H
+ATOM 3421 N VAL D 19 18.315 16.221 10.632 1.00 46.08 N
+ATOM 3422 CA VAL D 19 18.150 17.332 9.694 1.00 45.86 C
+ATOM 3423 C VAL D 19 19.416 18.161 9.678 1.00 44.40 C
+ATOM 3424 O VAL D 19 19.920 18.564 10.723 1.00 47.16 O
+ATOM 3425 CB VAL D 19 16.939 18.203 10.069 1.00 40.07 C
+ATOM 3426 CG1 VAL D 19 16.868 19.455 9.193 1.00 31.38 C
+ATOM 3427 CG2 VAL D 19 15.690 17.384 9.865 1.00 36.86 C
+ATOM 3428 H VAL D 19 17.931 16.297 11.570 1.00 0.00 H
+ATOM 3429 HA VAL D 19 17.983 16.927 8.695 1.00 0.00 H
+ATOM 3430 HB VAL D 19 17.022 18.500 11.099 1.00 0.00 H
+ATOM 3431 1HG1 VAL D 19 16.012 20.045 9.484 1.00 0.00 H
+ATOM 3432 2HG1 VAL D 19 17.775 20.047 9.331 1.00 0.00 H
+ATOM 3433 3HG1 VAL D 19 16.779 19.165 8.143 1.00 0.00 H
+ATOM 3434 1HG2 VAL D 19 14.822 17.956 10.132 1.00 0.00 H
+ATOM 3435 2HG2 VAL D 19 15.616 17.090 8.826 1.00 0.00 H
+ATOM 3436 3HG2 VAL D 19 15.749 16.504 10.478 1.00 0.00 H
+ATOM 3437 N ASN D 20 19.968 18.377 8.496 1.00 41.20 N
+ATOM 3438 CA ASN D 20 21.227 19.092 8.395 1.00 38.51 C
+ATOM 3439 C ASN D 20 21.070 20.502 7.865 1.00 39.82 C
+ATOM 3440 O ASN D 20 20.558 20.710 6.762 1.00 38.35 O
+ATOM 3441 CB ASN D 20 22.215 18.299 7.562 1.00 45.02 C
+ATOM 3442 CG ASN D 20 22.616 17.001 8.242 1.00 50.33 C
+ATOM 3443 OD1 ASN D 20 22.841 16.971 9.457 1.00 46.28 O
+ATOM 3444 ND2 ASN D 20 22.720 15.937 7.480 1.00 42.04 N
+ATOM 3445 H ASN D 20 19.496 18.047 7.657 1.00 0.00 H
+ATOM 3446 HA ASN D 20 21.648 19.185 9.397 1.00 0.00 H
+ATOM 3447 1HB ASN D 20 21.772 18.066 6.595 1.00 0.00 H
+ATOM 3448 2HB ASN D 20 23.107 18.898 7.382 1.00 0.00 H
+ATOM 3449 1HD2 ASN D 20 22.985 15.060 7.881 1.00 0.00 H
+ATOM 3450 2HD2 ASN D 20 22.538 16.001 6.501 1.00 0.00 H
+ATOM 3451 N VAL D 21 21.527 21.471 8.654 1.00 37.14 N
+ATOM 3452 CA VAL D 21 21.507 22.861 8.228 1.00 38.64 C
+ATOM 3453 C VAL D 21 22.948 23.250 7.931 1.00 39.02 C
+ATOM 3454 O VAL D 21 23.812 23.206 8.807 1.00 38.81 O
+ATOM 3455 CB VAL D 21 20.910 23.761 9.311 1.00 36.39 C
+ATOM 3456 CG1 VAL D 21 20.914 25.184 8.821 1.00 28.43 C
+ATOM 3457 CG2 VAL D 21 19.501 23.282 9.643 1.00 35.35 C
+ATOM 3458 H VAL D 21 21.900 21.234 9.573 1.00 0.00 H
+ATOM 3459 HA VAL D 21 20.919 22.959 7.316 1.00 0.00 H
+ATOM 3460 HB VAL D 21 21.532 23.717 10.201 1.00 0.00 H
+ATOM 3461 1HG1 VAL D 21 20.516 25.841 9.575 1.00 0.00 H
+ATOM 3462 2HG1 VAL D 21 21.936 25.483 8.590 1.00 0.00 H
+ATOM 3463 3HG1 VAL D 21 20.305 25.246 7.926 1.00 0.00 H
+ATOM 3464 1HG2 VAL D 21 19.071 23.915 10.412 1.00 0.00 H
+ATOM 3465 2HG2 VAL D 21 18.889 23.329 8.750 1.00 0.00 H
+ATOM 3466 3HG2 VAL D 21 19.538 22.251 10.005 1.00 0.00 H
+ATOM 3467 N ILE D 22 23.218 23.568 6.678 1.00 39.07 N
+ATOM 3468 CA ILE D 22 24.580 23.744 6.222 1.00 38.40 C
+ATOM 3469 C ILE D 22 24.943 25.172 5.868 1.00 39.00 C
+ATOM 3470 O ILE D 22 24.260 25.830 5.085 1.00 41.81 O
+ATOM 3471 CB ILE D 22 24.807 22.860 4.994 1.00 41.27 C
+ATOM 3472 CG1 ILE D 22 24.564 21.401 5.347 1.00 38.76 C
+ATOM 3473 CG2 ILE D 22 26.206 23.042 4.467 1.00 43.18 C
+ATOM 3474 CD1 ILE D 22 24.501 20.516 4.141 1.00 40.23 C
+ATOM 3475 H ILE D 22 22.467 23.626 6.008 1.00 0.00 H
+ATOM 3476 HA ILE D 22 25.239 23.414 7.010 1.00 0.00 H
+ATOM 3477 HB ILE D 22 24.100 23.123 4.240 1.00 0.00 H
+ATOM 3478 1HG1 ILE D 22 25.361 21.055 5.990 1.00 0.00 H
+ATOM 3479 2HG1 ILE D 22 23.618 21.312 5.882 1.00 0.00 H
+ATOM 3480 1HG2 ILE D 22 26.323 22.413 3.603 1.00 0.00 H
+ATOM 3481 2HG2 ILE D 22 26.368 24.075 4.186 1.00 0.00 H
+ATOM 3482 3HG2 ILE D 22 26.930 22.758 5.232 1.00 0.00 H
+ATOM 3483 1HD1 ILE D 22 24.325 19.485 4.451 1.00 0.00 H
+ATOM 3484 2HD1 ILE D 22 23.686 20.846 3.492 1.00 0.00 H
+ATOM 3485 3HD1 ILE D 22 25.441 20.577 3.602 1.00 0.00 H
+ATOM 3486 N GLY D 23 26.033 25.654 6.452 1.00 39.26 N
+ATOM 3487 CA GLY D 23 26.511 26.986 6.136 1.00 37.32 C
+ATOM 3488 C GLY D 23 27.472 26.910 4.957 1.00 35.86 C
+ATOM 3489 O GLY D 23 28.444 26.132 4.977 1.00 36.32 O
+ATOM 3490 H GLY D 23 26.550 25.064 7.093 1.00 0.00 H
+ATOM 3491 1HA GLY D 23 25.669 27.636 5.891 1.00 0.00 H
+ATOM 3492 2HA GLY D 23 27.014 27.412 7.002 1.00 0.00 H
+ATOM 3493 N LEU D 24 27.207 27.766 3.960 1.00 32.84 N
+ATOM 3494 CA LEU D 24 28.008 27.896 2.744 1.00 31.94 C
+ATOM 3495 C LEU D 24 28.840 29.168 2.809 1.00 33.64 C
+ATOM 3496 O LEU D 24 28.318 30.266 3.071 1.00 32.62 O
+ATOM 3497 CB LEU D 24 27.110 27.966 1.505 1.00 31.24 C
+ATOM 3498 CG LEU D 24 26.515 26.649 1.002 1.00 26.82 C
+ATOM 3499 CD1 LEU D 24 25.438 26.170 1.965 1.00 37.89 C
+ATOM 3500 CD2 LEU D 24 25.935 26.843 -0.398 1.00 32.71 C
+ATOM 3501 H LEU D 24 26.370 28.340 4.034 1.00 0.00 H
+ATOM 3502 HA LEU D 24 28.675 27.040 2.662 1.00 0.00 H
+ATOM 3503 1HB LEU D 24 26.295 28.607 1.755 1.00 0.00 H
+ATOM 3504 2HB LEU D 24 27.673 28.420 0.688 1.00 0.00 H
+ATOM 3505 HG LEU D 24 27.288 25.910 0.965 1.00 0.00 H
+ATOM 3506 1HD1 LEU D 24 25.037 25.227 1.611 1.00 0.00 H
+ATOM 3507 2HD1 LEU D 24 25.860 26.028 2.941 1.00 0.00 H
+ATOM 3508 3HD1 LEU D 24 24.638 26.908 2.025 1.00 0.00 H
+ATOM 3509 1HD2 LEU D 24 25.523 25.898 -0.756 1.00 0.00 H
+ATOM 3510 2HD2 LEU D 24 25.148 27.588 -0.372 1.00 0.00 H
+ATOM 3511 3HD2 LEU D 24 26.723 27.171 -1.077 1.00 0.00 H
+ATOM 3512 N THR D 25 30.133 29.010 2.546 1.00 35.97 N
+ATOM 3513 CA THR D 25 31.094 30.090 2.703 1.00 35.46 C
+ATOM 3514 C THR D 25 30.910 31.286 1.782 1.00 35.14 C
+ATOM 3515 O THR D 25 30.572 31.154 0.605 1.00 37.74 O
+ATOM 3516 CB THR D 25 32.515 29.558 2.500 1.00 31.83 C
+ATOM 3517 OG1 THR D 25 32.584 28.905 1.246 1.00 34.03 O
+ATOM 3518 CG2 THR D 25 32.902 28.606 3.583 1.00 29.66 C
+ATOM 3519 H THR D 25 30.472 28.087 2.291 1.00 0.00 H
+ATOM 3520 HA THR D 25 31.020 30.434 3.724 1.00 0.00 H
+ATOM 3521 HB THR D 25 33.210 30.399 2.496 1.00 0.00 H
+ATOM 3522 HG1 THR D 25 31.996 28.124 1.260 1.00 0.00 H
+ATOM 3523 1HG2 THR D 25 33.916 28.247 3.405 1.00 0.00 H
+ATOM 3524 2HG2 THR D 25 32.858 29.121 4.540 1.00 0.00 H
+ATOM 3525 3HG2 THR D 25 32.213 27.764 3.586 1.00 0.00 H
+ATOM 3526 N ARG D 26 31.186 32.457 2.356 1.00 34.79 N
+ATOM 3527 CA ARG D 26 31.161 33.741 1.666 1.00 35.53 C
+ATOM 3528 C ARG D 26 32.484 34.027 0.954 1.00 34.41 C
+ATOM 3529 O ARG D 26 33.555 33.906 1.549 1.00 32.86 O
+ATOM 3530 CB ARG D 26 30.873 34.870 2.657 1.00 25.88 C
+ATOM 3531 CG ARG D 26 30.679 36.250 2.026 1.00 24.06 C
+ATOM 3532 CD ARG D 26 30.432 37.324 3.045 1.00 31.34 C
+ATOM 3533 NE ARG D 26 29.225 37.098 3.831 1.00 35.90 N
+ATOM 3534 CZ ARG D 26 27.977 37.388 3.434 1.00 26.01 C
+ATOM 3535 NH1 ARG D 26 27.755 37.908 2.249 1.00 29.08 N
+ATOM 3536 NH2 ARG D 26 26.994 37.142 4.265 1.00 21.02 N
+ATOM 3537 H ARG D 26 31.405 32.442 3.349 1.00 0.00 H
+ATOM 3538 HA ARG D 26 30.370 33.713 0.917 1.00 0.00 H
+ATOM 3539 1HB ARG D 26 29.977 34.635 3.235 1.00 0.00 H
+ATOM 3540 2HB ARG D 26 31.698 34.948 3.369 1.00 0.00 H
+ATOM 3541 1HG ARG D 26 31.580 36.523 1.480 1.00 0.00 H
+ATOM 3542 2HG ARG D 26 29.834 36.223 1.341 1.00 0.00 H
+ATOM 3543 1HD ARG D 26 31.275 37.375 3.727 1.00 0.00 H
+ATOM 3544 2HD ARG D 26 30.326 38.280 2.536 1.00 0.00 H
+ATOM 3545 HE ARG D 26 29.317 36.709 4.779 1.00 0.00 H
+ATOM 3546 1HH1 ARG D 26 28.530 38.094 1.636 1.00 0.00 H
+ATOM 3547 2HH1 ARG D 26 26.811 38.131 1.963 1.00 0.00 H
+ATOM 3548 1HH2 ARG D 26 27.233 36.755 5.181 1.00 0.00 H
+ATOM 3549 2HH2 ARG D 26 26.023 37.329 4.013 1.00 0.00 H
+ATOM 3550 N GLY D 27 32.408 34.430 -0.314 1.00 32.19 N
+ATOM 3551 CA GLY D 27 33.610 34.758 -1.080 1.00 31.52 C
+ATOM 3552 C GLY D 27 33.642 34.033 -2.421 1.00 32.68 C
+ATOM 3553 O GLY D 27 32.747 33.254 -2.736 1.00 30.02 O
+ATOM 3554 H GLY D 27 31.505 34.502 -0.758 1.00 0.00 H
+ATOM 3555 1HA GLY D 27 33.649 35.833 -1.245 1.00 0.00 H
+ATOM 3556 2HA GLY D 27 34.495 34.494 -0.500 1.00 0.00 H
+ATOM 3557 N ALA D 28 34.688 34.299 -3.212 1.00 34.75 N
+ATOM 3558 CA ALA D 28 34.842 33.685 -4.533 1.00 33.81 C
+ATOM 3559 C ALA D 28 34.910 32.156 -4.440 1.00 34.19 C
+ATOM 3560 O ALA D 28 34.485 31.449 -5.345 1.00 37.22 O
+ATOM 3561 CB ALA D 28 36.102 34.209 -5.210 1.00 29.41 C
+ATOM 3562 H ALA D 28 35.383 34.956 -2.895 1.00 0.00 H
+ATOM 3563 HA ALA D 28 33.978 33.949 -5.138 1.00 0.00 H
+ATOM 3564 1HB ALA D 28 36.190 33.763 -6.199 1.00 0.00 H
+ATOM 3565 2HB ALA D 28 36.048 35.289 -5.308 1.00 0.00 H
+ATOM 3566 3HB ALA D 28 36.970 33.944 -4.613 1.00 0.00 H
+ATOM 3567 N ASP D 29 35.502 31.660 -3.354 1.00 31.09 N
+ATOM 3568 CA ASP D 29 35.627 30.217 -3.147 1.00 30.96 C
+ATOM 3569 C ASP D 29 34.484 29.694 -2.268 1.00 32.61 C
+ATOM 3570 O ASP D 29 34.554 29.747 -1.055 1.00 31.23 O
+ATOM 3571 CB ASP D 29 36.997 29.897 -2.509 1.00 24.33 C
+ATOM 3572 CG ASP D 29 37.244 28.390 -2.213 1.00 31.72 C
+ATOM 3573 OD1 ASP D 29 38.380 27.990 -2.078 1.00 38.44 O
+ATOM 3574 OD2 ASP D 29 36.294 27.670 -2.065 1.00 30.83 O
+ATOM 3575 H ASP D 29 35.832 32.292 -2.648 1.00 0.00 H
+ATOM 3576 HA ASP D 29 35.567 29.724 -4.111 1.00 0.00 H
+ATOM 3577 1HB ASP D 29 37.786 30.258 -3.178 1.00 0.00 H
+ATOM 3578 2HB ASP D 29 37.093 30.437 -1.574 1.00 0.00 H
+ATOM 3579 N THR D 30 33.450 29.147 -2.925 1.00 31.48 N
+ATOM 3580 CA THR D 30 32.275 28.697 -2.170 1.00 34.55 C
+ATOM 3581 C THR D 30 32.311 27.191 -1.898 1.00 35.80 C
+ATOM 3582 O THR D 30 32.421 26.369 -2.804 1.00 38.70 O
+ATOM 3583 CB THR D 30 30.976 29.028 -2.929 1.00 32.64 C
+ATOM 3584 OG1 THR D 30 30.868 30.448 -3.083 1.00 35.21 O
+ATOM 3585 CG2 THR D 30 29.770 28.526 -2.129 1.00 20.95 C
+ATOM 3586 H THR D 30 33.459 29.108 -3.922 1.00 0.00 H
+ATOM 3587 HA THR D 30 32.251 29.216 -1.223 1.00 0.00 H
+ATOM 3588 HB THR D 30 30.991 28.558 -3.907 1.00 0.00 H
+ATOM 3589 HG1 THR D 30 30.997 30.877 -2.224 1.00 0.00 H
+ATOM 3590 1HG2 THR D 30 28.856 28.770 -2.667 1.00 0.00 H
+ATOM 3591 2HG2 THR D 30 29.839 27.448 -2.008 1.00 0.00 H
+ATOM 3592 3HG2 THR D 30 29.759 29.006 -1.148 1.00 0.00 H
+ATOM 3593 N ARG D 31 32.180 26.853 -0.619 1.00 34.24 N
+ATOM 3594 CA ARG D 31 32.188 25.480 -0.139 1.00 32.48 C
+ATOM 3595 C ARG D 31 31.463 25.417 1.195 1.00 33.83 C
+ATOM 3596 O ARG D 31 31.105 26.456 1.751 1.00 34.60 O
+ATOM 3597 CB ARG D 31 33.610 24.964 0.031 1.00 23.20 C
+ATOM 3598 CG ARG D 31 34.420 25.657 1.116 1.00 37.64 C
+ATOM 3599 CD ARG D 31 35.796 25.080 1.242 1.00 38.61 C
+ATOM 3600 NE ARG D 31 36.703 25.436 0.133 1.00 39.02 N
+ATOM 3601 CZ ARG D 31 37.855 24.777 -0.139 1.00 31.04 C
+ATOM 3602 NH1 ARG D 31 38.205 23.722 0.583 1.00 26.55 N
+ATOM 3603 NH2 ARG D 31 38.637 25.191 -1.122 1.00 37.96 N
+ATOM 3604 H ARG D 31 32.125 27.601 0.055 1.00 0.00 H
+ATOM 3605 HA ARG D 31 31.664 24.847 -0.856 1.00 0.00 H
+ATOM 3606 1HB ARG D 31 33.588 23.904 0.272 1.00 0.00 H
+ATOM 3607 2HB ARG D 31 34.156 25.081 -0.906 1.00 0.00 H
+ATOM 3608 1HG ARG D 31 34.513 26.720 0.873 1.00 0.00 H
+ATOM 3609 2HG ARG D 31 33.911 25.547 2.077 1.00 0.00 H
+ATOM 3610 1HD ARG D 31 36.242 25.435 2.169 1.00 0.00 H
+ATOM 3611 2HD ARG D 31 35.717 23.994 1.277 1.00 0.00 H
+ATOM 3612 HE ARG D 31 36.469 26.248 -0.473 1.00 0.00 H
+ATOM 3613 1HH1 ARG D 31 37.613 23.404 1.337 1.00 0.00 H
+ATOM 3614 2HH1 ARG D 31 39.066 23.235 0.378 1.00 0.00 H
+ATOM 3615 1HH2 ARG D 31 38.387 26.043 -1.655 1.00 0.00 H
+ATOM 3616 2HH2 ARG D 31 39.494 24.710 -1.326 1.00 0.00 H
+ATOM 3617 N PHE D 32 31.210 24.211 1.692 1.00 35.43 N
+ATOM 3618 CA PHE D 32 30.559 24.074 2.995 1.00 38.14 C
+ATOM 3619 C PHE D 32 31.569 24.327 4.101 1.00 42.55 C
+ATOM 3620 O PHE D 32 32.721 23.901 3.984 1.00 44.97 O
+ATOM 3621 CB PHE D 32 30.015 22.657 3.178 1.00 31.32 C
+ATOM 3622 CG PHE D 32 28.882 22.315 2.293 1.00 32.95 C
+ATOM 3623 CD1 PHE D 32 28.281 23.279 1.521 1.00 39.61 C
+ATOM 3624 CD2 PHE D 32 28.415 21.011 2.224 1.00 39.00 C
+ATOM 3625 CE1 PHE D 32 27.229 22.957 0.691 1.00 44.17 C
+ATOM 3626 CE2 PHE D 32 27.367 20.685 1.398 1.00 45.12 C
+ATOM 3627 CZ PHE D 32 26.774 21.665 0.631 1.00 35.27 C
+ATOM 3628 H PHE D 32 31.492 23.384 1.185 1.00 0.00 H
+ATOM 3629 HA PHE D 32 29.749 24.802 3.077 1.00 0.00 H
+ATOM 3630 1HB PHE D 32 30.811 21.938 3.003 1.00 0.00 H
+ATOM 3631 2HB PHE D 32 29.687 22.533 4.213 1.00 0.00 H
+ATOM 3632 HD1 PHE D 32 28.651 24.298 1.577 1.00 0.00 H
+ATOM 3633 HD2 PHE D 32 28.889 20.241 2.833 1.00 0.00 H
+ATOM 3634 HE1 PHE D 32 26.756 23.724 0.074 1.00 0.00 H
+ATOM 3635 HE2 PHE D 32 27.008 19.658 1.350 1.00 0.00 H
+ATOM 3636 HZ PHE D 32 25.953 21.420 -0.026 1.00 0.00 H
+ATOM 3637 N HIS D 33 31.147 24.966 5.190 1.00 41.40 N
+ATOM 3638 CA HIS D 33 32.054 25.108 6.328 1.00 43.35 C
+ATOM 3639 C HIS D 33 31.491 24.479 7.598 1.00 45.16 C
+ATOM 3640 O HIS D 33 32.249 24.099 8.492 1.00 47.98 O
+ATOM 3641 CB HIS D 33 32.396 26.574 6.599 1.00 36.79 C
+ATOM 3642 CG HIS D 33 31.252 27.424 7.061 1.00 45.42 C
+ATOM 3643 ND1 HIS D 33 30.828 27.416 8.362 1.00 36.24 N
+ATOM 3644 CD2 HIS D 33 30.454 28.311 6.416 1.00 45.54 C
+ATOM 3645 CE1 HIS D 33 29.830 28.253 8.508 1.00 37.43 C
+ATOM 3646 NE2 HIS D 33 29.582 28.810 7.348 1.00 44.03 N
+ATOM 3647 H HIS D 33 30.201 25.342 5.216 1.00 0.00 H
+ATOM 3648 HA HIS D 33 32.989 24.593 6.110 1.00 0.00 H
+ATOM 3649 1HB HIS D 33 33.169 26.618 7.369 1.00 0.00 H
+ATOM 3650 2HB HIS D 33 32.815 27.002 5.719 1.00 0.00 H
+ATOM 3651 HD2 HIS D 33 30.493 28.582 5.368 1.00 0.00 H
+ATOM 3652 HE1 HIS D 33 29.302 28.450 9.439 1.00 0.00 H
+ATOM 3653 HE2 HIS D 33 28.861 29.499 7.197 1.00 0.00 H
+ATOM 3654 N HIS D 34 30.168 24.343 7.675 1.00 41.01 N
+ATOM 3655 CA HIS D 34 29.559 23.784 8.886 1.00 40.83 C
+ATOM 3656 C HIS D 34 28.207 23.152 8.637 1.00 39.25 C
+ATOM 3657 O HIS D 34 27.381 23.682 7.904 1.00 36.62 O
+ATOM 3658 CB HIS D 34 29.404 24.841 9.988 1.00 41.27 C
+ATOM 3659 CG HIS D 34 28.844 24.286 11.283 1.00 49.01 C
+ATOM 3660 ND1 HIS D 34 29.579 23.480 12.129 1.00 41.42 N
+ATOM 3661 CD2 HIS D 34 27.622 24.428 11.864 1.00 48.76 C
+ATOM 3662 CE1 HIS D 34 28.831 23.149 13.177 1.00 34.70 C
+ATOM 3663 NE2 HIS D 34 27.642 23.712 13.037 1.00 45.07 N
+ATOM 3664 H HIS D 34 29.589 24.681 6.908 1.00 0.00 H
+ATOM 3665 HA HIS D 34 30.207 23.002 9.277 1.00 0.00 H
+ATOM 3666 1HB HIS D 34 30.375 25.290 10.206 1.00 0.00 H
+ATOM 3667 2HB HIS D 34 28.745 25.634 9.642 1.00 0.00 H
+ATOM 3668 HD2 HIS D 34 26.779 25.000 11.474 1.00 0.00 H
+ATOM 3669 HE1 HIS D 34 29.143 22.521 14.010 1.00 0.00 H
+ATOM 3670 HE2 HIS D 34 26.853 23.628 13.699 1.00 0.00 H
+ATOM 3671 N SER D 35 27.968 22.019 9.289 1.00 38.43 N
+ATOM 3672 CA SER D 35 26.679 21.348 9.186 1.00 38.72 C
+ATOM 3673 C SER D 35 26.107 21.075 10.570 1.00 39.18 C
+ATOM 3674 O SER D 35 26.639 20.260 11.326 1.00 39.23 O
+ATOM 3675 CB SER D 35 26.829 20.051 8.414 1.00 38.15 C
+ATOM 3676 OG SER D 35 25.618 19.357 8.370 1.00 50.79 O
+ATOM 3677 H SER D 35 28.688 21.626 9.880 1.00 0.00 H
+ATOM 3678 HA SER D 35 25.985 21.992 8.656 1.00 0.00 H
+ATOM 3679 1HB SER D 35 27.159 20.277 7.400 1.00 0.00 H
+ATOM 3680 2HB SER D 35 27.595 19.429 8.877 1.00 0.00 H
+ATOM 3681 HG SER D 35 24.945 20.029 8.233 1.00 0.00 H
+ATOM 3682 N GLU D 36 25.032 21.784 10.904 1.00 39.17 N
+ATOM 3683 CA GLU D 36 24.419 21.654 12.214 1.00 40.46 C
+ATOM 3684 C GLU D 36 23.350 20.579 12.163 1.00 41.65 C
+ATOM 3685 O GLU D 36 22.393 20.673 11.391 1.00 41.08 O
+ATOM 3686 CB GLU D 36 23.823 22.987 12.689 1.00 35.44 C
+ATOM 3687 CG GLU D 36 23.290 22.961 14.133 1.00 36.50 C
+ATOM 3688 CD GLU D 36 24.390 22.807 15.168 1.00 44.62 C
+ATOM 3689 OE1 GLU D 36 25.492 23.267 14.927 1.00 38.71 O
+ATOM 3690 OE2 GLU D 36 24.131 22.232 16.211 1.00 39.04 O
+ATOM 3691 H GLU D 36 24.630 22.424 10.227 1.00 0.00 H
+ATOM 3692 HA GLU D 36 25.180 21.344 12.929 1.00 0.00 H
+ATOM 3693 1HB GLU D 36 24.576 23.771 12.621 1.00 0.00 H
+ATOM 3694 2HB GLU D 36 23.002 23.268 12.032 1.00 0.00 H
+ATOM 3695 1HG GLU D 36 22.764 23.888 14.337 1.00 0.00 H
+ATOM 3696 2HG GLU D 36 22.578 22.141 14.234 1.00 0.00 H
+ATOM 3697 N LYS D 37 23.545 19.523 12.943 1.00 42.08 N
+ATOM 3698 CA LYS D 37 22.612 18.408 12.938 1.00 42.74 C
+ATOM 3699 C LYS D 37 21.496 18.648 13.946 1.00 41.93 C
+ATOM 3700 O LYS D 37 21.756 18.854 15.135 1.00 36.64 O
+ATOM 3701 CB LYS D 37 23.352 17.104 13.252 1.00 43.78 C
+ATOM 3702 CG LYS D 37 22.502 15.838 13.178 1.00 40.91 C
+ATOM 3703 CD LYS D 37 23.353 14.593 13.495 1.00 46.52 C
+ATOM 3704 CE LYS D 37 22.531 13.309 13.439 1.00 49.42 C
+ATOM 3705 NZ LYS D 37 23.339 12.110 13.815 1.00 45.00 N
+ATOM 3706 H LYS D 37 24.354 19.501 13.547 1.00 0.00 H
+ATOM 3707 HA LYS D 37 22.165 18.326 11.947 1.00 0.00 H
+ATOM 3708 1HB LYS D 37 24.172 16.985 12.540 1.00 0.00 H
+ATOM 3709 2HB LYS D 37 23.789 17.162 14.247 1.00 0.00 H
+ATOM 3710 1HG LYS D 37 21.670 15.903 13.888 1.00 0.00 H
+ATOM 3711 2HG LYS D 37 22.088 15.747 12.169 1.00 0.00 H
+ATOM 3712 1HD LYS D 37 24.170 14.521 12.775 1.00 0.00 H
+ATOM 3713 2HD LYS D 37 23.778 14.694 14.493 1.00 0.00 H
+ATOM 3714 1HE LYS D 37 21.682 13.395 14.122 1.00 0.00 H
+ATOM 3715 2HE LYS D 37 22.161 13.171 12.426 1.00 0.00 H
+ATOM 3716 1HZ LYS D 37 22.754 11.288 13.762 1.00 0.00 H
+ATOM 3717 2HZ LYS D 37 24.122 12.011 13.184 1.00 0.00 H
+ATOM 3718 3HZ LYS D 37 23.676 12.221 14.761 1.00 0.00 H
+ATOM 3719 N LEU D 38 20.261 18.648 13.462 1.00 42.38 N
+ATOM 3720 CA LEU D 38 19.096 18.860 14.301 1.00 39.69 C
+ATOM 3721 C LEU D 38 18.271 17.582 14.340 1.00 41.35 C
+ATOM 3722 O LEU D 38 17.916 17.038 13.291 1.00 38.14 O
+ATOM 3723 CB LEU D 38 18.214 19.982 13.732 1.00 44.26 C
+ATOM 3724 CG LEU D 38 18.858 21.333 13.463 1.00 47.99 C
+ATOM 3725 CD1 LEU D 38 17.788 22.268 12.867 1.00 40.45 C
+ATOM 3726 CD2 LEU D 38 19.442 21.883 14.731 1.00 44.48 C
+ATOM 3727 H LEU D 38 20.125 18.495 12.470 1.00 0.00 H
+ATOM 3728 HA LEU D 38 19.415 19.105 15.315 1.00 0.00 H
+ATOM 3729 1HB LEU D 38 17.832 19.645 12.788 1.00 0.00 H
+ATOM 3730 2HB LEU D 38 17.378 20.141 14.407 1.00 0.00 H
+ATOM 3731 HG LEU D 38 19.657 21.212 12.724 1.00 0.00 H
+ATOM 3732 1HD1 LEU D 38 18.230 23.227 12.644 1.00 0.00 H
+ATOM 3733 2HD1 LEU D 38 17.396 21.830 11.949 1.00 0.00 H
+ATOM 3734 3HD1 LEU D 38 16.971 22.401 13.583 1.00 0.00 H
+ATOM 3735 1HD2 LEU D 38 19.917 22.831 14.532 1.00 0.00 H
+ATOM 3736 2HD2 LEU D 38 18.652 22.013 15.475 1.00 0.00 H
+ATOM 3737 3HD2 LEU D 38 20.185 21.184 15.102 1.00 0.00 H
+ATOM 3738 N ASP D 39 17.957 17.094 15.524 1.00 40.61 N
+ATOM 3739 CA ASP D 39 17.121 15.904 15.596 1.00 41.67 C
+ATOM 3740 C ASP D 39 15.674 16.333 15.724 1.00 42.94 C
+ATOM 3741 O ASP D 39 15.423 17.516 15.953 1.00 41.44 O
+ATOM 3742 CB ASP D 39 17.589 14.942 16.678 1.00 56.25 C
+ATOM 3743 CG ASP D 39 18.900 14.211 16.255 1.00 51.32 C
+ATOM 3744 OD1 ASP D 39 19.158 14.088 15.051 1.00 50.41 O
+ATOM 3745 OD2 ASP D 39 19.613 13.771 17.124 1.00 55.20 O
+ATOM 3746 H ASP D 39 18.276 17.573 16.370 1.00 0.00 H
+ATOM 3747 HA ASP D 39 17.220 15.374 14.658 1.00 0.00 H
+ATOM 3748 1HB ASP D 39 17.771 15.495 17.604 1.00 0.00 H
+ATOM 3749 2HB ASP D 39 16.808 14.200 16.874 1.00 0.00 H
+ATOM 3750 N LYS D 40 14.730 15.416 15.525 1.00 44.32 N
+ATOM 3751 CA LYS D 40 13.331 15.812 15.505 1.00 44.06 C
+ATOM 3752 C LYS D 40 12.981 16.634 16.725 1.00 43.24 C
+ATOM 3753 O LYS D 40 13.249 16.230 17.855 1.00 41.30 O
+ATOM 3754 CB LYS D 40 12.421 14.586 15.436 1.00 49.20 C
+ATOM 3755 CG LYS D 40 10.943 14.902 15.293 1.00 45.71 C
+ATOM 3756 CD LYS D 40 10.131 13.633 15.105 1.00 44.39 C
+ATOM 3757 CE LYS D 40 8.656 13.935 14.910 1.00 56.77 C
+ATOM 3758 NZ LYS D 40 7.864 12.693 14.696 1.00 63.29 N
+ATOM 3759 H LYS D 40 14.965 14.430 15.374 1.00 0.00 H
+ATOM 3760 HA LYS D 40 13.157 16.423 14.619 1.00 0.00 H
+ATOM 3761 1HB LYS D 40 12.716 13.955 14.611 1.00 0.00 H
+ATOM 3762 2HB LYS D 40 12.548 13.998 16.344 1.00 0.00 H
+ATOM 3763 1HG LYS D 40 10.588 15.428 16.179 1.00 0.00 H
+ATOM 3764 2HG LYS D 40 10.803 15.548 14.432 1.00 0.00 H
+ATOM 3765 1HD LYS D 40 10.501 13.102 14.226 1.00 0.00 H
+ATOM 3766 2HD LYS D 40 10.254 12.993 15.977 1.00 0.00 H
+ATOM 3767 1HE LYS D 40 8.278 14.450 15.793 1.00 0.00 H
+ATOM 3768 2HE LYS D 40 8.536 14.585 14.042 1.00 0.00 H
+ATOM 3769 1HZ LYS D 40 6.893 12.931 14.570 1.00 0.00 H
+ATOM 3770 2HZ LYS D 40 8.203 12.216 13.871 1.00 0.00 H
+ATOM 3771 3HZ LYS D 40 7.962 12.088 15.497 1.00 0.00 H
+ATOM 3772 N GLY D 41 12.366 17.789 16.486 1.00 42.79 N
+ATOM 3773 CA GLY D 41 11.949 18.686 17.552 1.00 39.54 C
+ATOM 3774 C GLY D 41 12.925 19.828 17.847 1.00 39.53 C
+ATOM 3775 O GLY D 41 12.563 20.786 18.533 1.00 37.35 O
+ATOM 3776 H GLY D 41 12.187 18.059 15.521 1.00 0.00 H
+ATOM 3777 1HA GLY D 41 10.971 19.099 17.305 1.00 0.00 H
+ATOM 3778 2HA GLY D 41 11.818 18.098 18.459 1.00 0.00 H
+ATOM 3779 N GLU D 42 14.156 19.754 17.346 1.00 38.31 N
+ATOM 3780 CA GLU D 42 15.091 20.846 17.626 1.00 38.91 C
+ATOM 3781 C GLU D 42 14.863 22.031 16.696 1.00 37.30 C
+ATOM 3782 O GLU D 42 14.574 21.870 15.505 1.00 40.02 O
+ATOM 3783 CB GLU D 42 16.555 20.375 17.561 1.00 44.88 C
+ATOM 3784 CG GLU D 42 16.944 19.399 18.685 1.00 48.40 C
+ATOM 3785 CD GLU D 42 18.424 19.034 18.736 1.00 54.97 C
+ATOM 3786 OE1 GLU D 42 18.946 18.551 17.764 1.00 42.96 O
+ATOM 3787 OE2 GLU D 42 19.035 19.242 19.768 1.00 51.27 O
+ATOM 3788 H GLU D 42 14.449 18.947 16.797 1.00 0.00 H
+ATOM 3789 HA GLU D 42 14.911 21.193 18.648 1.00 0.00 H
+ATOM 3790 1HB GLU D 42 16.729 19.866 16.615 1.00 0.00 H
+ATOM 3791 2HB GLU D 42 17.226 21.232 17.609 1.00 0.00 H
+ATOM 3792 1HG GLU D 42 16.660 19.846 19.636 1.00 0.00 H
+ATOM 3793 2HG GLU D 42 16.361 18.481 18.559 1.00 0.00 H
+ATOM 3794 N VAL D 43 15.005 23.239 17.251 1.00 35.58 N
+ATOM 3795 CA VAL D 43 14.840 24.456 16.456 1.00 36.37 C
+ATOM 3796 C VAL D 43 16.120 25.273 16.402 1.00 38.52 C
+ATOM 3797 O VAL D 43 16.724 25.569 17.431 1.00 39.20 O
+ATOM 3798 CB VAL D 43 13.690 25.334 17.018 1.00 34.33 C
+ATOM 3799 CG1 VAL D 43 13.583 26.635 16.219 1.00 20.33 C
+ATOM 3800 CG2 VAL D 43 12.367 24.570 16.924 1.00 29.78 C
+ATOM 3801 H VAL D 43 15.232 23.310 18.245 1.00 0.00 H
+ATOM 3802 HA VAL D 43 14.579 24.171 15.440 1.00 0.00 H
+ATOM 3803 HB VAL D 43 13.901 25.584 18.057 1.00 0.00 H
+ATOM 3804 1HG1 VAL D 43 12.778 27.248 16.617 1.00 0.00 H
+ATOM 3805 2HG1 VAL D 43 14.521 27.185 16.288 1.00 0.00 H
+ATOM 3806 3HG1 VAL D 43 13.377 26.396 15.172 1.00 0.00 H
+ATOM 3807 1HG2 VAL D 43 11.558 25.184 17.319 1.00 0.00 H
+ATOM 3808 2HG2 VAL D 43 12.175 24.344 15.893 1.00 0.00 H
+ATOM 3809 3HG2 VAL D 43 12.433 23.643 17.493 1.00 0.00 H
+ATOM 3810 N LEU D 44 16.540 25.622 15.191 1.00 33.64 N
+ATOM 3811 CA LEU D 44 17.739 26.429 15.001 1.00 34.02 C
+ATOM 3812 C LEU D 44 17.418 27.763 14.358 1.00 35.19 C
+ATOM 3813 O LEU D 44 16.797 27.819 13.299 1.00 36.48 O
+ATOM 3814 CB LEU D 44 18.736 25.700 14.108 1.00 33.97 C
+ATOM 3815 CG LEU D 44 20.033 26.451 13.778 1.00 38.15 C
+ATOM 3816 CD1 LEU D 44 20.867 26.642 15.058 1.00 31.89 C
+ATOM 3817 CD2 LEU D 44 20.793 25.663 12.730 1.00 30.07 C
+ATOM 3818 H LEU D 44 16.008 25.316 14.380 1.00 0.00 H
+ATOM 3819 HA LEU D 44 18.195 26.619 15.970 1.00 0.00 H
+ATOM 3820 1HB LEU D 44 19.003 24.788 14.600 1.00 0.00 H
+ATOM 3821 2HB LEU D 44 18.243 25.463 13.167 1.00 0.00 H
+ATOM 3822 HG LEU D 44 19.793 27.439 13.383 1.00 0.00 H
+ATOM 3823 1HD1 LEU D 44 21.780 27.178 14.818 1.00 0.00 H
+ATOM 3824 2HD1 LEU D 44 20.294 27.214 15.786 1.00 0.00 H
+ATOM 3825 3HD1 LEU D 44 21.120 25.668 15.477 1.00 0.00 H
+ATOM 3826 1HD2 LEU D 44 21.715 26.186 12.472 1.00 0.00 H
+ATOM 3827 2HD2 LEU D 44 21.030 24.679 13.114 1.00 0.00 H
+ATOM 3828 3HD2 LEU D 44 20.175 25.561 11.850 1.00 0.00 H
+ATOM 3829 N ILE D 45 17.823 28.838 15.007 1.00 34.51 N
+ATOM 3830 CA ILE D 45 17.600 30.160 14.463 1.00 33.58 C
+ATOM 3831 C ILE D 45 18.969 30.725 14.122 1.00 35.38 C
+ATOM 3832 O ILE D 45 19.817 30.865 15.003 1.00 35.65 O
+ATOM 3833 CB ILE D 45 16.885 31.051 15.476 1.00 29.87 C
+ATOM 3834 CG1 ILE D 45 15.584 30.374 15.898 1.00 32.88 C
+ATOM 3835 CG2 ILE D 45 16.577 32.353 14.787 1.00 31.76 C
+ATOM 3836 CD1 ILE D 45 14.887 31.016 17.032 1.00 43.26 C
+ATOM 3837 H ILE D 45 18.299 28.740 15.896 1.00 0.00 H
+ATOM 3838 HA ILE D 45 17.010 30.095 13.555 1.00 0.00 H
+ATOM 3839 HB ILE D 45 17.503 31.211 16.360 1.00 0.00 H
+ATOM 3840 1HG1 ILE D 45 14.930 30.357 15.064 1.00 0.00 H
+ATOM 3841 2HG1 ILE D 45 15.804 29.349 16.184 1.00 0.00 H
+ATOM 3842 1HG2 ILE D 45 16.044 33.019 15.452 1.00 0.00 H
+ATOM 3843 2HG2 ILE D 45 17.504 32.819 14.460 1.00 0.00 H
+ATOM 3844 3HG2 ILE D 45 15.969 32.143 13.925 1.00 0.00 H
+ATOM 3845 1HD1 ILE D 45 13.987 30.457 17.242 1.00 0.00 H
+ATOM 3846 2HD1 ILE D 45 15.532 31.021 17.913 1.00 0.00 H
+ATOM 3847 3HD1 ILE D 45 14.632 32.025 16.760 1.00 0.00 H
+ATOM 3848 N ALA D 46 19.216 31.028 12.852 1.00 35.14 N
+ATOM 3849 CA ALA D 46 20.585 31.403 12.507 1.00 35.10 C
+ATOM 3850 C ALA D 46 20.689 32.546 11.524 1.00 35.88 C
+ATOM 3851 O ALA D 46 19.927 32.641 10.559 1.00 38.04 O
+ATOM 3852 CB ALA D 46 21.289 30.182 11.929 1.00 28.17 C
+ATOM 3853 H ALA D 46 18.479 30.948 12.153 1.00 0.00 H
+ATOM 3854 HA ALA D 46 21.091 31.718 13.415 1.00 0.00 H
+ATOM 3855 1HB ALA D 46 22.325 30.438 11.705 1.00 0.00 H
+ATOM 3856 2HB ALA D 46 21.262 29.368 12.652 1.00 0.00 H
+ATOM 3857 3HB ALA D 46 20.784 29.872 11.016 1.00 0.00 H
+ATOM 3858 N GLN D 47 21.680 33.405 11.776 1.00 36.46 N
+ATOM 3859 CA GLN D 47 21.972 34.568 10.948 1.00 33.92 C
+ATOM 3860 C GLN D 47 22.953 34.294 9.830 1.00 32.66 C
+ATOM 3861 O GLN D 47 23.792 33.393 9.917 1.00 31.33 O
+ATOM 3862 CB GLN D 47 22.530 35.725 11.795 1.00 24.62 C
+ATOM 3863 CG GLN D 47 21.555 36.337 12.790 1.00 42.70 C
+ATOM 3864 CD GLN D 47 22.137 37.507 13.531 1.00 32.43 C
+ATOM 3865 OE1 GLN D 47 23.311 37.489 13.923 1.00 38.44 O
+ATOM 3866 NE2 GLN D 47 21.323 38.546 13.730 1.00 31.18 N
+ATOM 3867 H GLN D 47 22.260 33.258 12.602 1.00 0.00 H
+ATOM 3868 HA GLN D 47 21.049 34.904 10.495 1.00 0.00 H
+ATOM 3869 1HB GLN D 47 23.399 35.371 12.355 1.00 0.00 H
+ATOM 3870 2HB GLN D 47 22.877 36.521 11.131 1.00 0.00 H
+ATOM 3871 1HG GLN D 47 20.724 36.726 12.231 1.00 0.00 H
+ATOM 3872 2HG GLN D 47 21.225 35.583 13.508 1.00 0.00 H
+ATOM 3873 1HE2 GLN D 47 21.648 39.358 14.219 1.00 0.00 H
+ATOM 3874 2HE2 GLN D 47 20.378 38.513 13.391 1.00 0.00 H
+ATOM 3875 N PHE D 48 22.886 35.134 8.807 1.00 29.22 N
+ATOM 3876 CA PHE D 48 23.890 35.127 7.753 1.00 34.57 C
+ATOM 3877 C PHE D 48 25.033 35.973 8.290 1.00 34.01 C
+ATOM 3878 O PHE D 48 24.792 36.930 9.027 1.00 35.68 O
+ATOM 3879 CB PHE D 48 23.332 35.690 6.465 1.00 27.73 C
+ATOM 3880 CG PHE D 48 22.276 34.817 5.869 1.00 28.37 C
+ATOM 3881 CD1 PHE D 48 22.599 33.745 5.050 1.00 33.11 C
+ATOM 3882 CD2 PHE D 48 20.941 35.067 6.145 1.00 24.77 C
+ATOM 3883 CE1 PHE D 48 21.596 32.948 4.532 1.00 26.87 C
+ATOM 3884 CE2 PHE D 48 19.951 34.274 5.628 1.00 35.05 C
+ATOM 3885 CZ PHE D 48 20.282 33.213 4.825 1.00 31.82 C
+ATOM 3886 H PHE D 48 22.123 35.812 8.790 1.00 0.00 H
+ATOM 3887 HA PHE D 48 24.248 34.111 7.582 1.00 0.00 H
+ATOM 3888 1HB PHE D 48 22.914 36.675 6.647 1.00 0.00 H
+ATOM 3889 2HB PHE D 48 24.142 35.790 5.742 1.00 0.00 H
+ATOM 3890 HD1 PHE D 48 23.647 33.535 4.824 1.00 0.00 H
+ATOM 3891 HD2 PHE D 48 20.686 35.907 6.789 1.00 0.00 H
+ATOM 3892 HE1 PHE D 48 21.837 32.110 3.902 1.00 0.00 H
+ATOM 3893 HE2 PHE D 48 18.908 34.484 5.859 1.00 0.00 H
+ATOM 3894 HZ PHE D 48 19.511 32.582 4.432 1.00 0.00 H
+ATOM 3895 N THR D 49 26.268 35.577 8.014 1.00 35.19 N
+ATOM 3896 CA THR D 49 27.410 36.245 8.634 1.00 36.13 C
+ATOM 3897 C THR D 49 28.519 36.619 7.681 1.00 37.91 C
+ATOM 3898 O THR D 49 28.442 36.400 6.470 1.00 36.70 O
+ATOM 3899 CB THR D 49 28.054 35.375 9.739 1.00 32.74 C
+ATOM 3900 OG1 THR D 49 28.723 34.251 9.142 1.00 33.58 O
+ATOM 3901 CG2 THR D 49 26.999 34.860 10.721 1.00 22.03 C
+ATOM 3902 H THR D 49 26.404 34.823 7.345 1.00 0.00 H
+ATOM 3903 HA THR D 49 27.054 37.168 9.094 1.00 0.00 H
+ATOM 3904 HB THR D 49 28.777 35.966 10.289 1.00 0.00 H
+ATOM 3905 HG1 THR D 49 28.078 33.540 9.035 1.00 0.00 H
+ATOM 3906 1HG2 THR D 49 27.486 34.258 11.483 1.00 0.00 H
+ATOM 3907 2HG2 THR D 49 26.485 35.697 11.192 1.00 0.00 H
+ATOM 3908 3HG2 THR D 49 26.272 34.246 10.192 1.00 0.00 H
+ATOM 3909 N GLU D 50 29.594 37.134 8.256 1.00 37.78 N
+ATOM 3910 CA GLU D 50 30.827 37.438 7.560 1.00 38.16 C
+ATOM 3911 C GLU D 50 31.373 36.197 6.842 1.00 38.85 C
+ATOM 3912 O GLU D 50 32.094 36.320 5.855 1.00 35.41 O
+ATOM 3913 CB GLU D 50 31.870 37.982 8.543 1.00 41.86 C
+ATOM 3914 CG GLU D 50 33.198 38.396 7.915 1.00 55.44 C
+ATOM 3915 CD GLU D 50 34.153 39.041 8.904 1.00 63.40 C
+ATOM 3916 OE1 GLU D 50 33.781 39.211 10.041 1.00 63.90 O
+ATOM 3917 OE2 GLU D 50 35.255 39.359 8.517 1.00 67.60 O
+ATOM 3918 H GLU D 50 29.563 37.306 9.252 1.00 0.00 H
+ATOM 3919 HA GLU D 50 30.623 38.202 6.807 1.00 0.00 H
+ATOM 3920 1HB GLU D 50 31.464 38.853 9.058 1.00 0.00 H
+ATOM 3921 2HB GLU D 50 32.080 37.224 9.299 1.00 0.00 H
+ATOM 3922 1HG GLU D 50 33.672 37.508 7.497 1.00 0.00 H
+ATOM 3923 2HG GLU D 50 33.002 39.088 7.101 1.00 0.00 H
+ATOM 3924 N HIS D 51 31.081 35.002 7.384 1.00 37.57 N
+ATOM 3925 CA HIS D 51 31.595 33.776 6.794 1.00 39.20 C
+ATOM 3926 C HIS D 51 30.508 32.950 6.089 1.00 36.84 C
+ATOM 3927 O HIS D 51 30.840 32.163 5.204 1.00 38.51 O
+ATOM 3928 CB HIS D 51 32.287 32.927 7.873 1.00 34.83 C
+ATOM 3929 CG HIS D 51 33.511 33.593 8.467 1.00 33.67 C
+ATOM 3930 ND1 HIS D 51 33.435 34.523 9.483 1.00 33.33 N
+ATOM 3931 CD2 HIS D 51 34.827 33.456 8.180 1.00 30.29 C
+ATOM 3932 CE1 HIS D 51 34.655 34.936 9.790 1.00 26.49 C
+ATOM 3933 NE2 HIS D 51 35.517 34.302 9.016 1.00 31.55 N
+ATOM 3934 H HIS D 51 30.459 34.933 8.180 1.00 0.00 H
+ATOM 3935 HA HIS D 51 32.343 34.028 6.046 1.00 0.00 H
+ATOM 3936 1HB HIS D 51 31.584 32.715 8.683 1.00 0.00 H
+ATOM 3937 2HB HIS D 51 32.587 31.972 7.443 1.00 0.00 H
+ATOM 3938 HD2 HIS D 51 35.260 32.800 7.426 1.00 0.00 H
+ATOM 3939 HE1 HIS D 51 34.904 35.677 10.554 1.00 0.00 H
+ATOM 3940 HE2 HIS D 51 36.521 34.420 9.029 1.00 0.00 H
+ATOM 3941 N THR D 52 29.223 33.149 6.436 1.00 37.72 N
+ATOM 3942 CA THR D 52 28.131 32.377 5.800 1.00 35.74 C
+ATOM 3943 C THR D 52 27.263 33.233 4.872 1.00 35.77 C
+ATOM 3944 O THR D 52 26.572 34.147 5.327 1.00 33.47 O
+ATOM 3945 CB THR D 52 27.174 31.748 6.844 1.00 34.29 C
+ATOM 3946 OG1 THR D 52 27.894 30.856 7.701 1.00 30.43 O
+ATOM 3947 CG2 THR D 52 26.040 30.969 6.137 1.00 31.02 C
+ATOM 3948 H THR D 52 29.014 33.805 7.180 1.00 0.00 H
+ATOM 3949 HA THR D 52 28.574 31.580 5.204 1.00 0.00 H
+ATOM 3950 HB THR D 52 26.729 32.536 7.451 1.00 0.00 H
+ATOM 3951 HG1 THR D 52 28.457 31.362 8.290 1.00 0.00 H
+ATOM 3952 1HG2 THR D 52 25.372 30.536 6.882 1.00 0.00 H
+ATOM 3953 2HG2 THR D 52 25.471 31.643 5.497 1.00 0.00 H
+ATOM 3954 3HG2 THR D 52 26.469 30.172 5.530 1.00 0.00 H
+ATOM 3955 N SER D 53 27.260 32.888 3.577 1.00 35.21 N
+ATOM 3956 CA SER D 53 26.479 33.636 2.583 1.00 36.50 C
+ATOM 3957 C SER D 53 25.199 32.909 2.212 1.00 37.36 C
+ATOM 3958 O SER D 53 24.270 33.500 1.651 1.00 34.46 O
+ATOM 3959 CB SER D 53 27.287 33.875 1.333 1.00 36.82 C
+ATOM 3960 OG SER D 53 27.606 32.674 0.690 1.00 32.64 O
+ATOM 3961 H SER D 53 27.824 32.093 3.283 1.00 0.00 H
+ATOM 3962 HA SER D 53 26.208 34.600 3.012 1.00 0.00 H
+ATOM 3963 1HB SER D 53 26.720 34.511 0.658 1.00 0.00 H
+ATOM 3964 2HB SER D 53 28.186 34.402 1.591 1.00 0.00 H
+ATOM 3965 HG SER D 53 27.916 32.071 1.383 1.00 0.00 H
+ATOM 3966 N ALA D 54 25.151 31.619 2.517 1.00 35.60 N
+ATOM 3967 CA ALA D 54 23.958 30.854 2.194 1.00 38.24 C
+ATOM 3968 C ALA D 54 23.764 29.712 3.175 1.00 38.37 C
+ATOM 3969 O ALA D 54 24.725 29.178 3.736 1.00 34.70 O
+ATOM 3970 CB ALA D 54 24.017 30.338 0.766 1.00 28.06 C
+ATOM 3971 H ALA D 54 25.961 31.174 2.942 1.00 0.00 H
+ATOM 3972 HA ALA D 54 23.104 31.515 2.279 1.00 0.00 H
+ATOM 3973 1HB ALA D 54 23.098 29.800 0.547 1.00 0.00 H
+ATOM 3974 2HB ALA D 54 24.118 31.182 0.086 1.00 0.00 H
+ATOM 3975 3HB ALA D 54 24.845 29.687 0.634 1.00 0.00 H
+ATOM 3976 N ILE D 55 22.504 29.330 3.351 1.00 38.67 N
+ATOM 3977 CA ILE D 55 22.131 28.211 4.199 1.00 39.91 C
+ATOM 3978 C ILE D 55 21.394 27.132 3.411 1.00 39.19 C
+ATOM 3979 O ILE D 55 20.400 27.400 2.738 1.00 39.48 O
+ATOM 3980 CB ILE D 55 21.269 28.685 5.392 1.00 41.40 C
+ATOM 3981 CG1 ILE D 55 22.095 29.673 6.276 1.00 38.43 C
+ATOM 3982 CG2 ILE D 55 20.789 27.483 6.198 1.00 28.35 C
+ATOM 3983 CD1 ILE D 55 21.289 30.398 7.343 1.00 30.70 C
+ATOM 3984 H ILE D 55 21.776 29.830 2.851 1.00 0.00 H
+ATOM 3985 HA ILE D 55 23.039 27.776 4.600 1.00 0.00 H
+ATOM 3986 HB ILE D 55 20.405 29.233 5.016 1.00 0.00 H
+ATOM 3987 1HG1 ILE D 55 22.893 29.112 6.764 1.00 0.00 H
+ATOM 3988 2HG1 ILE D 55 22.547 30.421 5.637 1.00 0.00 H
+ATOM 3989 1HG2 ILE D 55 20.175 27.819 7.032 1.00 0.00 H
+ATOM 3990 2HG2 ILE D 55 20.199 26.824 5.560 1.00 0.00 H
+ATOM 3991 3HG2 ILE D 55 21.656 26.939 6.574 1.00 0.00 H
+ATOM 3992 1HD1 ILE D 55 21.948 31.065 7.908 1.00 0.00 H
+ATOM 3993 2HD1 ILE D 55 20.505 30.986 6.869 1.00 0.00 H
+ATOM 3994 3HD1 ILE D 55 20.841 29.675 8.023 1.00 0.00 H
+ATOM 3995 N LYS D 56 21.891 25.909 3.486 1.00 41.17 N
+ATOM 3996 CA LYS D 56 21.270 24.797 2.774 1.00 43.41 C
+ATOM 3997 C LYS D 56 20.659 23.818 3.768 1.00 43.46 C
+ATOM 3998 O LYS D 56 21.290 23.472 4.759 1.00 40.79 O
+ATOM 3999 CB LYS D 56 22.299 24.118 1.871 1.00 42.92 C
+ATOM 4000 CG LYS D 56 21.799 22.965 1.043 1.00 50.50 C
+ATOM 4001 CD LYS D 56 22.936 22.429 0.190 1.00 47.04 C
+ATOM 4002 CE LYS D 56 22.481 21.332 -0.747 1.00 62.47 C
+ATOM 4003 NZ LYS D 56 23.594 20.872 -1.608 1.00 45.76 N
+ATOM 4004 H LYS D 56 22.725 25.757 4.049 1.00 0.00 H
+ATOM 4005 HA LYS D 56 20.468 25.181 2.151 1.00 0.00 H
+ATOM 4006 1HB LYS D 56 22.695 24.854 1.173 1.00 0.00 H
+ATOM 4007 2HB LYS D 56 23.124 23.768 2.453 1.00 0.00 H
+ATOM 4008 1HG LYS D 56 21.429 22.168 1.692 1.00 0.00 H
+ATOM 4009 2HG LYS D 56 20.979 23.298 0.397 1.00 0.00 H
+ATOM 4010 1HD LYS D 56 23.366 23.241 -0.407 1.00 0.00 H
+ATOM 4011 2HD LYS D 56 23.715 22.033 0.842 1.00 0.00 H
+ATOM 4012 1HE LYS D 56 22.094 20.484 -0.179 1.00 0.00 H
+ATOM 4013 2HE LYS D 56 21.694 21.716 -1.369 1.00 0.00 H
+ATOM 4014 1HZ LYS D 56 23.263 20.156 -2.252 1.00 0.00 H
+ATOM 4015 2HZ LYS D 56 23.968 21.670 -2.141 1.00 0.00 H
+ATOM 4016 3HZ LYS D 56 24.325 20.497 -1.036 1.00 0.00 H
+ATOM 4017 N VAL D 57 19.415 23.407 3.541 1.00 41.81 N
+ATOM 4018 CA VAL D 57 18.777 22.492 4.476 1.00 42.73 C
+ATOM 4019 C VAL D 57 18.392 21.166 3.819 1.00 44.28 C
+ATOM 4020 O VAL D 57 17.719 21.130 2.778 1.00 42.88 O
+ATOM 4021 CB VAL D 57 17.521 23.136 5.101 1.00 41.59 C
+ATOM 4022 CG1 VAL D 57 16.869 22.148 6.096 1.00 36.45 C
+ATOM 4023 CG2 VAL D 57 17.905 24.447 5.786 1.00 31.04 C
+ATOM 4024 H VAL D 57 18.917 23.737 2.723 1.00 0.00 H
+ATOM 4025 HA VAL D 57 19.474 22.282 5.282 1.00 0.00 H
+ATOM 4026 HB VAL D 57 16.795 23.339 4.317 1.00 0.00 H
+ATOM 4027 1HG1 VAL D 57 15.979 22.591 6.532 1.00 0.00 H
+ATOM 4028 2HG1 VAL D 57 16.589 21.226 5.583 1.00 0.00 H
+ATOM 4029 3HG1 VAL D 57 17.580 21.914 6.892 1.00 0.00 H
+ATOM 4030 1HG2 VAL D 57 17.015 24.899 6.208 1.00 0.00 H
+ATOM 4031 2HG2 VAL D 57 18.625 24.247 6.570 1.00 0.00 H
+ATOM 4032 3HG2 VAL D 57 18.342 25.128 5.056 1.00 0.00 H
+ATOM 4033 N ARG D 58 18.836 20.073 4.445 1.00 46.39 N
+ATOM 4034 CA ARG D 58 18.537 18.710 4.007 1.00 45.57 C
+ATOM 4035 C ARG D 58 17.815 17.923 5.098 1.00 44.94 C
+ATOM 4036 O ARG D 58 18.266 17.852 6.242 1.00 46.05 O
+ATOM 4037 CB ARG D 58 19.800 17.947 3.627 1.00 57.65 C
+ATOM 4038 CG ARG D 58 19.546 16.472 3.263 1.00 63.97 C
+ATOM 4039 CD ARG D 58 20.792 15.718 2.926 1.00 68.83 C
+ATOM 4040 NE ARG D 58 21.364 16.113 1.657 1.00 77.75 N
+ATOM 4041 CZ ARG D 58 22.515 15.629 1.145 1.00 87.78 C
+ATOM 4042 NH1 ARG D 58 23.223 14.733 1.803 1.00 84.82 N
+ATOM 4043 NH2 ARG D 58 22.916 16.068 -0.030 1.00 91.25 N
+ATOM 4044 H ARG D 58 19.407 20.206 5.280 1.00 0.00 H
+ATOM 4045 HA ARG D 58 17.888 18.761 3.132 1.00 0.00 H
+ATOM 4046 1HB ARG D 58 20.272 18.426 2.766 1.00 0.00 H
+ATOM 4047 2HB ARG D 58 20.509 17.975 4.453 1.00 0.00 H
+ATOM 4048 1HG ARG D 58 19.081 15.967 4.110 1.00 0.00 H
+ATOM 4049 2HG ARG D 58 18.876 16.428 2.401 1.00 0.00 H
+ATOM 4050 1HD ARG D 58 21.534 15.892 3.702 1.00 0.00 H
+ATOM 4051 2HD ARG D 58 20.562 14.655 2.878 1.00 0.00 H
+ATOM 4052 HE ARG D 58 20.866 16.806 1.088 1.00 0.00 H
+ATOM 4053 1HH1 ARG D 58 22.909 14.400 2.702 1.00 0.00 H
+ATOM 4054 2HH1 ARG D 58 24.081 14.381 1.405 1.00 0.00 H
+ATOM 4055 1HH2 ARG D 58 22.335 16.765 -0.509 1.00 0.00 H
+ATOM 4056 2HH2 ARG D 58 23.767 15.726 -0.444 1.00 0.00 H
+ATOM 4057 N GLY D 59 16.708 17.295 4.735 1.00 45.33 N
+ATOM 4058 CA GLY D 59 15.914 16.548 5.703 1.00 45.38 C
+ATOM 4059 C GLY D 59 14.630 17.307 5.950 1.00 41.90 C
+ATOM 4060 O GLY D 59 14.587 18.524 5.792 1.00 40.78 O
+ATOM 4061 H GLY D 59 16.378 17.363 3.778 1.00 0.00 H
+ATOM 4062 1HA GLY D 59 15.691 15.551 5.329 1.00 0.00 H
+ATOM 4063 2HA GLY D 59 16.463 16.433 6.634 1.00 0.00 H
+ATOM 4064 N LYS D 60 13.575 16.590 6.291 1.00 42.35 N
+ATOM 4065 CA LYS D 60 12.275 17.220 6.464 1.00 43.43 C
+ATOM 4066 C LYS D 60 12.332 18.260 7.571 1.00 40.02 C
+ATOM 4067 O LYS D 60 12.760 17.960 8.692 1.00 37.51 O
+ATOM 4068 CB LYS D 60 11.225 16.152 6.753 1.00 39.47 C
+ATOM 4069 CG LYS D 60 9.792 16.611 6.759 1.00 37.78 C
+ATOM 4070 CD LYS D 60 8.876 15.427 7.087 1.00 41.76 C
+ATOM 4071 CE LYS D 60 7.408 15.808 7.042 1.00 44.88 C
+ATOM 4072 NZ LYS D 60 6.920 15.943 5.633 1.00 51.14 N
+ATOM 4073 H LYS D 60 13.673 15.586 6.422 1.00 0.00 H
+ATOM 4074 HA LYS D 60 12.016 17.729 5.550 1.00 0.00 H
+ATOM 4075 1HB LYS D 60 11.305 15.367 5.994 1.00 0.00 H
+ATOM 4076 2HB LYS D 60 11.419 15.697 7.710 1.00 0.00 H
+ATOM 4077 1HG LYS D 60 9.655 17.403 7.471 1.00 0.00 H
+ATOM 4078 2HG LYS D 60 9.538 16.993 5.769 1.00 0.00 H
+ATOM 4079 1HD LYS D 60 9.057 14.634 6.357 1.00 0.00 H
+ATOM 4080 2HD LYS D 60 9.123 15.043 8.082 1.00 0.00 H
+ATOM 4081 1HE LYS D 60 6.819 15.051 7.559 1.00 0.00 H
+ATOM 4082 2HE LYS D 60 7.274 16.752 7.541 1.00 0.00 H
+ATOM 4083 1HZ LYS D 60 5.948 16.205 5.632 1.00 0.00 H
+ATOM 4084 2HZ LYS D 60 7.460 16.651 5.144 1.00 0.00 H
+ATOM 4085 3HZ LYS D 60 7.031 15.050 5.160 1.00 0.00 H
+ATOM 4086 N ALA D 61 11.893 19.474 7.259 1.00 39.81 N
+ATOM 4087 CA ALA D 61 11.956 20.550 8.239 1.00 39.48 C
+ATOM 4088 C ALA D 61 10.989 21.674 7.921 1.00 38.42 C
+ATOM 4089 O ALA D 61 10.624 21.894 6.764 1.00 38.68 O
+ATOM 4090 CB ALA D 61 13.364 21.112 8.326 1.00 38.39 C
+ATOM 4091 H ALA D 61 11.533 19.634 6.320 1.00 0.00 H
+ATOM 4092 HA ALA D 61 11.691 20.131 9.203 1.00 0.00 H
+ATOM 4093 1HB ALA D 61 13.403 21.880 9.085 1.00 0.00 H
+ATOM 4094 2HB ALA D 61 14.038 20.312 8.581 1.00 0.00 H
+ATOM 4095 3HB ALA D 61 13.653 21.543 7.381 1.00 0.00 H
+ATOM 4096 N TYR D 62 10.615 22.426 8.944 1.00 37.16 N
+ATOM 4097 CA TYR D 62 9.778 23.598 8.725 1.00 36.97 C
+ATOM 4098 C TYR D 62 10.683 24.815 8.787 1.00 36.47 C
+ATOM 4099 O TYR D 62 11.392 25.011 9.775 1.00 34.92 O
+ATOM 4100 CB TYR D 62 8.666 23.693 9.770 1.00 34.30 C
+ATOM 4101 CG TYR D 62 7.653 24.791 9.481 1.00 30.19 C
+ATOM 4102 CD1 TYR D 62 6.683 24.558 8.522 1.00 29.74 C
+ATOM 4103 CD2 TYR D 62 7.682 26.005 10.151 1.00 29.81 C
+ATOM 4104 CE1 TYR D 62 5.743 25.514 8.226 1.00 27.52 C
+ATOM 4105 CE2 TYR D 62 6.729 26.971 9.854 1.00 28.43 C
+ATOM 4106 CZ TYR D 62 5.761 26.721 8.894 1.00 31.07 C
+ATOM 4107 OH TYR D 62 4.800 27.660 8.597 1.00 31.61 O
+ATOM 4108 H TYR D 62 10.953 22.183 9.872 1.00 0.00 H
+ATOM 4109 HA TYR D 62 9.335 23.552 7.732 1.00 0.00 H
+ATOM 4110 1HB TYR D 62 8.134 22.742 9.819 1.00 0.00 H
+ATOM 4111 2HB TYR D 62 9.099 23.879 10.745 1.00 0.00 H
+ATOM 4112 HD1 TYR D 62 6.662 23.608 8.004 1.00 0.00 H
+ATOM 4113 HD2 TYR D 62 8.443 26.194 10.904 1.00 0.00 H
+ATOM 4114 HE1 TYR D 62 4.982 25.312 7.470 1.00 0.00 H
+ATOM 4115 HE2 TYR D 62 6.738 27.922 10.378 1.00 0.00 H
+ATOM 4116 HH TYR D 62 4.954 28.452 9.113 1.00 0.00 H
+ATOM 4117 N ILE D 63 10.700 25.607 7.719 1.00 36.72 N
+ATOM 4118 CA ILE D 63 11.604 26.745 7.653 1.00 31.64 C
+ATOM 4119 C ILE D 63 10.860 28.085 7.583 1.00 30.48 C
+ATOM 4120 O ILE D 63 9.921 28.251 6.800 1.00 29.70 O
+ATOM 4121 CB ILE D 63 12.525 26.609 6.434 1.00 31.08 C
+ATOM 4122 CG1 ILE D 63 13.313 25.306 6.511 1.00 32.31 C
+ATOM 4123 CG2 ILE D 63 13.487 27.789 6.377 1.00 16.93 C
+ATOM 4124 CD1 ILE D 63 14.007 24.962 5.221 1.00 31.40 C
+ATOM 4125 H ILE D 63 10.116 25.409 6.910 1.00 0.00 H
+ATOM 4126 HA ILE D 63 12.215 26.728 8.537 1.00 0.00 H
+ATOM 4127 HB ILE D 63 11.936 26.578 5.549 1.00 0.00 H
+ATOM 4128 1HG1 ILE D 63 14.049 25.386 7.300 1.00 0.00 H
+ATOM 4129 2HG1 ILE D 63 12.632 24.490 6.751 1.00 0.00 H
+ATOM 4130 1HG2 ILE D 63 14.121 27.675 5.514 1.00 0.00 H
+ATOM 4131 2HG2 ILE D 63 12.926 28.714 6.296 1.00 0.00 H
+ATOM 4132 3HG2 ILE D 63 14.095 27.812 7.281 1.00 0.00 H
+ATOM 4133 1HD1 ILE D 63 14.539 24.026 5.336 1.00 0.00 H
+ATOM 4134 2HD1 ILE D 63 13.265 24.858 4.427 1.00 0.00 H
+ATOM 4135 3HD1 ILE D 63 14.710 25.750 4.960 1.00 0.00 H
+ATOM 4136 N GLN D 64 11.269 29.046 8.418 1.00 31.71 N
+ATOM 4137 CA GLN D 64 10.648 30.373 8.402 1.00 32.77 C
+ATOM 4138 C GLN D 64 11.679 31.423 7.996 1.00 32.81 C
+ATOM 4139 O GLN D 64 12.753 31.508 8.601 1.00 34.31 O
+ATOM 4140 CB GLN D 64 10.087 30.742 9.791 1.00 29.02 C
+ATOM 4141 CG GLN D 64 9.035 29.775 10.354 1.00 25.62 C
+ATOM 4142 CD GLN D 64 8.632 30.066 11.825 1.00 35.61 C
+ATOM 4143 OE1 GLN D 64 9.496 30.159 12.699 1.00 35.18 O
+ATOM 4144 NE2 GLN D 64 7.325 30.180 12.085 1.00 30.83 N
+ATOM 4145 H GLN D 64 12.035 28.836 9.053 1.00 0.00 H
+ATOM 4146 HA GLN D 64 9.854 30.387 7.665 1.00 0.00 H
+ATOM 4147 1HB GLN D 64 10.872 30.877 10.489 1.00 0.00 H
+ATOM 4148 2HB GLN D 64 9.592 31.710 9.705 1.00 0.00 H
+ATOM 4149 1HG GLN D 64 8.138 29.839 9.758 1.00 0.00 H
+ATOM 4150 2HG GLN D 64 9.436 28.762 10.311 1.00 0.00 H
+ATOM 4151 1HE2 GLN D 64 6.983 30.336 13.034 1.00 0.00 H
+ATOM 4152 2HE2 GLN D 64 6.654 30.103 11.353 1.00 0.00 H
+ATOM 4153 N THR D 65 11.368 32.229 6.977 1.00 33.25 N
+ATOM 4154 CA THR D 65 12.299 33.266 6.547 1.00 35.12 C
+ATOM 4155 C THR D 65 11.562 34.586 6.382 1.00 34.82 C
+ATOM 4156 O THR D 65 10.327 34.644 6.416 1.00 35.99 O
+ATOM 4157 CB THR D 65 12.942 32.957 5.180 1.00 30.73 C
+ATOM 4158 OG1 THR D 65 11.990 33.218 4.141 1.00 36.55 O
+ATOM 4159 CG2 THR D 65 13.332 31.496 5.103 1.00 27.87 C
+ATOM 4160 H THR D 65 10.493 32.117 6.466 1.00 0.00 H
+ATOM 4161 HA THR D 65 13.075 33.399 7.301 1.00 0.00 H
+ATOM 4162 HB THR D 65 13.821 33.571 5.044 1.00 0.00 H
+ATOM 4163 HG1 THR D 65 11.177 32.691 4.305 1.00 0.00 H
+ATOM 4164 1HG2 THR D 65 13.777 31.294 4.133 1.00 0.00 H
+ATOM 4165 2HG2 THR D 65 14.045 31.262 5.887 1.00 0.00 H
+ATOM 4166 3HG2 THR D 65 12.443 30.878 5.226 1.00 0.00 H
+ATOM 4167 N ARG D 66 12.307 35.643 6.104 1.00 34.76 N
+ATOM 4168 CA ARG D 66 11.723 36.950 5.847 1.00 36.10 C
+ATOM 4169 C ARG D 66 10.813 36.975 4.608 1.00 37.20 C
+ATOM 4170 O ARG D 66 9.998 37.887 4.474 1.00 34.95 O
+ATOM 4171 CB ARG D 66 12.797 38.031 5.722 1.00 31.49 C
+ATOM 4172 CG ARG D 66 12.236 39.439 5.527 1.00 51.27 C
+ATOM 4173 CD ARG D 66 13.203 40.533 5.919 1.00 62.51 C
+ATOM 4174 NE ARG D 66 14.425 40.541 5.162 1.00 62.52 N
+ATOM 4175 CZ ARG D 66 14.576 41.064 3.937 1.00 72.90 C
+ATOM 4176 NH1 ARG D 66 15.754 41.033 3.370 1.00 66.56 N
+ATOM 4177 NH2 ARG D 66 13.547 41.618 3.311 1.00 66.85 N
+ATOM 4178 H ARG D 66 13.311 35.536 6.095 1.00 0.00 H
+ATOM 4179 HA ARG D 66 11.110 37.214 6.705 1.00 0.00 H
+ATOM 4180 1HB ARG D 66 13.451 38.022 6.591 1.00 0.00 H
+ATOM 4181 2HB ARG D 66 13.405 37.826 4.847 1.00 0.00 H
+ATOM 4182 1HG ARG D 66 11.981 39.568 4.473 1.00 0.00 H
+ATOM 4183 2HG ARG D 66 11.335 39.552 6.130 1.00 0.00 H
+ATOM 4184 1HD ARG D 66 12.723 41.502 5.787 1.00 0.00 H
+ATOM 4185 2HD ARG D 66 13.471 40.405 6.965 1.00 0.00 H
+ATOM 4186 HE ARG D 66 15.262 40.157 5.621 1.00 0.00 H
+ATOM 4187 1HH1 ARG D 66 16.551 40.602 3.871 1.00 0.00 H
+ATOM 4188 2HH1 ARG D 66 15.878 41.427 2.448 1.00 0.00 H
+ATOM 4189 1HH2 ARG D 66 12.639 41.641 3.753 1.00 0.00 H
+ATOM 4190 2HH2 ARG D 66 13.674 42.015 2.392 1.00 0.00 H
+ATOM 4191 N HIS D 67 10.982 36.017 3.689 1.00 36.65 N
+ATOM 4192 CA HIS D 67 10.186 36.026 2.465 1.00 39.38 C
+ATOM 4193 C HIS D 67 9.105 34.944 2.475 1.00 38.25 C
+ATOM 4194 O HIS D 67 8.563 34.583 1.430 1.00 37.05 O
+ATOM 4195 CB HIS D 67 11.074 35.904 1.219 1.00 32.56 C
+ATOM 4196 CG HIS D 67 12.019 37.066 1.081 1.00 30.79 C
+ATOM 4197 ND1 HIS D 67 11.586 38.368 1.142 1.00 33.65 N
+ATOM 4198 CD2 HIS D 67 13.350 37.130 0.833 1.00 32.61 C
+ATOM 4199 CE1 HIS D 67 12.608 39.183 0.967 1.00 23.10 C
+ATOM 4200 NE2 HIS D 67 13.685 38.470 0.768 1.00 36.43 N
+ATOM 4201 H HIS D 67 11.616 35.241 3.845 1.00 0.00 H
+ATOM 4202 HA HIS D 67 9.670 36.979 2.388 1.00 0.00 H
+ATOM 4203 1HB HIS D 67 11.653 34.978 1.257 1.00 0.00 H
+ATOM 4204 2HB HIS D 67 10.445 35.868 0.326 1.00 0.00 H
+ATOM 4205 HD2 HIS D 67 14.025 36.288 0.696 1.00 0.00 H
+ATOM 4206 HE1 HIS D 67 12.563 40.266 0.964 1.00 0.00 H
+ATOM 4207 HE2 HIS D 67 14.619 38.878 0.582 1.00 0.00 H
+ATOM 4208 N GLY D 68 8.772 34.444 3.668 1.00 36.16 N
+ATOM 4209 CA GLY D 68 7.720 33.444 3.796 1.00 32.69 C
+ATOM 4210 C GLY D 68 8.225 32.157 4.420 1.00 35.32 C
+ATOM 4211 O GLY D 68 9.383 32.063 4.844 1.00 35.91 O
+ATOM 4212 H GLY D 68 9.256 34.757 4.508 1.00 0.00 H
+ATOM 4213 1HA GLY D 68 6.910 33.850 4.404 1.00 0.00 H
+ATOM 4214 2HA GLY D 68 7.300 33.226 2.816 1.00 0.00 H
+ATOM 4215 N VAL D 69 7.347 31.164 4.484 1.00 36.05 N
+ATOM 4216 CA VAL D 69 7.709 29.903 5.101 1.00 38.52 C
+ATOM 4217 C VAL D 69 7.747 28.836 4.036 1.00 41.42 C
+ATOM 4218 O VAL D 69 7.053 28.936 3.020 1.00 40.10 O
+ATOM 4219 CB VAL D 69 6.700 29.515 6.193 1.00 39.30 C
+ATOM 4220 CG1 VAL D 69 6.681 30.575 7.282 1.00 28.66 C
+ATOM 4221 CG2 VAL D 69 5.328 29.347 5.576 1.00 31.40 C
+ATOM 4222 H VAL D 69 6.416 31.292 4.113 1.00 0.00 H
+ATOM 4223 HA VAL D 69 8.699 29.992 5.543 1.00 0.00 H
+ATOM 4224 HB VAL D 69 7.016 28.573 6.654 1.00 0.00 H
+ATOM 4225 1HG1 VAL D 69 5.979 30.282 8.062 1.00 0.00 H
+ATOM 4226 2HG1 VAL D 69 7.662 30.672 7.703 1.00 0.00 H
+ATOM 4227 3HG1 VAL D 69 6.376 31.530 6.863 1.00 0.00 H
+ATOM 4228 1HG2 VAL D 69 4.616 29.060 6.346 1.00 0.00 H
+ATOM 4229 2HG2 VAL D 69 5.015 30.287 5.123 1.00 0.00 H
+ATOM 4230 3HG2 VAL D 69 5.370 28.569 4.813 1.00 0.00 H
+ATOM 4231 N ILE D 70 8.585 27.840 4.250 1.00 40.54 N
+ATOM 4232 CA ILE D 70 8.754 26.775 3.285 1.00 41.17 C
+ATOM 4233 C ILE D 70 9.105 25.472 3.990 1.00 42.99 C
+ATOM 4234 O ILE D 70 9.762 25.486 5.029 1.00 46.29 O
+ATOM 4235 CB ILE D 70 9.851 27.179 2.275 1.00 42.47 C
+ATOM 4236 CG1 ILE D 70 9.882 26.260 1.103 1.00 43.58 C
+ATOM 4237 CG2 ILE D 70 11.206 27.179 2.954 1.00 51.59 C
+ATOM 4238 CD1 ILE D 70 10.670 26.840 -0.025 1.00 39.65 C
+ATOM 4239 H ILE D 70 9.120 27.835 5.116 1.00 0.00 H
+ATOM 4240 HA ILE D 70 7.815 26.635 2.750 1.00 0.00 H
+ATOM 4241 HB ILE D 70 9.646 28.176 1.897 1.00 0.00 H
+ATOM 4242 1HG1 ILE D 70 10.334 25.310 1.391 1.00 0.00 H
+ATOM 4243 2HG1 ILE D 70 8.863 26.073 0.764 1.00 0.00 H
+ATOM 4244 1HG2 ILE D 70 11.969 27.473 2.245 1.00 0.00 H
+ATOM 4245 2HG2 ILE D 70 11.193 27.879 3.787 1.00 0.00 H
+ATOM 4246 3HG2 ILE D 70 11.421 26.172 3.316 1.00 0.00 H
+ATOM 4247 1HD1 ILE D 70 10.654 26.159 -0.844 1.00 0.00 H
+ATOM 4248 2HD1 ILE D 70 10.227 27.788 -0.336 1.00 0.00 H
+ATOM 4249 3HD1 ILE D 70 11.689 27.006 0.297 1.00 0.00 H
+ATOM 4250 N GLU D 71 8.672 24.349 3.445 1.00 41.35 N
+ATOM 4251 CA GLU D 71 9.067 23.079 4.035 1.00 41.91 C
+ATOM 4252 C GLU D 71 10.114 22.375 3.191 1.00 42.61 C
+ATOM 4253 O GLU D 71 10.013 22.336 1.959 1.00 42.42 O
+ATOM 4254 CB GLU D 71 7.855 22.157 4.208 1.00 33.03 C
+ATOM 4255 CG GLU D 71 6.840 22.618 5.241 1.00 32.29 C
+ATOM 4256 CD GLU D 71 5.634 21.699 5.339 1.00 44.06 C
+ATOM 4257 OE1 GLU D 71 5.458 21.068 6.357 1.00 51.88 O
+ATOM 4258 OE2 GLU D 71 4.891 21.636 4.389 1.00 53.91 O
+ATOM 4259 H GLU D 71 8.100 24.378 2.612 1.00 0.00 H
+ATOM 4260 HA GLU D 71 9.500 23.268 5.018 1.00 0.00 H
+ATOM 4261 1HB GLU D 71 7.339 22.052 3.254 1.00 0.00 H
+ATOM 4262 2HB GLU D 71 8.204 21.166 4.503 1.00 0.00 H
+ATOM 4263 1HG GLU D 71 7.346 22.636 6.200 1.00 0.00 H
+ATOM 4264 2HG GLU D 71 6.514 23.631 5.010 1.00 0.00 H
+ATOM 4265 N SER D 72 11.091 21.778 3.866 1.00 42.42 N
+ATOM 4266 CA SER D 72 12.110 20.954 3.221 1.00 42.47 C
+ATOM 4267 C SER D 72 11.670 19.509 3.375 1.00 44.88 C
+ATOM 4268 O SER D 72 10.798 19.232 4.203 1.00 43.18 O
+ATOM 4269 CB SER D 72 13.486 21.220 3.810 1.00 37.06 C
+ATOM 4270 OG SER D 72 13.557 20.823 5.134 1.00 31.23 O
+ATOM 4271 H SER D 72 11.092 21.868 4.879 1.00 0.00 H
+ATOM 4272 HA SER D 72 12.148 21.185 2.156 1.00 0.00 H
+ATOM 4273 1HB SER D 72 14.251 20.700 3.226 1.00 0.00 H
+ATOM 4274 2HB SER D 72 13.694 22.279 3.746 1.00 0.00 H
+ATOM 4275 HG SER D 72 13.816 19.885 5.139 1.00 0.00 H
+ATOM 4276 N GLU D 73 12.288 18.594 2.632 1.00 45.63 N
+ATOM 4277 CA GLU D 73 11.914 17.173 2.657 1.00 49.48 C
+ATOM 4278 C GLU D 73 13.148 16.252 2.668 1.00 50.07 C
+ATOM 4279 O GLU D 73 14.270 16.685 2.402 1.00 49.88 O
+ATOM 4280 CB GLU D 73 10.961 16.887 1.476 1.00 49.23 C
+ATOM 4281 CG GLU D 73 10.389 15.458 1.333 1.00 41.84 C
+ATOM 4282 CD GLU D 73 9.569 14.973 2.523 1.00 47.42 C
+ATOM 4283 OE1 GLU D 73 8.369 15.117 2.519 1.00 45.00 O
+ATOM 4284 OE2 GLU D 73 10.163 14.470 3.436 1.00 47.59 O
+ATOM 4285 H GLU D 73 13.014 18.901 1.987 1.00 0.00 H
+ATOM 4286 HA GLU D 73 11.348 16.979 3.566 1.00 0.00 H
+ATOM 4287 1HB GLU D 73 10.101 17.546 1.565 1.00 0.00 H
+ATOM 4288 2HB GLU D 73 11.450 17.133 0.547 1.00 0.00 H
+ATOM 4289 1HG GLU D 73 9.738 15.459 0.461 1.00 0.00 H
+ATOM 4290 2HG GLU D 73 11.196 14.760 1.120 1.00 0.00 H
+ATOM 4291 N GLY D 74 12.938 15.000 3.071 1.00 51.62 N
+ATOM 4292 CA GLY D 74 14.010 14.016 3.105 1.00 53.91 C
+ATOM 4293 C GLY D 74 14.169 13.321 1.755 1.00 55.67 C
+ATOM 4294 O GLY D 74 13.618 13.766 0.750 1.00 56.63 O
+ATOM 4295 H GLY D 74 11.990 14.711 3.312 1.00 0.00 H
+ATOM 4296 1HA GLY D 74 14.941 14.504 3.382 1.00 0.00 H
+ATOM 4297 2HA GLY D 74 13.793 13.276 3.875 1.00 0.00 H
+ATOM 4298 N LYS D 75 14.939 12.237 1.742 1.00 57.67 N
+ATOM 4299 CA LYS D 75 15.195 11.487 0.519 1.00 58.92 C
+ATOM 4300 C LYS D 75 14.629 10.079 0.635 1.00 59.91 C
+ATOM 4301 O LYS D 75 14.454 9.575 1.744 1.00 63.21 O
+ATOM 4302 OXT LYS D 75 14.187 9.518 -0.366 1.00 0.00 O
+ATOM 4303 CB LYS D 75 16.695 11.437 0.224 1.00 54.81 C
+ATOM 4304 CG LYS D 75 17.069 10.678 -1.044 1.00 60.93 C
+ATOM 4305 CD LYS D 75 18.574 10.744 -1.299 1.00 45.00 C
+ATOM 4306 CE LYS D 75 18.967 9.992 -2.568 1.00 45.00 C
+ATOM 4307 NZ LYS D 75 20.443 10.053 -2.813 1.00 45.00 N
+ATOM 4308 H LYS D 75 15.361 11.930 2.606 1.00 0.00 H
+ATOM 4309 HA LYS D 75 14.694 11.985 -0.312 1.00 0.00 H
+ATOM 4310 1HB LYS D 75 17.077 12.453 0.123 1.00 0.00 H
+ATOM 4311 2HB LYS D 75 17.216 10.969 1.060 1.00 0.00 H
+ATOM 4312 1HG LYS D 75 16.774 9.632 -0.937 1.00 0.00 H
+ATOM 4313 2HG LYS D 75 16.539 11.104 -1.898 1.00 0.00 H
+ATOM 4314 1HD LYS D 75 18.873 11.787 -1.402 1.00 0.00 H
+ATOM 4315 2HD LYS D 75 19.106 10.314 -0.448 1.00 0.00 H
+ATOM 4316 1HE LYS D 75 18.666 8.948 -2.476 1.00 0.00 H
+ATOM 4317 2HE LYS D 75 18.449 10.435 -3.419 1.00 0.00 H
+ATOM 4318 1HZ LYS D 75 20.670 9.550 -3.660 1.00 0.00 H
+ATOM 4319 2HZ LYS D 75 20.728 11.020 -2.911 1.00 0.00 H
+ATOM 4320 3HZ LYS D 75 20.933 9.634 -2.035 1.00 0.00 H
+TER
+ATOM 4322 N SER E 7 22.288 42.762 2.923 1.00 41.06 N
+ATOM 4323 CA SER E 7 22.068 42.152 1.623 1.00 45.68 C
+ATOM 4324 C SER E 7 20.813 41.289 1.616 1.00 43.32 C
+ATOM 4325 O SER E 7 20.490 40.637 2.605 1.00 44.98 O
+ATOM 4326 CB SER E 7 23.248 41.313 1.221 1.00 44.05 C
+ATOM 4327 OG SER E 7 22.982 40.658 0.022 1.00 44.67 O
+ATOM 4328 1H SER E 7 22.266 43.766 2.837 1.00 0.00 H
+ATOM 4329 2H SER E 7 21.561 42.463 3.557 1.00 0.00 H
+ATOM 4330 3H SER E 7 23.187 42.475 3.276 1.00 0.00 H
+ATOM 4331 HA SER E 7 21.939 42.948 0.885 1.00 0.00 H
+ATOM 4332 1HB SER E 7 24.117 41.941 1.090 1.00 0.00 H
+ATOM 4333 2HB SER E 7 23.468 40.588 2.013 1.00 0.00 H
+ATOM 4334 HG SER E 7 23.750 40.104 -0.160 1.00 0.00 H
+ATOM 4335 N ASP E 8 20.095 41.323 0.502 1.00 40.52 N
+ATOM 4336 CA ASP E 8 18.856 40.567 0.353 1.00 40.57 C
+ATOM 4337 C ASP E 8 19.146 39.112 -0.011 1.00 39.51 C
+ATOM 4338 O ASP E 8 20.292 38.748 -0.291 1.00 37.33 O
+ATOM 4339 CB ASP E 8 17.974 41.253 -0.703 1.00 56.79 C
+ATOM 4340 CG ASP E 8 16.455 41.027 -0.502 1.00 60.26 C
+ATOM 4341 OD1 ASP E 8 16.088 40.045 0.124 1.00 49.31 O
+ATOM 4342 OD2 ASP E 8 15.683 41.861 -0.936 1.00 55.93 O
+ATOM 4343 H ASP E 8 20.422 41.879 -0.273 1.00 0.00 H
+ATOM 4344 HA ASP E 8 18.325 40.579 1.304 1.00 0.00 H
+ATOM 4345 1HB ASP E 8 18.171 42.323 -0.696 1.00 0.00 H
+ATOM 4346 2HB ASP E 8 18.253 40.883 -1.696 1.00 0.00 H
+ATOM 4347 N PHE E 9 18.100 38.287 -0.029 1.00 38.68 N
+ATOM 4348 CA PHE E 9 18.259 36.865 -0.322 1.00 38.50 C
+ATOM 4349 C PHE E 9 17.067 36.238 -1.025 1.00 38.08 C
+ATOM 4350 O PHE E 9 15.984 36.818 -1.090 1.00 38.81 O
+ATOM 4351 CB PHE E 9 18.503 36.068 0.971 1.00 36.19 C
+ATOM 4352 CG PHE E 9 17.339 36.007 1.928 1.00 31.04 C
+ATOM 4353 CD1 PHE E 9 16.447 34.947 1.860 1.00 30.36 C
+ATOM 4354 CD2 PHE E 9 17.136 36.974 2.899 1.00 27.01 C
+ATOM 4355 CE1 PHE E 9 15.388 34.845 2.735 1.00 32.84 C
+ATOM 4356 CE2 PHE E 9 16.069 36.874 3.773 1.00 24.98 C
+ATOM 4357 CZ PHE E 9 15.200 35.808 3.686 1.00 29.24 C
+ATOM 4358 H PHE E 9 17.187 38.677 0.189 1.00 0.00 H
+ATOM 4359 HA PHE E 9 19.117 36.758 -0.981 1.00 0.00 H
+ATOM 4360 1HB PHE E 9 18.778 35.046 0.729 1.00 0.00 H
+ATOM 4361 2HB PHE E 9 19.333 36.505 1.497 1.00 0.00 H
+ATOM 4362 HD1 PHE E 9 16.600 34.186 1.096 1.00 0.00 H
+ATOM 4363 HD2 PHE E 9 17.827 37.823 2.978 1.00 0.00 H
+ATOM 4364 HE1 PHE E 9 14.701 34.006 2.664 1.00 0.00 H
+ATOM 4365 HE2 PHE E 9 15.915 37.641 4.531 1.00 0.00 H
+ATOM 4366 HZ PHE E 9 14.371 35.733 4.363 1.00 0.00 H
+ATOM 4367 N VAL E 10 17.288 35.039 -1.547 1.00 37.70 N
+ATOM 4368 CA VAL E 10 16.220 34.286 -2.187 1.00 35.56 C
+ATOM 4369 C VAL E 10 16.132 32.898 -1.561 1.00 37.31 C
+ATOM 4370 O VAL E 10 17.135 32.358 -1.094 1.00 39.54 O
+ATOM 4371 CB VAL E 10 16.522 34.136 -3.692 1.00 38.13 C
+ATOM 4372 CG1 VAL E 10 16.636 35.522 -4.349 1.00 29.12 C
+ATOM 4373 CG2 VAL E 10 17.803 33.343 -3.870 1.00 34.52 C
+ATOM 4374 H VAL E 10 18.226 34.653 -1.484 1.00 0.00 H
+ATOM 4375 HA VAL E 10 15.271 34.801 -2.043 1.00 0.00 H
+ATOM 4376 HB VAL E 10 15.694 33.606 -4.174 1.00 0.00 H
+ATOM 4377 1HG1 VAL E 10 16.849 35.404 -5.401 1.00 0.00 H
+ATOM 4378 2HG1 VAL E 10 15.705 36.076 -4.222 1.00 0.00 H
+ATOM 4379 3HG1 VAL E 10 17.449 36.074 -3.888 1.00 0.00 H
+ATOM 4380 1HG2 VAL E 10 18.010 33.227 -4.932 1.00 0.00 H
+ATOM 4381 2HG2 VAL E 10 18.633 33.870 -3.393 1.00 0.00 H
+ATOM 4382 3HG2 VAL E 10 17.689 32.359 -3.412 1.00 0.00 H
+ATOM 4383 N VAL E 11 14.940 32.304 -1.592 1.00 36.87 N
+ATOM 4384 CA VAL E 11 14.757 30.937 -1.098 1.00 37.15 C
+ATOM 4385 C VAL E 11 14.430 30.031 -2.269 1.00 40.80 C
+ATOM 4386 O VAL E 11 13.457 30.273 -2.967 1.00 37.56 O
+ATOM 4387 CB VAL E 11 13.576 30.868 -0.121 1.00 36.00 C
+ATOM 4388 CG1 VAL E 11 13.387 29.447 0.380 1.00 30.17 C
+ATOM 4389 CG2 VAL E 11 13.772 31.854 1.016 1.00 30.80 C
+ATOM 4390 H VAL E 11 14.136 32.813 -1.951 1.00 0.00 H
+ATOM 4391 HA VAL E 11 15.668 30.592 -0.614 1.00 0.00 H
+ATOM 4392 HB VAL E 11 12.699 31.113 -0.652 1.00 0.00 H
+ATOM 4393 1HG1 VAL E 11 12.517 29.421 1.040 1.00 0.00 H
+ATOM 4394 2HG1 VAL E 11 13.219 28.784 -0.470 1.00 0.00 H
+ATOM 4395 3HG1 VAL E 11 14.260 29.118 0.919 1.00 0.00 H
+ATOM 4396 1HG2 VAL E 11 12.908 31.812 1.685 1.00 0.00 H
+ATOM 4397 2HG2 VAL E 11 14.659 31.608 1.562 1.00 0.00 H
+ATOM 4398 3HG2 VAL E 11 13.865 32.863 0.609 1.00 0.00 H
+ATOM 4399 N ILE E 12 15.242 29.000 -2.491 1.00 41.30 N
+ATOM 4400 CA ILE E 12 15.024 28.108 -3.627 1.00 38.42 C
+ATOM 4401 C ILE E 12 14.863 26.644 -3.193 1.00 38.25 C
+ATOM 4402 O ILE E 12 15.732 26.077 -2.532 1.00 39.89 O
+ATOM 4403 CB ILE E 12 16.219 28.222 -4.592 1.00 39.50 C
+ATOM 4404 CG1 ILE E 12 16.371 29.686 -5.061 1.00 36.54 C
+ATOM 4405 CG2 ILE E 12 15.974 27.311 -5.802 1.00 33.59 C
+ATOM 4406 CD1 ILE E 12 17.655 29.958 -5.736 1.00 34.23 C
+ATOM 4407 H ILE E 12 16.035 28.852 -1.886 1.00 0.00 H
+ATOM 4408 HA ILE E 12 14.121 28.411 -4.146 1.00 0.00 H
+ATOM 4409 HB ILE E 12 17.139 27.933 -4.084 1.00 0.00 H
+ATOM 4410 1HG1 ILE E 12 15.576 29.915 -5.746 1.00 0.00 H
+ATOM 4411 2HG1 ILE E 12 16.304 30.355 -4.213 1.00 0.00 H
+ATOM 4412 1HG2 ILE E 12 16.803 27.390 -6.490 1.00 0.00 H
+ATOM 4413 2HG2 ILE E 12 15.879 26.279 -5.469 1.00 0.00 H
+ATOM 4414 3HG2 ILE E 12 15.059 27.612 -6.305 1.00 0.00 H
+ATOM 4415 1HD1 ILE E 12 17.691 31.001 -6.049 1.00 0.00 H
+ATOM 4416 2HD1 ILE E 12 18.473 29.757 -5.045 1.00 0.00 H
+ATOM 4417 3HD1 ILE E 12 17.744 29.318 -6.588 1.00 0.00 H
+ATOM 4418 N LYS E 13 13.748 26.027 -3.588 1.00 35.71 N
+ATOM 4419 CA LYS E 13 13.482 24.628 -3.255 1.00 35.63 C
+ATOM 4420 C LYS E 13 13.406 23.707 -4.447 1.00 37.22 C
+ATOM 4421 O LYS E 13 12.642 23.925 -5.386 1.00 36.22 O
+ATOM 4422 CB LYS E 13 12.192 24.493 -2.483 1.00 33.34 C
+ATOM 4423 CG LYS E 13 11.829 23.054 -2.183 1.00 20.10 C
+ATOM 4424 CD LYS E 13 10.559 22.950 -1.400 1.00 35.89 C
+ATOM 4425 CE LYS E 13 10.164 21.497 -1.230 1.00 29.95 C
+ATOM 4426 NZ LYS E 13 8.960 21.360 -0.402 1.00 34.51 N
+ATOM 4427 H LYS E 13 13.053 26.549 -4.107 1.00 0.00 H
+ATOM 4428 HA LYS E 13 14.292 24.269 -2.627 1.00 0.00 H
+ATOM 4429 1HB LYS E 13 12.316 24.993 -1.541 1.00 0.00 H
+ATOM 4430 2HB LYS E 13 11.382 24.972 -3.020 1.00 0.00 H
+ATOM 4431 1HG LYS E 13 11.696 22.513 -3.118 1.00 0.00 H
+ATOM 4432 2HG LYS E 13 12.639 22.577 -1.625 1.00 0.00 H
+ATOM 4433 1HD LYS E 13 10.696 23.400 -0.413 1.00 0.00 H
+ATOM 4434 2HD LYS E 13 9.762 23.482 -1.922 1.00 0.00 H
+ATOM 4435 1HE LYS E 13 9.976 21.061 -2.212 1.00 0.00 H
+ATOM 4436 2HE LYS E 13 10.984 20.957 -0.753 1.00 0.00 H
+ATOM 4437 1HZ LYS E 13 8.721 20.387 -0.294 1.00 0.00 H
+ATOM 4438 2HZ LYS E 13 9.176 21.766 0.516 1.00 0.00 H
+ATOM 4439 3HZ LYS E 13 8.189 21.852 -0.823 1.00 0.00 H
+ATOM 4440 N ALA E 14 14.188 22.645 -4.414 1.00 39.21 N
+ATOM 4441 CA ALA E 14 14.159 21.714 -5.527 1.00 38.92 C
+ATOM 4442 C ALA E 14 12.855 20.931 -5.567 1.00 40.10 C
+ATOM 4443 O ALA E 14 12.471 20.287 -4.582 1.00 35.62 O
+ATOM 4444 CB ALA E 14 15.308 20.754 -5.419 1.00 39.23 C
+ATOM 4445 H ALA E 14 14.798 22.482 -3.609 1.00 0.00 H
+ATOM 4446 HA ALA E 14 14.240 22.288 -6.448 1.00 0.00 H
+ATOM 4447 1HB ALA E 14 15.309 20.062 -6.257 1.00 0.00 H
+ATOM 4448 2HB ALA E 14 16.219 21.297 -5.410 1.00 0.00 H
+ATOM 4449 3HB ALA E 14 15.197 20.217 -4.498 1.00 0.00 H
+ATOM 4450 N LEU E 15 12.201 20.915 -6.728 1.00 40.83 N
+ATOM 4451 CA LEU E 15 10.983 20.124 -6.913 1.00 42.76 C
+ATOM 4452 C LEU E 15 11.296 18.817 -7.640 1.00 45.52 C
+ATOM 4453 O LEU E 15 10.439 17.939 -7.779 1.00 49.04 O
+ATOM 4454 CB LEU E 15 9.930 20.957 -7.651 1.00 41.63 C
+ATOM 4455 CG LEU E 15 8.974 21.814 -6.757 1.00 46.79 C
+ATOM 4456 CD1 LEU E 15 9.737 22.454 -5.622 1.00 25.40 C
+ATOM 4457 CD2 LEU E 15 8.353 22.910 -7.624 1.00 33.57 C
+ATOM 4458 H LEU E 15 12.537 21.471 -7.519 1.00 0.00 H
+ATOM 4459 HA LEU E 15 10.587 19.876 -5.931 1.00 0.00 H
+ATOM 4460 1HB LEU E 15 10.449 21.643 -8.299 1.00 0.00 H
+ATOM 4461 2HB LEU E 15 9.325 20.294 -8.266 1.00 0.00 H
+ATOM 4462 HG LEU E 15 8.193 21.179 -6.336 1.00 0.00 H
+ATOM 4463 1HD1 LEU E 15 9.059 23.053 -5.018 1.00 0.00 H
+ATOM 4464 2HD1 LEU E 15 10.182 21.679 -5.002 1.00 0.00 H
+ATOM 4465 3HD1 LEU E 15 10.498 23.074 -6.019 1.00 0.00 H
+ATOM 4466 1HD2 LEU E 15 7.683 23.523 -7.023 1.00 0.00 H
+ATOM 4467 2HD2 LEU E 15 9.139 23.536 -8.032 1.00 0.00 H
+ATOM 4468 3HD2 LEU E 15 7.793 22.467 -8.433 1.00 0.00 H
+ATOM 4469 N GLU E 16 12.548 18.698 -8.072 1.00 45.55 N
+ATOM 4470 CA GLU E 16 13.056 17.529 -8.779 1.00 47.16 C
+ATOM 4471 C GLU E 16 14.547 17.357 -8.500 1.00 45.25 C
+ATOM 4472 O GLU E 16 15.207 18.276 -8.031 1.00 45.86 O
+ATOM 4473 CB GLU E 16 12.802 17.635 -10.287 1.00 39.48 C
+ATOM 4474 CG GLU E 16 13.503 18.789 -11.002 1.00 35.61 C
+ATOM 4475 CD GLU E 16 13.171 18.812 -12.485 1.00 46.16 C
+ATOM 4476 OE1 GLU E 16 12.531 17.892 -12.941 1.00 46.06 O
+ATOM 4477 OE2 GLU E 16 13.513 19.769 -13.151 1.00 42.95 O
+ATOM 4478 H GLU E 16 13.173 19.471 -7.907 1.00 0.00 H
+ATOM 4479 HA GLU E 16 12.538 16.645 -8.408 1.00 0.00 H
+ATOM 4480 1HB GLU E 16 13.100 16.706 -10.773 1.00 0.00 H
+ATOM 4481 2HB GLU E 16 11.732 17.763 -10.458 1.00 0.00 H
+ATOM 4482 1HG GLU E 16 13.207 19.731 -10.547 1.00 0.00 H
+ATOM 4483 2HG GLU E 16 14.583 18.680 -10.874 1.00 0.00 H
+ATOM 4484 N ASP E 17 15.074 16.166 -8.740 1.00 43.85 N
+ATOM 4485 CA ASP E 17 16.508 15.949 -8.561 1.00 44.90 C
+ATOM 4486 C ASP E 17 17.321 16.749 -9.573 1.00 42.54 C
+ATOM 4487 O ASP E 17 16.883 16.932 -10.709 1.00 38.73 O
+ATOM 4488 CB ASP E 17 16.837 14.465 -8.650 1.00 48.52 C
+ATOM 4489 CG ASP E 17 16.322 13.704 -7.443 1.00 49.84 C
+ATOM 4490 OD1 ASP E 17 15.946 14.345 -6.475 1.00 62.54 O
+ATOM 4491 OD2 ASP E 17 16.291 12.499 -7.490 1.00 61.15 O
+ATOM 4492 H ASP E 17 14.492 15.421 -9.096 1.00 0.00 H
+ATOM 4493 HA ASP E 17 16.781 16.291 -7.575 1.00 0.00 H
+ATOM 4494 1HB ASP E 17 16.407 14.040 -9.552 1.00 0.00 H
+ATOM 4495 2HB ASP E 17 17.924 14.337 -8.705 1.00 0.00 H
+ATOM 4496 N GLY E 18 18.521 17.190 -9.187 1.00 41.03 N
+ATOM 4497 CA GLY E 18 19.389 17.881 -10.144 1.00 38.37 C
+ATOM 4498 C GLY E 18 19.093 19.373 -10.414 1.00 40.50 C
+ATOM 4499 O GLY E 18 19.429 19.874 -11.488 1.00 41.61 O
+ATOM 4500 H GLY E 18 18.864 17.009 -8.234 1.00 0.00 H
+ATOM 4501 1HA GLY E 18 20.415 17.787 -9.795 1.00 0.00 H
+ATOM 4502 2HA GLY E 18 19.347 17.344 -11.089 1.00 0.00 H
+ATOM 4503 N VAL E 19 18.450 20.076 -9.485 1.00 38.22 N
+ATOM 4504 CA VAL E 19 18.180 21.509 -9.663 1.00 37.27 C
+ATOM 4505 C VAL E 19 19.470 22.275 -9.470 1.00 36.63 C
+ATOM 4506 O VAL E 19 20.217 21.995 -8.539 1.00 38.03 O
+ATOM 4507 CB VAL E 19 17.099 21.993 -8.685 1.00 34.20 C
+ATOM 4508 CG1 VAL E 19 16.954 23.528 -8.712 1.00 35.14 C
+ATOM 4509 CG2 VAL E 19 15.794 21.353 -9.088 1.00 35.29 C
+ATOM 4510 H VAL E 19 18.191 19.637 -8.605 1.00 0.00 H
+ATOM 4511 HA VAL E 19 17.819 21.678 -10.681 1.00 0.00 H
+ATOM 4512 HB VAL E 19 17.363 21.691 -7.690 1.00 0.00 H
+ATOM 4513 1HG1 VAL E 19 16.188 23.823 -8.006 1.00 0.00 H
+ATOM 4514 2HG1 VAL E 19 17.902 23.989 -8.424 1.00 0.00 H
+ATOM 4515 3HG1 VAL E 19 16.678 23.863 -9.717 1.00 0.00 H
+ATOM 4516 1HG2 VAL E 19 15.010 21.646 -8.420 1.00 0.00 H
+ATOM 4517 2HG2 VAL E 19 15.533 21.658 -10.099 1.00 0.00 H
+ATOM 4518 3HG2 VAL E 19 15.913 20.281 -9.061 1.00 0.00 H
+ATOM 4519 N ASN E 20 19.766 23.216 -10.352 1.00 34.47 N
+ATOM 4520 CA ASN E 20 21.026 23.939 -10.238 1.00 32.65 C
+ATOM 4521 C ASN E 20 20.856 25.440 -10.074 1.00 35.80 C
+ATOM 4522 O ASN E 20 20.234 26.113 -10.903 1.00 36.34 O
+ATOM 4523 CB ASN E 20 21.931 23.610 -11.410 1.00 44.77 C
+ATOM 4524 CG ASN E 20 22.421 22.160 -11.386 1.00 53.85 C
+ATOM 4525 OD1 ASN E 20 23.351 21.808 -10.651 1.00 61.09 O
+ATOM 4526 ND2 ASN E 20 21.806 21.319 -12.171 1.00 45.61 N
+ATOM 4527 H ASN E 20 19.112 23.430 -11.104 1.00 0.00 H
+ATOM 4528 HA ASN E 20 21.533 23.594 -9.337 1.00 0.00 H
+ATOM 4529 1HB ASN E 20 21.396 23.789 -12.344 1.00 0.00 H
+ATOM 4530 2HB ASN E 20 22.798 24.275 -11.395 1.00 0.00 H
+ATOM 4531 1HD2 ASN E 20 22.079 20.357 -12.188 1.00 0.00 H
+ATOM 4532 2HD2 ASN E 20 21.048 21.625 -12.745 1.00 0.00 H
+ATOM 4533 N VAL E 21 21.394 25.953 -8.970 1.00 35.00 N
+ATOM 4534 CA VAL E 21 21.332 27.377 -8.683 1.00 36.34 C
+ATOM 4535 C VAL E 21 22.696 27.981 -8.989 1.00 35.14 C
+ATOM 4536 O VAL E 21 23.707 27.612 -8.385 1.00 35.64 O
+ATOM 4537 CB VAL E 21 20.951 27.611 -7.220 1.00 27.75 C
+ATOM 4538 CG1 VAL E 21 20.888 29.088 -6.954 1.00 28.77 C
+ATOM 4539 CG2 VAL E 21 19.627 26.919 -6.937 1.00 28.32 C
+ATOM 4540 H VAL E 21 21.870 25.333 -8.313 1.00 0.00 H
+ATOM 4541 HA VAL E 21 20.586 27.845 -9.326 1.00 0.00 H
+ATOM 4542 HB VAL E 21 21.721 27.197 -6.573 1.00 0.00 H
+ATOM 4543 1HG1 VAL E 21 20.634 29.267 -5.914 1.00 0.00 H
+ATOM 4544 2HG1 VAL E 21 21.857 29.536 -7.171 1.00 0.00 H
+ATOM 4545 3HG1 VAL E 21 20.132 29.528 -7.597 1.00 0.00 H
+ATOM 4546 1HG2 VAL E 21 19.345 27.072 -5.897 1.00 0.00 H
+ATOM 4547 2HG2 VAL E 21 18.864 27.333 -7.589 1.00 0.00 H
+ATOM 4548 3HG2 VAL E 21 19.729 25.848 -7.130 1.00 0.00 H
+ATOM 4549 N ILE E 22 22.728 28.879 -9.963 1.00 35.05 N
+ATOM 4550 CA ILE E 22 23.977 29.394 -10.492 1.00 35.91 C
+ATOM 4551 C ILE E 22 24.271 30.827 -10.077 1.00 37.69 C
+ATOM 4552 O ILE E 22 23.443 31.721 -10.250 1.00 40.31 O
+ATOM 4553 CB ILE E 22 23.934 29.331 -12.023 1.00 36.75 C
+ATOM 4554 CG1 ILE E 22 23.705 27.889 -12.486 1.00 36.75 C
+ATOM 4555 CG2 ILE E 22 25.239 29.837 -12.586 1.00 37.85 C
+ATOM 4556 CD1 ILE E 22 23.353 27.785 -13.955 1.00 33.68 C
+ATOM 4557 H ILE E 22 21.860 29.167 -10.394 1.00 0.00 H
+ATOM 4558 HA ILE E 22 24.785 28.764 -10.139 1.00 0.00 H
+ATOM 4559 HB ILE E 22 23.114 29.934 -12.391 1.00 0.00 H
+ATOM 4560 1HG1 ILE E 22 24.610 27.311 -12.300 1.00 0.00 H
+ATOM 4561 2HG1 ILE E 22 22.889 27.452 -11.906 1.00 0.00 H
+ATOM 4562 1HG2 ILE E 22 25.186 29.778 -13.658 1.00 0.00 H
+ATOM 4563 2HG2 ILE E 22 25.407 30.863 -12.285 1.00 0.00 H
+ATOM 4564 3HG2 ILE E 22 26.061 29.215 -12.221 1.00 0.00 H
+ATOM 4565 1HD1 ILE E 22 23.203 26.737 -14.218 1.00 0.00 H
+ATOM 4566 2HD1 ILE E 22 22.433 28.344 -14.146 1.00 0.00 H
+ATOM 4567 3HD1 ILE E 22 24.161 28.199 -14.552 1.00 0.00 H
+ATOM 4568 N GLY E 23 25.460 31.046 -9.524 1.00 34.78 N
+ATOM 4569 CA GLY E 23 25.860 32.397 -9.152 1.00 33.76 C
+ATOM 4570 C GLY E 23 26.566 33.061 -10.330 1.00 36.76 C
+ATOM 4571 O GLY E 23 27.502 32.489 -10.904 1.00 38.56 O
+ATOM 4572 H GLY E 23 26.100 30.265 -9.401 1.00 0.00 H
+ATOM 4573 1HA GLY E 23 24.984 32.982 -8.867 1.00 0.00 H
+ATOM 4574 2HA GLY E 23 26.526 32.359 -8.291 1.00 0.00 H
+ATOM 4575 N LEU E 24 26.126 34.281 -10.658 1.00 35.03 N
+ATOM 4576 CA LEU E 24 26.677 35.087 -11.747 1.00 35.89 C
+ATOM 4577 C LEU E 24 27.521 36.231 -11.182 1.00 37.63 C
+ATOM 4578 O LEU E 24 27.060 36.985 -10.304 1.00 35.33 O
+ATOM 4579 CB LEU E 24 25.535 35.654 -12.591 1.00 30.73 C
+ATOM 4580 CG LEU E 24 24.848 34.690 -13.592 1.00 33.48 C
+ATOM 4581 CD1 LEU E 24 24.008 33.653 -12.841 1.00 36.93 C
+ATOM 4582 CD2 LEU E 24 23.960 35.481 -14.539 1.00 35.44 C
+ATOM 4583 H LEU E 24 25.333 34.661 -10.147 1.00 0.00 H
+ATOM 4584 HA LEU E 24 27.307 34.456 -12.371 1.00 0.00 H
+ATOM 4585 1HB LEU E 24 24.789 35.971 -11.904 1.00 0.00 H
+ATOM 4586 2HB LEU E 24 25.891 36.517 -13.130 1.00 0.00 H
+ATOM 4587 HG LEU E 24 25.606 34.173 -14.156 1.00 0.00 H
+ATOM 4588 1HD1 LEU E 24 23.544 32.977 -13.557 1.00 0.00 H
+ATOM 4589 2HD1 LEU E 24 24.631 33.084 -12.183 1.00 0.00 H
+ATOM 4590 3HD1 LEU E 24 23.235 34.153 -12.260 1.00 0.00 H
+ATOM 4591 1HD2 LEU E 24 23.488 34.798 -15.245 1.00 0.00 H
+ATOM 4592 2HD2 LEU E 24 23.194 35.995 -13.972 1.00 0.00 H
+ATOM 4593 3HD2 LEU E 24 24.556 36.207 -15.089 1.00 0.00 H
+ATOM 4594 N THR E 25 28.750 36.370 -11.696 1.00 37.25 N
+ATOM 4595 CA THR E 25 29.696 37.316 -11.108 1.00 35.94 C
+ATOM 4596 C THR E 25 29.321 38.779 -11.207 1.00 38.06 C
+ATOM 4597 O THR E 25 28.779 39.247 -12.212 1.00 41.21 O
+ATOM 4598 CB THR E 25 31.121 37.179 -11.700 1.00 40.58 C
+ATOM 4599 OG1 THR E 25 31.105 37.409 -13.114 1.00 34.18 O
+ATOM 4600 CG2 THR E 25 31.670 35.804 -11.421 1.00 30.79 C
+ATOM 4601 H THR E 25 29.052 35.740 -12.436 1.00 0.00 H
+ATOM 4602 HA THR E 25 29.771 37.062 -10.063 1.00 0.00 H
+ATOM 4603 HB THR E 25 31.782 37.916 -11.236 1.00 0.00 H
+ATOM 4604 HG1 THR E 25 31.342 38.346 -13.333 1.00 0.00 H
+ATOM 4605 1HG2 THR E 25 32.675 35.721 -11.826 1.00 0.00 H
+ATOM 4606 2HG2 THR E 25 31.700 35.650 -10.346 1.00 0.00 H
+ATOM 4607 3HG2 THR E 25 31.042 35.058 -11.870 1.00 0.00 H
+ATOM 4608 N ARG E 26 29.681 39.488 -10.139 1.00 37.59 N
+ATOM 4609 CA ARG E 26 29.551 40.929 -10.002 1.00 35.86 C
+ATOM 4610 C ARG E 26 30.726 41.642 -10.663 1.00 36.05 C
+ATOM 4611 O ARG E 26 31.883 41.296 -10.424 1.00 36.01 O
+ATOM 4612 CB ARG E 26 29.497 41.326 -8.530 1.00 29.42 C
+ATOM 4613 CG ARG E 26 29.224 42.806 -8.279 1.00 30.81 C
+ATOM 4614 CD ARG E 26 29.196 43.150 -6.825 1.00 31.23 C
+ATOM 4615 NE ARG E 26 28.157 42.434 -6.109 1.00 37.50 N
+ATOM 4616 CZ ARG E 26 26.860 42.764 -6.102 1.00 30.68 C
+ATOM 4617 NH1 ARG E 26 26.433 43.800 -6.785 1.00 29.31 N
+ATOM 4618 NH2 ARG E 26 26.040 42.018 -5.397 1.00 29.50 N
+ATOM 4619 H ARG E 26 30.065 38.963 -9.357 1.00 0.00 H
+ATOM 4620 HA ARG E 26 28.632 41.245 -10.496 1.00 0.00 H
+ATOM 4621 1HB ARG E 26 28.726 40.747 -8.018 1.00 0.00 H
+ATOM 4622 2HB ARG E 26 30.448 41.082 -8.051 1.00 0.00 H
+ATOM 4623 1HG ARG E 26 30.012 43.398 -8.743 1.00 0.00 H
+ATOM 4624 2HG ARG E 26 28.265 43.075 -8.714 1.00 0.00 H
+ATOM 4625 1HD ARG E 26 30.154 42.904 -6.372 1.00 0.00 H
+ATOM 4626 2HD ARG E 26 29.010 44.216 -6.714 1.00 0.00 H
+ATOM 4627 HE ARG E 26 28.417 41.619 -5.541 1.00 0.00 H
+ATOM 4628 1HH1 ARG E 26 27.091 44.354 -7.309 1.00 0.00 H
+ATOM 4629 2HH1 ARG E 26 25.452 44.049 -6.775 1.00 0.00 H
+ATOM 4630 1HH2 ARG E 26 26.444 41.233 -4.877 1.00 0.00 H
+ATOM 4631 2HH2 ARG E 26 25.036 42.200 -5.372 1.00 0.00 H
+ATOM 4632 N GLY E 27 30.432 42.647 -11.480 1.00 34.35 N
+ATOM 4633 CA GLY E 27 31.484 43.418 -12.130 1.00 36.26 C
+ATOM 4634 C GLY E 27 31.237 43.553 -13.624 1.00 38.67 C
+ATOM 4635 O GLY E 27 30.182 43.176 -14.128 1.00 39.41 O
+ATOM 4636 H GLY E 27 29.466 42.878 -11.659 1.00 0.00 H
+ATOM 4637 1HA GLY E 27 31.536 44.407 -11.677 1.00 0.00 H
+ATOM 4638 2HA GLY E 27 32.448 42.941 -11.961 1.00 0.00 H
+ATOM 4639 N ALA E 28 32.220 44.112 -14.331 1.00 39.86 N
+ATOM 4640 CA ALA E 28 32.102 44.331 -15.773 1.00 41.53 C
+ATOM 4641 C ALA E 28 31.898 43.013 -16.512 1.00 42.24 C
+ATOM 4642 O ALA E 28 31.181 42.962 -17.513 1.00 38.94 O
+ATOM 4643 CB ALA E 28 33.357 45.014 -16.294 1.00 23.40 C
+ATOM 4644 H ALA E 28 33.059 44.401 -13.857 1.00 0.00 H
+ATOM 4645 HA ALA E 28 31.241 44.968 -15.955 1.00 0.00 H
+ATOM 4646 1HB ALA E 28 33.257 45.190 -17.366 1.00 0.00 H
+ATOM 4647 2HB ALA E 28 33.494 45.964 -15.783 1.00 0.00 H
+ATOM 4648 3HB ALA E 28 34.220 44.373 -16.113 1.00 0.00 H
+ATOM 4649 N ASP E 29 32.539 41.959 -16.024 1.00 42.10 N
+ATOM 4650 CA ASP E 29 32.439 40.637 -16.620 1.00 40.64 C
+ATOM 4651 C ASP E 29 31.495 39.749 -15.817 1.00 41.90 C
+ATOM 4652 O ASP E 29 31.771 39.446 -14.650 1.00 40.36 O
+ATOM 4653 CB ASP E 29 33.814 39.966 -16.683 1.00 51.92 C
+ATOM 4654 CG ASP E 29 34.794 40.630 -17.667 1.00 56.63 C
+ATOM 4655 OD1 ASP E 29 34.365 41.111 -18.687 1.00 53.40 O
+ATOM 4656 OD2 ASP E 29 35.967 40.632 -17.382 1.00 57.08 O
+ATOM 4657 H ASP E 29 33.103 42.084 -15.196 1.00 0.00 H
+ATOM 4658 HA ASP E 29 32.041 40.734 -17.632 1.00 0.00 H
+ATOM 4659 1HB ASP E 29 34.262 39.972 -15.689 1.00 0.00 H
+ATOM 4660 2HB ASP E 29 33.683 38.926 -16.966 1.00 0.00 H
+ATOM 4661 N THR E 30 30.406 39.314 -16.450 1.00 40.01 N
+ATOM 4662 CA THR E 30 29.441 38.441 -15.792 1.00 36.95 C
+ATOM 4663 C THR E 30 29.638 37.005 -16.257 1.00 41.64 C
+ATOM 4664 O THR E 30 29.415 36.680 -17.425 1.00 41.56 O
+ATOM 4665 CB THR E 30 28.002 38.890 -16.060 1.00 29.76 C
+ATOM 4666 OG1 THR E 30 27.808 40.212 -15.541 1.00 42.16 O
+ATOM 4667 CG2 THR E 30 27.044 37.943 -15.391 1.00 34.63 C
+ATOM 4668 H THR E 30 30.239 39.608 -17.403 1.00 0.00 H
+ATOM 4669 HA THR E 30 29.603 38.480 -14.717 1.00 0.00 H
+ATOM 4670 HB THR E 30 27.819 38.898 -17.130 1.00 0.00 H
+ATOM 4671 HG1 THR E 30 28.045 40.220 -14.599 1.00 0.00 H
+ATOM 4672 1HG2 THR E 30 26.022 38.265 -15.582 1.00 0.00 H
+ATOM 4673 2HG2 THR E 30 27.189 36.938 -15.784 1.00 0.00 H
+ATOM 4674 3HG2 THR E 30 27.242 37.948 -14.319 1.00 0.00 H
+ATOM 4675 N ARG E 31 30.078 36.157 -15.341 1.00 43.55 N
+ATOM 4676 CA ARG E 31 30.422 34.772 -15.625 1.00 42.29 C
+ATOM 4677 C ARG E 31 29.840 33.852 -14.570 1.00 44.54 C
+ATOM 4678 O ARG E 31 29.488 34.288 -13.478 1.00 42.17 O
+ATOM 4679 CB ARG E 31 31.938 34.617 -15.643 1.00 40.91 C
+ATOM 4680 CG ARG E 31 32.657 35.494 -16.673 1.00 56.34 C
+ATOM 4681 CD ARG E 31 34.137 35.336 -16.627 1.00 58.75 C
+ATOM 4682 NE ARG E 31 34.793 36.226 -17.573 1.00 58.39 N
+ATOM 4683 CZ ARG E 31 36.123 36.422 -17.660 1.00 63.66 C
+ATOM 4684 NH1 ARG E 31 36.943 35.779 -16.854 1.00 53.38 N
+ATOM 4685 NH2 ARG E 31 36.604 37.266 -18.555 1.00 61.93 N
+ATOM 4686 H ARG E 31 30.241 36.514 -14.411 1.00 0.00 H
+ATOM 4687 HA ARG E 31 30.015 34.496 -16.597 1.00 0.00 H
+ATOM 4688 1HB ARG E 31 32.334 34.869 -14.660 1.00 0.00 H
+ATOM 4689 2HB ARG E 31 32.197 33.577 -15.845 1.00 0.00 H
+ATOM 4690 1HG ARG E 31 32.311 35.238 -17.674 1.00 0.00 H
+ATOM 4691 2HG ARG E 31 32.434 36.542 -16.472 1.00 0.00 H
+ATOM 4692 1HD ARG E 31 34.497 35.577 -15.625 1.00 0.00 H
+ATOM 4693 2HD ARG E 31 34.408 34.310 -16.875 1.00 0.00 H
+ATOM 4694 HE ARG E 31 34.204 36.743 -18.213 1.00 0.00 H
+ATOM 4695 1HH1 ARG E 31 36.577 35.135 -16.168 1.00 0.00 H
+ATOM 4696 2HH1 ARG E 31 37.939 35.934 -16.921 1.00 0.00 H
+ATOM 4697 1HH2 ARG E 31 35.974 37.765 -19.172 1.00 0.00 H
+ATOM 4698 2HH2 ARG E 31 37.596 37.424 -18.620 1.00 0.00 H
+ATOM 4699 N PHE E 32 29.727 32.571 -14.866 1.00 42.60 N
+ATOM 4700 CA PHE E 32 29.292 31.673 -13.806 1.00 44.41 C
+ATOM 4701 C PHE E 32 30.483 31.412 -12.904 1.00 43.70 C
+ATOM 4702 O PHE E 32 31.590 31.207 -13.407 1.00 47.46 O
+ATOM 4703 CB PHE E 32 28.805 30.351 -14.380 1.00 39.36 C
+ATOM 4704 CG PHE E 32 27.556 30.473 -15.147 1.00 52.91 C
+ATOM 4705 CD1 PHE E 32 26.836 31.654 -15.129 1.00 58.13 C
+ATOM 4706 CD2 PHE E 32 27.088 29.412 -15.901 1.00 50.89 C
+ATOM 4707 CE1 PHE E 32 25.673 31.769 -15.855 1.00 52.47 C
+ATOM 4708 CE2 PHE E 32 25.928 29.528 -16.622 1.00 50.89 C
+ATOM 4709 CZ PHE E 32 25.225 30.712 -16.595 1.00 47.86 C
+ATOM 4710 H PHE E 32 29.972 32.218 -15.781 1.00 0.00 H
+ATOM 4711 HA PHE E 32 28.496 32.145 -13.226 1.00 0.00 H
+ATOM 4712 1HB PHE E 32 29.570 29.929 -15.029 1.00 0.00 H
+ATOM 4713 2HB PHE E 32 28.636 29.647 -13.566 1.00 0.00 H
+ATOM 4714 HD1 PHE E 32 27.198 32.492 -14.536 1.00 0.00 H
+ATOM 4715 HD2 PHE E 32 27.653 28.480 -15.919 1.00 0.00 H
+ATOM 4716 HE1 PHE E 32 25.106 32.698 -15.849 1.00 0.00 H
+ATOM 4717 HE2 PHE E 32 25.567 28.688 -17.215 1.00 0.00 H
+ATOM 4718 HZ PHE E 32 24.316 30.813 -17.165 1.00 0.00 H
+ATOM 4719 N HIS E 33 30.279 31.388 -11.590 1.00 40.75 N
+ATOM 4720 CA HIS E 33 31.415 31.064 -10.726 1.00 35.13 C
+ATOM 4721 C HIS E 33 31.104 29.926 -9.755 1.00 33.46 C
+ATOM 4722 O HIS E 33 32.002 29.386 -9.110 1.00 33.99 O
+ATOM 4723 CB HIS E 33 31.877 32.299 -9.942 1.00 38.20 C
+ATOM 4724 CG HIS E 33 30.946 32.781 -8.856 1.00 35.81 C
+ATOM 4725 ND1 HIS E 33 30.941 32.203 -7.608 1.00 24.82 N
+ATOM 4726 CD2 HIS E 33 30.011 33.768 -8.812 1.00 30.87 C
+ATOM 4727 CE1 HIS E 33 30.065 32.809 -6.842 1.00 33.19 C
+ATOM 4728 NE2 HIS E 33 29.486 33.762 -7.541 1.00 28.32 N
+ATOM 4729 H HIS E 33 29.358 31.618 -11.218 1.00 0.00 H
+ATOM 4730 HA HIS E 33 32.254 30.736 -11.338 1.00 0.00 H
+ATOM 4731 1HB HIS E 33 32.838 32.083 -9.476 1.00 0.00 H
+ATOM 4732 2HB HIS E 33 32.038 33.113 -10.637 1.00 0.00 H
+ATOM 4733 HD2 HIS E 33 29.729 34.440 -9.616 1.00 0.00 H
+ATOM 4734 HE1 HIS E 33 29.856 32.558 -5.799 1.00 0.00 H
+ATOM 4735 HE2 HIS E 33 28.771 34.376 -7.181 1.00 0.00 H
+ATOM 4736 N HIS E 34 29.831 29.556 -9.664 1.00 31.35 N
+ATOM 4737 CA HIS E 34 29.388 28.505 -8.752 1.00 34.30 C
+ATOM 4738 C HIS E 34 28.030 27.961 -9.150 1.00 34.18 C
+ATOM 4739 O HIS E 34 27.135 28.708 -9.546 1.00 36.42 O
+ATOM 4740 CB HIS E 34 29.322 28.981 -7.293 1.00 25.61 C
+ATOM 4741 CG HIS E 34 29.000 27.858 -6.313 1.00 20.52 C
+ATOM 4742 ND1 HIS E 34 29.923 26.897 -5.954 1.00 28.12 N
+ATOM 4743 CD2 HIS E 34 27.856 27.550 -5.641 1.00 26.31 C
+ATOM 4744 CE1 HIS E 34 29.365 26.047 -5.100 1.00 25.35 C
+ATOM 4745 NE2 HIS E 34 28.110 26.419 -4.896 1.00 31.85 N
+ATOM 4746 H HIS E 34 29.153 30.032 -10.236 1.00 0.00 H
+ATOM 4747 HA HIS E 34 30.094 27.675 -8.792 1.00 0.00 H
+ATOM 4748 1HB HIS E 34 30.282 29.416 -7.006 1.00 0.00 H
+ATOM 4749 2HB HIS E 34 28.567 29.760 -7.193 1.00 0.00 H
+ATOM 4750 HD2 HIS E 34 26.910 28.090 -5.686 1.00 0.00 H
+ATOM 4751 HE1 HIS E 34 29.856 25.187 -4.645 1.00 0.00 H
+ATOM 4752 HE2 HIS E 34 27.431 25.937 -4.282 1.00 0.00 H
+ATOM 4753 N SER E 35 27.864 26.653 -9.011 1.00 34.82 N
+ATOM 4754 CA SER E 35 26.584 26.016 -9.290 1.00 36.37 C
+ATOM 4755 C SER E 35 26.228 25.042 -8.171 1.00 36.42 C
+ATOM 4756 O SER E 35 26.886 24.014 -7.995 1.00 34.00 O
+ATOM 4757 CB SER E 35 26.653 25.300 -10.628 1.00 37.90 C
+ATOM 4758 OG SER E 35 25.465 24.622 -10.904 1.00 47.40 O
+ATOM 4759 H SER E 35 28.637 26.089 -8.682 1.00 0.00 H
+ATOM 4760 HA SER E 35 25.813 26.778 -9.336 1.00 0.00 H
+ATOM 4761 1HB SER E 35 26.845 26.032 -11.415 1.00 0.00 H
+ATOM 4762 2HB SER E 35 27.484 24.597 -10.622 1.00 0.00 H
+ATOM 4763 HG SER E 35 25.362 23.975 -10.198 1.00 0.00 H
+ATOM 4764 N GLU E 36 25.208 25.396 -7.390 1.00 40.00 N
+ATOM 4765 CA GLU E 36 24.806 24.592 -6.243 1.00 42.65 C
+ATOM 4766 C GLU E 36 23.718 23.609 -6.645 1.00 43.08 C
+ATOM 4767 O GLU E 36 22.644 24.011 -7.102 1.00 42.72 O
+ATOM 4768 CB GLU E 36 24.320 25.474 -5.083 1.00 38.79 C
+ATOM 4769 CG GLU E 36 24.017 24.705 -3.787 1.00 34.96 C
+ATOM 4770 CD GLU E 36 25.260 24.144 -3.141 1.00 38.12 C
+ATOM 4771 OE1 GLU E 36 26.312 24.754 -3.273 1.00 33.27 O
+ATOM 4772 OE2 GLU E 36 25.171 23.101 -2.510 1.00 35.58 O
+ATOM 4773 H GLU E 36 24.695 26.247 -7.609 1.00 0.00 H
+ATOM 4774 HA GLU E 36 25.670 24.020 -5.900 1.00 0.00 H
+ATOM 4775 1HB GLU E 36 25.068 26.231 -4.860 1.00 0.00 H
+ATOM 4776 2HB GLU E 36 23.412 25.992 -5.381 1.00 0.00 H
+ATOM 4777 1HG GLU E 36 23.548 25.376 -3.078 1.00 0.00 H
+ATOM 4778 2HG GLU E 36 23.317 23.895 -4.000 1.00 0.00 H
+ATOM 4779 N LYS E 37 24.006 22.319 -6.522 1.00 44.40 N
+ATOM 4780 CA LYS E 37 23.038 21.314 -6.927 1.00 45.27 C
+ATOM 4781 C LYS E 37 22.105 20.953 -5.782 1.00 44.97 C
+ATOM 4782 O LYS E 37 22.557 20.604 -4.687 1.00 47.03 O
+ATOM 4783 CB LYS E 37 23.728 20.050 -7.422 1.00 43.10 C
+ATOM 4784 CG LYS E 37 22.763 19.004 -7.971 1.00 58.73 C
+ATOM 4785 CD LYS E 37 23.506 17.827 -8.588 1.00 45.00 C
+ATOM 4786 CE LYS E 37 24.114 16.948 -7.502 1.00 45.00 C
+ATOM 4787 NZ LYS E 37 24.697 15.700 -8.055 1.00 45.00 N
+ATOM 4788 H LYS E 37 24.902 22.040 -6.148 1.00 0.00 H
+ATOM 4789 HA LYS E 37 22.443 21.718 -7.740 1.00 0.00 H
+ATOM 4790 1HB LYS E 37 24.428 20.309 -8.216 1.00 0.00 H
+ATOM 4791 2HB LYS E 37 24.293 19.596 -6.611 1.00 0.00 H
+ATOM 4792 1HG LYS E 37 22.122 18.634 -7.165 1.00 0.00 H
+ATOM 4793 2HG LYS E 37 22.124 19.471 -8.729 1.00 0.00 H
+ATOM 4794 1HD LYS E 37 22.819 17.231 -9.186 1.00 0.00 H
+ATOM 4795 2HD LYS E 37 24.303 18.199 -9.234 1.00 0.00 H
+ATOM 4796 1HE LYS E 37 24.894 17.506 -6.989 1.00 0.00 H
+ATOM 4797 2HE LYS E 37 23.334 16.685 -6.782 1.00 0.00 H
+ATOM 4798 1HZ LYS E 37 25.081 15.149 -7.300 1.00 0.00 H
+ATOM 4799 2HZ LYS E 37 23.970 15.173 -8.519 1.00 0.00 H
+ATOM 4800 3HZ LYS E 37 25.426 15.925 -8.714 1.00 0.00 H
+ATOM 4801 N LEU E 38 20.806 21.053 -6.035 1.00 43.21 N
+ATOM 4802 CA LEU E 38 19.795 20.723 -5.046 1.00 39.44 C
+ATOM 4803 C LEU E 38 18.992 19.517 -5.528 1.00 40.75 C
+ATOM 4804 O LEU E 38 18.463 19.524 -6.643 1.00 40.58 O
+ATOM 4805 CB LEU E 38 18.834 21.906 -4.845 1.00 34.65 C
+ATOM 4806 CG LEU E 38 19.433 23.263 -4.509 1.00 42.25 C
+ATOM 4807 CD1 LEU E 38 18.280 24.277 -4.378 1.00 36.99 C
+ATOM 4808 CD2 LEU E 38 20.250 23.171 -3.257 1.00 43.54 C
+ATOM 4809 H LEU E 38 20.515 21.355 -6.954 1.00 0.00 H
+ATOM 4810 HA LEU E 38 20.279 20.473 -4.102 1.00 0.00 H
+ATOM 4811 1HB LEU E 38 18.294 22.044 -5.755 1.00 0.00 H
+ATOM 4812 2HB LEU E 38 18.126 21.649 -4.055 1.00 0.00 H
+ATOM 4813 HG LEU E 38 20.079 23.585 -5.332 1.00 0.00 H
+ATOM 4814 1HD1 LEU E 38 18.680 25.261 -4.162 1.00 0.00 H
+ATOM 4815 2HD1 LEU E 38 17.718 24.314 -5.313 1.00 0.00 H
+ATOM 4816 3HD1 LEU E 38 17.612 23.971 -3.566 1.00 0.00 H
+ATOM 4817 1HD2 LEU E 38 20.691 24.130 -3.038 1.00 0.00 H
+ATOM 4818 2HD2 LEU E 38 19.618 22.854 -2.423 1.00 0.00 H
+ATOM 4819 3HD2 LEU E 38 21.040 22.445 -3.414 1.00 0.00 H
+ATOM 4820 N ASP E 39 18.893 18.487 -4.706 1.00 39.70 N
+ATOM 4821 CA ASP E 39 18.084 17.338 -5.100 1.00 38.72 C
+ATOM 4822 C ASP E 39 16.680 17.537 -4.565 1.00 40.22 C
+ATOM 4823 O ASP E 39 16.480 18.431 -3.743 1.00 39.91 O
+ATOM 4824 CB ASP E 39 18.726 16.018 -4.699 1.00 46.58 C
+ATOM 4825 CG ASP E 39 19.936 15.698 -5.610 1.00 54.50 C
+ATOM 4826 OD1 ASP E 39 19.966 16.191 -6.747 1.00 58.60 O
+ATOM 4827 OD2 ASP E 39 20.809 14.977 -5.179 1.00 57.86 O
+ATOM 4828 H ASP E 39 19.356 18.526 -3.796 1.00 0.00 H
+ATOM 4829 HA ASP E 39 18.022 17.329 -6.180 1.00 0.00 H
+ATOM 4830 1HB ASP E 39 19.057 16.066 -3.654 1.00 0.00 H
+ATOM 4831 2HB ASP E 39 17.992 15.211 -4.789 1.00 0.00 H
+ATOM 4832 N LYS E 40 15.707 16.768 -5.048 1.00 40.08 N
+ATOM 4833 CA LYS E 40 14.333 17.032 -4.648 1.00 43.04 C
+ATOM 4834 C LYS E 40 14.198 17.096 -3.143 1.00 43.17 C
+ATOM 4835 O LYS E 40 14.629 16.193 -2.426 1.00 42.77 O
+ATOM 4836 CB LYS E 40 13.380 15.982 -5.214 1.00 44.64 C
+ATOM 4837 CG LYS E 40 11.909 16.251 -4.919 1.00 44.19 C
+ATOM 4838 CD LYS E 40 11.006 15.267 -5.651 1.00 53.48 C
+ATOM 4839 CE LYS E 40 9.538 15.594 -5.428 1.00 55.67 C
+ATOM 4840 NZ LYS E 40 8.647 14.678 -6.179 1.00 62.34 N
+ATOM 4841 H LYS E 40 15.902 16.001 -5.699 1.00 0.00 H
+ATOM 4842 HA LYS E 40 14.039 18.000 -5.053 1.00 0.00 H
+ATOM 4843 1HB LYS E 40 13.501 15.921 -6.283 1.00 0.00 H
+ATOM 4844 2HB LYS E 40 13.638 15.004 -4.808 1.00 0.00 H
+ATOM 4845 1HG LYS E 40 11.735 16.153 -3.847 1.00 0.00 H
+ATOM 4846 2HG LYS E 40 11.657 17.269 -5.215 1.00 0.00 H
+ATOM 4847 1HD LYS E 40 11.219 15.313 -6.720 1.00 0.00 H
+ATOM 4848 2HD LYS E 40 11.207 14.256 -5.299 1.00 0.00 H
+ATOM 4849 1HE LYS E 40 9.309 15.516 -4.367 1.00 0.00 H
+ATOM 4850 2HE LYS E 40 9.349 16.617 -5.757 1.00 0.00 H
+ATOM 4851 1HZ LYS E 40 7.687 14.931 -6.008 1.00 0.00 H
+ATOM 4852 2HZ LYS E 40 8.846 14.755 -7.167 1.00 0.00 H
+ATOM 4853 3HZ LYS E 40 8.806 13.729 -5.877 1.00 0.00 H
+ATOM 4854 N GLY E 41 13.578 18.173 -2.670 1.00 43.58 N
+ATOM 4855 CA GLY E 41 13.356 18.382 -1.249 1.00 42.40 C
+ATOM 4856 C GLY E 41 14.399 19.276 -0.569 1.00 41.68 C
+ATOM 4857 O GLY E 41 14.182 19.715 0.564 1.00 42.94 O
+ATOM 4858 H GLY E 41 13.253 18.883 -3.326 1.00 0.00 H
+ATOM 4859 1HA GLY E 41 12.368 18.820 -1.115 1.00 0.00 H
+ATOM 4860 2HA GLY E 41 13.338 17.415 -0.749 1.00 0.00 H
+ATOM 4861 N GLU E 42 15.525 19.554 -1.229 1.00 41.28 N
+ATOM 4862 CA GLU E 42 16.522 20.423 -0.600 1.00 38.45 C
+ATOM 4863 C GLU E 42 16.163 21.894 -0.762 1.00 37.10 C
+ATOM 4864 O GLU E 42 15.677 22.331 -1.813 1.00 38.37 O
+ATOM 4865 CB GLU E 42 17.939 20.141 -1.127 1.00 35.24 C
+ATOM 4866 CG GLU E 42 18.508 18.782 -0.675 1.00 36.04 C
+ATOM 4867 CD GLU E 42 19.929 18.500 -1.134 1.00 43.75 C
+ATOM 4868 OE1 GLU E 42 20.269 18.841 -2.235 1.00 38.74 O
+ATOM 4869 OE2 GLU E 42 20.685 17.935 -0.370 1.00 42.19 O
+ATOM 4870 H GLU E 42 15.695 19.159 -2.152 1.00 0.00 H
+ATOM 4871 HA GLU E 42 16.532 20.207 0.472 1.00 0.00 H
+ATOM 4872 1HB GLU E 42 17.929 20.147 -2.215 1.00 0.00 H
+ATOM 4873 2HB GLU E 42 18.620 20.928 -0.797 1.00 0.00 H
+ATOM 4874 1HG GLU E 42 18.487 18.745 0.418 1.00 0.00 H
+ATOM 4875 2HG GLU E 42 17.856 17.993 -1.047 1.00 0.00 H
+ATOM 4876 N VAL E 43 16.421 22.663 0.298 1.00 32.84 N
+ATOM 4877 CA VAL E 43 16.142 24.098 0.283 1.00 31.71 C
+ATOM 4878 C VAL E 43 17.407 24.920 0.460 1.00 32.39 C
+ATOM 4879 O VAL E 43 18.198 24.678 1.369 1.00 31.58 O
+ATOM 4880 CB VAL E 43 15.127 24.478 1.398 1.00 28.12 C
+ATOM 4881 CG1 VAL E 43 14.902 25.997 1.412 1.00 26.78 C
+ATOM 4882 CG2 VAL E 43 13.797 23.762 1.157 1.00 22.23 C
+ATOM 4883 H VAL E 43 16.818 22.232 1.134 1.00 0.00 H
+ATOM 4884 HA VAL E 43 15.702 24.355 -0.678 1.00 0.00 H
+ATOM 4885 HB VAL E 43 15.530 24.185 2.367 1.00 0.00 H
+ATOM 4886 1HG1 VAL E 43 14.196 26.256 2.198 1.00 0.00 H
+ATOM 4887 2HG1 VAL E 43 15.847 26.506 1.596 1.00 0.00 H
+ATOM 4888 3HG1 VAL E 43 14.503 26.313 0.445 1.00 0.00 H
+ATOM 4889 1HG2 VAL E 43 13.087 24.029 1.941 1.00 0.00 H
+ATOM 4890 2HG2 VAL E 43 13.405 24.064 0.205 1.00 0.00 H
+ATOM 4891 3HG2 VAL E 43 13.953 22.685 1.159 1.00 0.00 H
+ATOM 4892 N LEU E 44 17.603 25.886 -0.429 1.00 31.71 N
+ATOM 4893 CA LEU E 44 18.753 26.772 -0.363 1.00 32.81 C
+ATOM 4894 C LEU E 44 18.334 28.214 -0.165 1.00 33.84 C
+ATOM 4895 O LEU E 44 17.558 28.760 -0.945 1.00 34.20 O
+ATOM 4896 CB LEU E 44 19.561 26.685 -1.651 1.00 37.28 C
+ATOM 4897 CG LEU E 44 20.775 27.610 -1.750 1.00 37.24 C
+ATOM 4898 CD1 LEU E 44 21.821 27.193 -0.705 1.00 28.35 C
+ATOM 4899 CD2 LEU E 44 21.323 27.544 -3.168 1.00 42.22 C
+ATOM 4900 H LEU E 44 16.927 26.009 -1.175 1.00 0.00 H
+ATOM 4901 HA LEU E 44 19.377 26.480 0.478 1.00 0.00 H
+ATOM 4902 1HB LEU E 44 19.913 25.679 -1.743 1.00 0.00 H
+ATOM 4903 2HB LEU E 44 18.901 26.906 -2.489 1.00 0.00 H
+ATOM 4904 HG LEU E 44 20.475 28.636 -1.528 1.00 0.00 H
+ATOM 4905 1HD1 LEU E 44 22.679 27.854 -0.767 1.00 0.00 H
+ATOM 4906 2HD1 LEU E 44 21.385 27.260 0.292 1.00 0.00 H
+ATOM 4907 3HD1 LEU E 44 22.139 26.169 -0.895 1.00 0.00 H
+ATOM 4908 1HD2 LEU E 44 22.186 28.204 -3.261 1.00 0.00 H
+ATOM 4909 2HD2 LEU E 44 21.618 26.526 -3.396 1.00 0.00 H
+ATOM 4910 3HD2 LEU E 44 20.550 27.858 -3.865 1.00 0.00 H
+ATOM 4911 N ILE E 45 18.844 28.836 0.881 1.00 34.46 N
+ATOM 4912 CA ILE E 45 18.539 30.229 1.121 1.00 36.36 C
+ATOM 4913 C ILE E 45 19.832 30.997 0.916 1.00 37.28 C
+ATOM 4914 O ILE E 45 20.822 30.736 1.596 1.00 37.80 O
+ATOM 4915 CB ILE E 45 17.994 30.434 2.529 1.00 39.03 C
+ATOM 4916 CG1 ILE E 45 16.771 29.547 2.705 1.00 36.71 C
+ATOM 4917 CG2 ILE E 45 17.597 31.886 2.662 1.00 22.88 C
+ATOM 4918 CD1 ILE E 45 16.242 29.482 4.083 1.00 39.25 C
+ATOM 4919 H ILE E 45 19.455 28.336 1.517 1.00 0.00 H
+ATOM 4920 HA ILE E 45 17.805 30.574 0.403 1.00 0.00 H
+ATOM 4921 HB ILE E 45 18.739 30.161 3.277 1.00 0.00 H
+ATOM 4922 1HG1 ILE E 45 16.006 29.903 2.055 1.00 0.00 H
+ATOM 4923 2HG1 ILE E 45 17.033 28.536 2.404 1.00 0.00 H
+ATOM 4924 1HG2 ILE E 45 17.177 32.077 3.639 1.00 0.00 H
+ATOM 4925 2HG2 ILE E 45 18.465 32.521 2.505 1.00 0.00 H
+ATOM 4926 3HG2 ILE E 45 16.860 32.103 1.904 1.00 0.00 H
+ATOM 4927 1HD1 ILE E 45 15.379 28.827 4.095 1.00 0.00 H
+ATOM 4928 2HD1 ILE E 45 17.008 29.096 4.759 1.00 0.00 H
+ATOM 4929 3HD1 ILE E 45 15.952 30.471 4.390 1.00 0.00 H
+ATOM 4930 N ALA E 46 19.857 31.921 -0.039 1.00 35.76 N
+ATOM 4931 CA ALA E 46 21.149 32.523 -0.352 1.00 33.97 C
+ATOM 4932 C ALA E 46 21.097 34.011 -0.607 1.00 35.93 C
+ATOM 4933 O ALA E 46 20.177 34.529 -1.244 1.00 38.80 O
+ATOM 4934 CB ALA E 46 21.728 31.828 -1.577 1.00 23.85 C
+ATOM 4935 H ALA E 46 19.007 32.149 -0.552 1.00 0.00 H
+ATOM 4936 HA ALA E 46 21.810 32.373 0.496 1.00 0.00 H
+ATOM 4937 1HB ALA E 46 22.714 32.240 -1.797 1.00 0.00 H
+ATOM 4938 2HB ALA E 46 21.816 30.762 -1.379 1.00 0.00 H
+ATOM 4939 3HB ALA E 46 21.068 31.984 -2.429 1.00 0.00 H
+ATOM 4940 N GLN E 47 22.130 34.689 -0.110 1.00 31.00 N
+ATOM 4941 CA GLN E 47 22.278 36.127 -0.245 1.00 31.68 C
+ATOM 4942 C GLN E 47 23.034 36.542 -1.483 1.00 30.94 C
+ATOM 4943 O GLN E 47 23.853 35.794 -2.021 1.00 33.65 O
+ATOM 4944 CB GLN E 47 23.018 36.718 0.960 1.00 35.95 C
+ATOM 4945 CG GLN E 47 22.310 36.587 2.284 1.00 28.22 C
+ATOM 4946 CD GLN E 47 23.068 37.259 3.387 1.00 33.66 C
+ATOM 4947 OE1 GLN E 47 24.296 37.134 3.492 1.00 30.67 O
+ATOM 4948 NE2 GLN E 47 22.344 37.985 4.226 1.00 29.44 N
+ATOM 4949 H GLN E 47 22.849 34.188 0.413 1.00 0.00 H
+ATOM 4950 HA GLN E 47 21.290 36.567 -0.298 1.00 0.00 H
+ATOM 4951 1HB GLN E 47 24.000 36.246 1.049 1.00 0.00 H
+ATOM 4952 2HB GLN E 47 23.189 37.785 0.783 1.00 0.00 H
+ATOM 4953 1HG GLN E 47 21.348 37.073 2.213 1.00 0.00 H
+ATOM 4954 2HG GLN E 47 22.192 35.527 2.536 1.00 0.00 H
+ATOM 4955 1HE2 GLN E 47 22.776 38.462 4.990 1.00 0.00 H
+ATOM 4956 2HE2 GLN E 47 21.351 38.054 4.088 1.00 0.00 H
+ATOM 4957 N PHE E 48 22.811 37.781 -1.882 1.00 28.69 N
+ATOM 4958 CA PHE E 48 23.614 38.385 -2.934 1.00 33.33 C
+ATOM 4959 C PHE E 48 24.899 38.874 -2.268 1.00 34.80 C
+ATOM 4960 O PHE E 48 24.884 39.287 -1.104 1.00 35.45 O
+ATOM 4961 CB PHE E 48 22.847 39.501 -3.606 1.00 34.24 C
+ATOM 4962 CG PHE E 48 21.702 38.984 -4.418 1.00 39.49 C
+ATOM 4963 CD1 PHE E 48 21.885 38.569 -5.732 1.00 33.58 C
+ATOM 4964 CD2 PHE E 48 20.438 38.882 -3.852 1.00 29.83 C
+ATOM 4965 CE1 PHE E 48 20.822 38.071 -6.454 1.00 36.16 C
+ATOM 4966 CE2 PHE E 48 19.385 38.382 -4.573 1.00 34.03 C
+ATOM 4967 CZ PHE E 48 19.580 37.974 -5.872 1.00 33.26 C
+ATOM 4968 H PHE E 48 22.070 38.309 -1.417 1.00 0.00 H
+ATOM 4969 HA PHE E 48 23.874 37.632 -3.682 1.00 0.00 H
+ATOM 4970 1HB PHE E 48 22.468 40.199 -2.863 1.00 0.00 H
+ATOM 4971 2HB PHE E 48 23.521 40.036 -4.262 1.00 0.00 H
+ATOM 4972 HD1 PHE E 48 22.879 38.640 -6.183 1.00 0.00 H
+ATOM 4973 HD2 PHE E 48 20.293 39.197 -2.814 1.00 0.00 H
+ATOM 4974 HE1 PHE E 48 20.963 37.746 -7.473 1.00 0.00 H
+ATOM 4975 HE2 PHE E 48 18.400 38.301 -4.116 1.00 0.00 H
+ATOM 4976 HZ PHE E 48 18.762 37.567 -6.428 1.00 0.00 H
+ATOM 4977 N THR E 49 26.030 38.754 -2.956 1.00 34.30 N
+ATOM 4978 CA THR E 49 27.300 39.060 -2.298 1.00 31.43 C
+ATOM 4979 C THR E 49 28.213 39.963 -3.093 1.00 33.61 C
+ATOM 4980 O THR E 49 27.899 40.405 -4.195 1.00 37.07 O
+ATOM 4981 CB THR E 49 28.107 37.783 -1.968 1.00 32.55 C
+ATOM 4982 OG1 THR E 49 28.620 37.191 -3.181 1.00 39.52 O
+ATOM 4983 CG2 THR E 49 27.229 36.760 -1.241 1.00 25.46 C
+ATOM 4984 H THR E 49 26.001 38.473 -3.935 1.00 0.00 H
+ATOM 4985 HA THR E 49 27.083 39.569 -1.359 1.00 0.00 H
+ATOM 4986 HB THR E 49 28.941 38.039 -1.321 1.00 0.00 H
+ATOM 4987 HG1 THR E 49 27.954 36.583 -3.538 1.00 0.00 H
+ATOM 4988 1HG2 THR E 49 27.821 35.878 -1.010 1.00 0.00 H
+ATOM 4989 2HG2 THR E 49 26.842 37.189 -0.317 1.00 0.00 H
+ATOM 4990 3HG2 THR E 49 26.395 36.473 -1.879 1.00 0.00 H
+ATOM 4991 N GLU E 50 29.390 40.182 -2.530 1.00 34.73 N
+ATOM 4992 CA GLU E 50 30.472 40.910 -3.164 1.00 33.34 C
+ATOM 4993 C GLU E 50 30.853 40.269 -4.501 1.00 32.56 C
+ATOM 4994 O GLU E 50 31.394 40.943 -5.379 1.00 32.29 O
+ATOM 4995 CB GLU E 50 31.686 40.964 -2.230 1.00 30.47 C
+ATOM 4996 CG GLU E 50 32.864 41.774 -2.749 1.00 40.28 C
+ATOM 4997 CD GLU E 50 33.996 41.900 -1.739 1.00 54.29 C
+ATOM 4998 OE1 GLU E 50 33.864 41.394 -0.647 1.00 47.60 O
+ATOM 4999 OE2 GLU E 50 34.992 42.502 -2.070 1.00 61.85 O
+ATOM 5000 H GLU E 50 29.556 39.801 -1.612 1.00 0.00 H
+ATOM 5001 HA GLU E 50 30.135 41.930 -3.361 1.00 0.00 H
+ATOM 5002 1HB GLU E 50 31.387 41.392 -1.276 1.00 0.00 H
+ATOM 5003 2HB GLU E 50 32.042 39.951 -2.039 1.00 0.00 H
+ATOM 5004 1HG GLU E 50 33.246 41.286 -3.647 1.00 0.00 H
+ATOM 5005 2HG GLU E 50 32.517 42.769 -3.028 1.00 0.00 H
+ATOM 5006 N HIS E 51 30.633 38.951 -4.635 1.00 26.61 N
+ATOM 5007 CA HIS E 51 31.008 38.257 -5.851 1.00 28.83 C
+ATOM 5008 C HIS E 51 29.799 37.844 -6.702 1.00 33.61 C
+ATOM 5009 O HIS E 51 29.949 37.689 -7.910 1.00 35.25 O
+ATOM 5010 CB HIS E 51 31.863 37.031 -5.505 1.00 26.49 C
+ATOM 5011 CG HIS E 51 33.148 37.409 -4.825 1.00 34.64 C
+ATOM 5012 ND1 HIS E 51 33.232 37.636 -3.467 1.00 32.77 N
+ATOM 5013 CD2 HIS E 51 34.389 37.614 -5.316 1.00 28.18 C
+ATOM 5014 CE1 HIS E 51 34.471 37.971 -3.155 1.00 32.28 C
+ATOM 5015 NE2 HIS E 51 35.193 37.960 -4.257 1.00 35.45 N
+ATOM 5016 H HIS E 51 30.157 38.426 -3.908 1.00 0.00 H
+ATOM 5017 HA HIS E 51 31.620 38.917 -6.464 1.00 0.00 H
+ATOM 5018 1HB HIS E 51 31.302 36.359 -4.849 1.00 0.00 H
+ATOM 5019 2HB HIS E 51 32.101 36.481 -6.415 1.00 0.00 H
+ATOM 5020 HD2 HIS E 51 34.695 37.525 -6.358 1.00 0.00 H
+ATOM 5021 HE1 HIS E 51 34.831 38.216 -2.154 1.00 0.00 H
+ATOM 5022 HE2 HIS E 51 36.178 38.178 -4.320 1.00 0.00 H
+ATOM 5023 N THR E 52 28.604 37.715 -6.100 1.00 33.45 N
+ATOM 5024 CA THR E 52 27.402 37.321 -6.867 1.00 31.88 C
+ATOM 5025 C THR E 52 26.392 38.462 -7.014 1.00 33.48 C
+ATOM 5026 O THR E 52 25.833 38.940 -6.023 1.00 37.50 O
+ATOM 5027 CB THR E 52 26.647 36.146 -6.204 1.00 25.12 C
+ATOM 5028 OG1 THR E 52 27.486 34.992 -6.129 1.00 30.45 O
+ATOM 5029 CG2 THR E 52 25.381 35.796 -7.007 1.00 23.80 C
+ATOM 5030 H THR E 52 28.545 37.850 -5.098 1.00 0.00 H
+ATOM 5031 HA THR E 52 27.713 37.019 -7.865 1.00 0.00 H
+ATOM 5032 HB THR E 52 26.356 36.437 -5.195 1.00 0.00 H
+ATOM 5033 HG1 THR E 52 27.518 34.590 -7.001 1.00 0.00 H
+ATOM 5034 1HG2 THR E 52 24.857 34.974 -6.523 1.00 0.00 H
+ATOM 5035 2HG2 THR E 52 24.719 36.661 -7.059 1.00 0.00 H
+ATOM 5036 3HG2 THR E 52 25.665 35.500 -8.017 1.00 0.00 H
+ATOM 5037 N SER E 53 26.115 38.850 -8.267 1.00 31.11 N
+ATOM 5038 CA SER E 53 25.164 39.934 -8.545 1.00 29.90 C
+ATOM 5039 C SER E 53 23.847 39.394 -9.063 1.00 29.14 C
+ATOM 5040 O SER E 53 22.824 40.088 -9.060 1.00 28.99 O
+ATOM 5041 CB SER E 53 25.722 40.898 -9.556 1.00 31.04 C
+ATOM 5042 OG SER E 53 25.916 40.281 -10.798 1.00 25.29 O
+ATOM 5043 H SER E 53 26.589 38.378 -9.037 1.00 0.00 H
+ATOM 5044 HA SER E 53 24.966 40.471 -7.618 1.00 0.00 H
+ATOM 5045 1HB SER E 53 25.039 41.734 -9.666 1.00 0.00 H
+ATOM 5046 2HB SER E 53 26.651 41.287 -9.184 1.00 0.00 H
+ATOM 5047 HG SER E 53 26.342 39.429 -10.617 1.00 0.00 H
+ATOM 5048 N ALA E 54 23.870 38.148 -9.512 1.00 25.72 N
+ATOM 5049 CA ALA E 54 22.650 37.551 -10.020 1.00 32.13 C
+ATOM 5050 C ALA E 54 22.644 36.060 -9.760 1.00 31.63 C
+ATOM 5051 O ALA E 54 23.692 35.411 -9.699 1.00 32.32 O
+ATOM 5052 CB ALA E 54 22.475 37.852 -11.501 1.00 31.19 C
+ATOM 5053 H ALA E 54 24.748 37.634 -9.528 1.00 0.00 H
+ATOM 5054 HA ALA E 54 21.814 37.982 -9.480 1.00 0.00 H
+ATOM 5055 1HB ALA E 54 21.543 37.410 -11.837 1.00 0.00 H
+ATOM 5056 2HB ALA E 54 22.445 38.931 -11.650 1.00 0.00 H
+ATOM 5057 3HB ALA E 54 23.279 37.451 -12.067 1.00 0.00 H
+ATOM 5058 N ILE E 55 21.442 35.523 -9.624 1.00 32.66 N
+ATOM 5059 CA ILE E 55 21.238 34.102 -9.420 1.00 34.41 C
+ATOM 5060 C ILE E 55 20.351 33.512 -10.507 1.00 35.79 C
+ATOM 5061 O ILE E 55 19.254 34.010 -10.760 1.00 32.11 O
+ATOM 5062 CB ILE E 55 20.609 33.838 -8.034 1.00 34.57 C
+ATOM 5063 CG1 ILE E 55 21.556 34.344 -6.904 1.00 35.03 C
+ATOM 5064 CG2 ILE E 55 20.311 32.366 -7.881 1.00 27.08 C
+ATOM 5065 CD1 ILE E 55 20.932 34.331 -5.513 1.00 37.79 C
+ATOM 5066 H ILE E 55 20.632 36.133 -9.687 1.00 0.00 H
+ATOM 5067 HA ILE E 55 22.204 33.606 -9.458 1.00 0.00 H
+ATOM 5068 HB ILE E 55 19.681 34.402 -7.948 1.00 0.00 H
+ATOM 5069 1HG1 ILE E 55 22.451 33.718 -6.892 1.00 0.00 H
+ATOM 5070 2HG1 ILE E 55 21.855 35.363 -7.122 1.00 0.00 H
+ATOM 5071 1HG2 ILE E 55 19.859 32.184 -6.909 1.00 0.00 H
+ATOM 5072 2HG2 ILE E 55 19.626 32.047 -8.665 1.00 0.00 H
+ATOM 5073 3HG2 ILE E 55 21.245 31.809 -7.965 1.00 0.00 H
+ATOM 5074 1HD1 ILE E 55 21.656 34.702 -4.781 1.00 0.00 H
+ATOM 5075 2HD1 ILE E 55 20.048 34.972 -5.500 1.00 0.00 H
+ATOM 5076 3HD1 ILE E 55 20.645 33.314 -5.252 1.00 0.00 H
+ATOM 5077 N LYS E 56 20.820 32.462 -11.168 1.00 39.17 N
+ATOM 5078 CA LYS E 56 19.987 31.838 -12.189 1.00 40.26 C
+ATOM 5079 C LYS E 56 19.594 30.442 -11.743 1.00 40.72 C
+ATOM 5080 O LYS E 56 20.427 29.682 -11.256 1.00 42.44 O
+ATOM 5081 CB LYS E 56 20.656 31.825 -13.566 1.00 37.30 C
+ATOM 5082 CG LYS E 56 19.742 31.258 -14.664 1.00 46.86 C
+ATOM 5083 CD LYS E 56 20.231 31.584 -16.074 1.00 48.21 C
+ATOM 5084 CE LYS E 56 21.287 30.648 -16.604 1.00 59.48 C
+ATOM 5085 NZ LYS E 56 21.677 31.044 -18.000 1.00 54.41 N
+ATOM 5086 H LYS E 56 21.742 32.096 -10.940 1.00 0.00 H
+ATOM 5087 HA LYS E 56 19.072 32.410 -12.286 1.00 0.00 H
+ATOM 5088 1HB LYS E 56 20.927 32.840 -13.849 1.00 0.00 H
+ATOM 5089 2HB LYS E 56 21.566 31.237 -13.531 1.00 0.00 H
+ATOM 5090 1HG LYS E 56 19.675 30.172 -14.559 1.00 0.00 H
+ATOM 5091 2HG LYS E 56 18.736 31.673 -14.543 1.00 0.00 H
+ATOM 5092 1HD LYS E 56 19.387 31.499 -16.744 1.00 0.00 H
+ATOM 5093 2HD LYS E 56 20.608 32.611 -16.117 1.00 0.00 H
+ATOM 5094 1HE LYS E 56 22.165 30.661 -15.961 1.00 0.00 H
+ATOM 5095 2HE LYS E 56 20.878 29.634 -16.631 1.00 0.00 H
+ATOM 5096 1HZ LYS E 56 22.363 30.416 -18.378 1.00 0.00 H
+ATOM 5097 2HZ LYS E 56 20.863 31.043 -18.616 1.00 0.00 H
+ATOM 5098 3HZ LYS E 56 22.070 31.991 -17.978 1.00 0.00 H
+ATOM 5099 N VAL E 57 18.316 30.113 -11.863 1.00 40.68 N
+ATOM 5100 CA VAL E 57 17.859 28.808 -11.424 1.00 38.48 C
+ATOM 5101 C VAL E 57 17.403 27.963 -12.603 1.00 38.47 C
+ATOM 5102 O VAL E 57 16.551 28.373 -13.405 1.00 39.05 O
+ATOM 5103 CB VAL E 57 16.720 28.959 -10.405 1.00 33.39 C
+ATOM 5104 CG1 VAL E 57 16.260 27.569 -9.923 1.00 25.82 C
+ATOM 5105 CG2 VAL E 57 17.202 29.830 -9.265 1.00 28.19 C
+ATOM 5106 H VAL E 57 17.664 30.783 -12.258 1.00 0.00 H
+ATOM 5107 HA VAL E 57 18.685 28.292 -10.934 1.00 0.00 H
+ATOM 5108 HB VAL E 57 15.865 29.433 -10.884 1.00 0.00 H
+ATOM 5109 1HG1 VAL E 57 15.449 27.679 -9.209 1.00 0.00 H
+ATOM 5110 2HG1 VAL E 57 15.912 26.978 -10.773 1.00 0.00 H
+ATOM 5111 3HG1 VAL E 57 17.093 27.053 -9.443 1.00 0.00 H
+ATOM 5112 1HG2 VAL E 57 16.403 29.954 -8.539 1.00 0.00 H
+ATOM 5113 2HG2 VAL E 57 18.055 29.352 -8.804 1.00 0.00 H
+ATOM 5114 3HG2 VAL E 57 17.496 30.810 -9.648 1.00 0.00 H
+ATOM 5115 N ARG E 58 18.010 26.782 -12.706 1.00 40.15 N
+ATOM 5116 CA ARG E 58 17.757 25.818 -13.766 1.00 38.22 C
+ATOM 5117 C ARG E 58 17.135 24.529 -13.226 1.00 35.72 C
+ATOM 5118 O ARG E 58 17.653 23.909 -12.290 1.00 37.46 O
+ATOM 5119 CB ARG E 58 19.064 25.510 -14.478 1.00 39.57 C
+ATOM 5120 CG ARG E 58 19.000 24.449 -15.552 1.00 55.09 C
+ATOM 5121 CD ARG E 58 20.309 24.321 -16.247 1.00 63.17 C
+ATOM 5122 NE ARG E 58 20.591 25.472 -17.079 1.00 65.35 N
+ATOM 5123 CZ ARG E 58 21.775 25.745 -17.652 1.00 65.54 C
+ATOM 5124 NH1 ARG E 58 22.813 24.953 -17.478 1.00 73.92 N
+ATOM 5125 NH2 ARG E 58 21.873 26.826 -18.394 1.00 54.17 N
+ATOM 5126 H ARG E 58 18.713 26.542 -12.010 1.00 0.00 H
+ATOM 5127 HA ARG E 58 17.064 26.265 -14.483 1.00 0.00 H
+ATOM 5128 1HB ARG E 58 19.431 26.421 -14.953 1.00 0.00 H
+ATOM 5129 2HB ARG E 58 19.812 25.206 -13.743 1.00 0.00 H
+ATOM 5130 1HG ARG E 58 18.753 23.489 -15.097 1.00 0.00 H
+ATOM 5131 2HG ARG E 58 18.238 24.719 -16.286 1.00 0.00 H
+ATOM 5132 1HD ARG E 58 21.099 24.246 -15.502 1.00 0.00 H
+ATOM 5133 2HD ARG E 58 20.313 23.433 -16.874 1.00 0.00 H
+ATOM 5134 HE ARG E 58 19.832 26.141 -17.259 1.00 0.00 H
+ATOM 5135 1HH1 ARG E 58 22.726 24.127 -16.907 1.00 0.00 H
+ATOM 5136 2HH1 ARG E 58 23.695 25.174 -17.916 1.00 0.00 H
+ATOM 5137 1HH2 ARG E 58 21.031 27.410 -18.506 1.00 0.00 H
+ATOM 5138 2HH2 ARG E 58 22.747 27.060 -18.845 1.00 0.00 H
+ATOM 5139 N GLY E 59 16.034 24.104 -13.831 1.00 34.36 N
+ATOM 5140 CA GLY E 59 15.327 22.914 -13.373 1.00 33.56 C
+ATOM 5141 C GLY E 59 14.095 23.358 -12.615 1.00 35.82 C
+ATOM 5142 O GLY E 59 13.936 24.550 -12.355 1.00 33.36 O
+ATOM 5143 H GLY E 59 15.647 24.638 -14.603 1.00 0.00 H
+ATOM 5144 1HA GLY E 59 15.035 22.295 -14.222 1.00 0.00 H
+ATOM 5145 2HA GLY E 59 15.965 22.314 -12.726 1.00 0.00 H
+ATOM 5146 N LYS E 60 13.216 22.422 -12.287 1.00 36.69 N
+ATOM 5147 CA LYS E 60 11.962 22.780 -11.637 1.00 37.82 C
+ATOM 5148 C LYS E 60 12.176 23.078 -10.155 1.00 35.00 C
+ATOM 5149 O LYS E 60 12.702 22.234 -9.417 1.00 33.46 O
+ATOM 5150 CB LYS E 60 10.947 21.657 -11.830 1.00 51.48 C
+ATOM 5151 CG LYS E 60 9.532 21.953 -11.386 1.00 61.43 C
+ATOM 5152 CD LYS E 60 8.638 20.748 -11.674 1.00 62.59 C
+ATOM 5153 CE LYS E 60 7.210 20.978 -11.227 1.00 68.24 C
+ATOM 5154 NZ LYS E 60 6.336 19.822 -11.562 1.00 79.72 N
+ATOM 5155 H LYS E 60 13.404 21.448 -12.521 1.00 0.00 H
+ATOM 5156 HA LYS E 60 11.580 23.673 -12.107 1.00 0.00 H
+ATOM 5157 1HB LYS E 60 10.927 21.369 -12.884 1.00 0.00 H
+ATOM 5158 2HB LYS E 60 11.265 20.789 -11.265 1.00 0.00 H
+ATOM 5159 1HG LYS E 60 9.503 22.193 -10.333 1.00 0.00 H
+ATOM 5160 2HG LYS E 60 9.154 22.818 -11.947 1.00 0.00 H
+ATOM 5161 1HD LYS E 60 8.656 20.528 -12.746 1.00 0.00 H
+ATOM 5162 2HD LYS E 60 9.036 19.883 -11.139 1.00 0.00 H
+ATOM 5163 1HE LYS E 60 7.200 21.119 -10.155 1.00 0.00 H
+ATOM 5164 2HE LYS E 60 6.818 21.875 -11.709 1.00 0.00 H
+ATOM 5165 1HZ LYS E 60 5.392 20.001 -11.243 1.00 0.00 H
+ATOM 5166 2HZ LYS E 60 6.332 19.683 -12.562 1.00 0.00 H
+ATOM 5167 3HZ LYS E 60 6.695 18.994 -11.108 1.00 0.00 H
+ATOM 5168 N ALA E 61 11.774 24.272 -9.726 1.00 34.61 N
+ATOM 5169 CA ALA E 61 11.985 24.673 -8.336 1.00 32.29 C
+ATOM 5170 C ALA E 61 11.010 25.744 -7.872 1.00 34.99 C
+ATOM 5171 O ALA E 61 10.552 26.579 -8.653 1.00 34.51 O
+ATOM 5172 CB ALA E 61 13.406 25.186 -8.144 1.00 25.78 C
+ATOM 5173 H ALA E 61 11.321 24.901 -10.393 1.00 0.00 H
+ATOM 5174 HA ALA E 61 11.842 23.793 -7.717 1.00 0.00 H
+ATOM 5175 1HB ALA E 61 13.570 25.447 -7.100 1.00 0.00 H
+ATOM 5176 2HB ALA E 61 14.094 24.411 -8.439 1.00 0.00 H
+ATOM 5177 3HB ALA E 61 13.562 26.064 -8.755 1.00 0.00 H
+ATOM 5178 N TYR E 62 10.722 25.744 -6.583 1.00 35.89 N
+ATOM 5179 CA TYR E 62 9.884 26.773 -5.981 1.00 33.95 C
+ATOM 5180 C TYR E 62 10.752 27.863 -5.386 1.00 33.45 C
+ATOM 5181 O TYR E 62 11.650 27.585 -4.592 1.00 30.51 O
+ATOM 5182 CB TYR E 62 8.925 26.154 -4.973 1.00 35.26 C
+ATOM 5183 CG TYR E 62 8.126 27.138 -4.159 1.00 32.56 C
+ATOM 5184 CD1 TYR E 62 7.137 27.942 -4.725 1.00 28.65 C
+ATOM 5185 CD2 TYR E 62 8.363 27.194 -2.817 1.00 32.84 C
+ATOM 5186 CE1 TYR E 62 6.411 28.805 -3.918 1.00 27.21 C
+ATOM 5187 CE2 TYR E 62 7.646 28.034 -2.016 1.00 34.90 C
+ATOM 5188 CZ TYR E 62 6.673 28.842 -2.552 1.00 33.31 C
+ATOM 5189 OH TYR E 62 5.954 29.672 -1.721 1.00 35.34 O
+ATOM 5190 H TYR E 62 11.147 25.025 -6.000 1.00 0.00 H
+ATOM 5191 HA TYR E 62 9.288 27.235 -6.765 1.00 0.00 H
+ATOM 5192 1HB TYR E 62 8.223 25.510 -5.504 1.00 0.00 H
+ATOM 5193 2HB TYR E 62 9.485 25.528 -4.286 1.00 0.00 H
+ATOM 5194 HD1 TYR E 62 6.935 27.895 -5.791 1.00 0.00 H
+ATOM 5195 HD2 TYR E 62 9.123 26.553 -2.395 1.00 0.00 H
+ATOM 5196 HE1 TYR E 62 5.636 29.436 -4.352 1.00 0.00 H
+ATOM 5197 HE2 TYR E 62 7.845 28.054 -0.947 1.00 0.00 H
+ATOM 5198 HH TYR E 62 6.220 29.518 -0.810 1.00 0.00 H
+ATOM 5199 N ILE E 63 10.517 29.102 -5.806 1.00 33.23 N
+ATOM 5200 CA ILE E 63 11.362 30.197 -5.371 1.00 31.73 C
+ATOM 5201 C ILE E 63 10.573 31.291 -4.623 1.00 33.46 C
+ATOM 5202 O ILE E 63 9.523 31.747 -5.085 1.00 34.16 O
+ATOM 5203 CB ILE E 63 12.051 30.817 -6.600 1.00 25.81 C
+ATOM 5204 CG1 ILE E 63 12.842 29.752 -7.370 1.00 29.97 C
+ATOM 5205 CG2 ILE E 63 12.993 31.913 -6.157 1.00 19.12 C
+ATOM 5206 CD1 ILE E 63 13.328 30.228 -8.723 1.00 25.06 C
+ATOM 5207 H ILE E 63 9.776 29.299 -6.470 1.00 0.00 H
+ATOM 5208 HA ILE E 63 12.117 29.797 -4.719 1.00 0.00 H
+ATOM 5209 HB ILE E 63 11.312 31.212 -7.255 1.00 0.00 H
+ATOM 5210 1HG1 ILE E 63 13.681 29.446 -6.779 1.00 0.00 H
+ATOM 5211 2HG1 ILE E 63 12.206 28.887 -7.540 1.00 0.00 H
+ATOM 5212 1HG2 ILE E 63 13.463 32.342 -7.025 1.00 0.00 H
+ATOM 5213 2HG2 ILE E 63 12.436 32.669 -5.633 1.00 0.00 H
+ATOM 5214 3HG2 ILE E 63 13.751 31.499 -5.495 1.00 0.00 H
+ATOM 5215 1HD1 ILE E 63 13.868 29.429 -9.215 1.00 0.00 H
+ATOM 5216 2HD1 ILE E 63 12.473 30.515 -9.339 1.00 0.00 H
+ATOM 5217 3HD1 ILE E 63 13.987 31.085 -8.597 1.00 0.00 H
+ATOM 5218 N GLN E 64 11.078 31.706 -3.454 1.00 35.03 N
+ATOM 5219 CA GLN E 64 10.434 32.788 -2.698 1.00 34.16 C
+ATOM 5220 C GLN E 64 11.380 33.985 -2.663 1.00 35.40 C
+ATOM 5221 O GLN E 64 12.540 33.860 -2.257 1.00 37.46 O
+ATOM 5222 CB GLN E 64 10.106 32.379 -1.248 1.00 30.14 C
+ATOM 5223 CG GLN E 64 9.209 31.167 -1.098 1.00 27.77 C
+ATOM 5224 CD GLN E 64 8.985 30.759 0.365 1.00 37.54 C
+ATOM 5225 OE1 GLN E 64 9.856 30.922 1.227 1.00 38.28 O
+ATOM 5226 NE2 GLN E 64 7.800 30.219 0.627 1.00 29.20 N
+ATOM 5227 H GLN E 64 11.931 31.275 -3.116 1.00 0.00 H
+ATOM 5228 HA GLN E 64 9.522 33.093 -3.203 1.00 0.00 H
+ATOM 5229 1HB GLN E 64 10.981 32.257 -0.676 1.00 0.00 H
+ATOM 5230 2HB GLN E 64 9.564 33.208 -0.783 1.00 0.00 H
+ATOM 5231 1HG GLN E 64 8.242 31.386 -1.530 1.00 0.00 H
+ATOM 5232 2HG GLN E 64 9.668 30.326 -1.622 1.00 0.00 H
+ATOM 5233 1HE2 GLN E 64 7.564 29.899 1.565 1.00 0.00 H
+ATOM 5234 2HE2 GLN E 64 7.132 30.108 -0.113 1.00 0.00 H
+ATOM 5235 N THR E 65 10.909 35.138 -3.130 1.00 32.72 N
+ATOM 5236 CA THR E 65 11.750 36.329 -3.147 1.00 31.97 C
+ATOM 5237 C THR E 65 10.994 37.508 -2.569 1.00 33.60 C
+ATOM 5238 O THR E 65 9.806 37.436 -2.255 1.00 34.69 O
+ATOM 5239 CB THR E 65 12.203 36.761 -4.567 1.00 37.52 C
+ATOM 5240 OG1 THR E 65 11.091 37.331 -5.272 1.00 30.83 O
+ATOM 5241 CG2 THR E 65 12.728 35.582 -5.365 1.00 26.18 C
+ATOM 5242 H THR E 65 9.949 35.203 -3.465 1.00 0.00 H
+ATOM 5243 HA THR E 65 12.631 36.157 -2.528 1.00 0.00 H
+ATOM 5244 HB THR E 65 12.988 37.501 -4.477 1.00 0.00 H
+ATOM 5245 HG1 THR E 65 10.556 37.844 -4.658 1.00 0.00 H
+ATOM 5246 1HG2 THR E 65 13.037 35.924 -6.355 1.00 0.00 H
+ATOM 5247 2HG2 THR E 65 13.575 35.135 -4.852 1.00 0.00 H
+ATOM 5248 3HG2 THR E 65 11.937 34.849 -5.467 1.00 0.00 H
+ATOM 5249 N ARG E 66 11.672 38.629 -2.527 1.00 31.73 N
+ATOM 5250 CA ARG E 66 11.112 39.895 -2.097 1.00 33.45 C
+ATOM 5251 C ARG E 66 9.898 40.337 -2.901 1.00 36.82 C
+ATOM 5252 O ARG E 66 9.107 41.149 -2.420 1.00 35.21 O
+ATOM 5253 CB ARG E 66 12.181 40.963 -2.172 1.00 35.42 C
+ATOM 5254 CG ARG E 66 11.805 42.321 -1.667 1.00 51.25 C
+ATOM 5255 CD ARG E 66 13.026 43.132 -1.529 1.00 65.13 C
+ATOM 5256 NE ARG E 66 12.776 44.521 -1.256 1.00 78.05 N
+ATOM 5257 CZ ARG E 66 13.761 45.422 -1.085 1.00 80.20 C
+ATOM 5258 NH1 ARG E 66 15.020 45.020 -1.143 1.00 69.11 N
+ATOM 5259 NH2 ARG E 66 13.474 46.694 -0.854 1.00 78.94 N
+ATOM 5260 H ARG E 66 12.649 38.607 -2.784 1.00 0.00 H
+ATOM 5261 HA ARG E 66 10.794 39.790 -1.063 1.00 0.00 H
+ATOM 5262 1HB ARG E 66 13.079 40.637 -1.639 1.00 0.00 H
+ATOM 5263 2HB ARG E 66 12.454 41.102 -3.213 1.00 0.00 H
+ATOM 5264 1HG ARG E 66 11.137 42.805 -2.380 1.00 0.00 H
+ATOM 5265 2HG ARG E 66 11.317 42.238 -0.693 1.00 0.00 H
+ATOM 5266 1HD ARG E 66 13.583 42.737 -0.689 1.00 0.00 H
+ATOM 5267 2HD ARG E 66 13.633 43.054 -2.433 1.00 0.00 H
+ATOM 5268 HE ARG E 66 11.819 44.835 -1.204 1.00 0.00 H
+ATOM 5269 1HH1 ARG E 66 15.245 44.020 -1.292 1.00 0.00 H
+ATOM 5270 2HH1 ARG E 66 15.765 45.683 -1.016 1.00 0.00 H
+ATOM 5271 1HH2 ARG E 66 12.512 46.991 -0.798 1.00 0.00 H
+ATOM 5272 2HH2 ARG E 66 14.219 47.366 -0.725 1.00 0.00 H
+ATOM 5273 N HIS E 67 9.758 39.854 -4.138 1.00 36.86 N
+ATOM 5274 CA HIS E 67 8.666 40.339 -4.963 1.00 38.75 C
+ATOM 5275 C HIS E 67 7.499 39.350 -5.021 1.00 39.61 C
+ATOM 5276 O HIS E 67 6.600 39.496 -5.852 1.00 39.14 O
+ATOM 5277 CB HIS E 67 9.168 40.616 -6.378 1.00 36.83 C
+ATOM 5278 CG HIS E 67 10.317 41.561 -6.400 1.00 26.70 C
+ATOM 5279 ND1 HIS E 67 10.415 42.641 -5.549 1.00 29.47 N
+ATOM 5280 CD2 HIS E 67 11.405 41.607 -7.192 1.00 21.20 C
+ATOM 5281 CE1 HIS E 67 11.535 43.286 -5.803 1.00 26.21 C
+ATOM 5282 NE2 HIS E 67 12.138 42.687 -6.802 1.00 32.59 N
+ATOM 5283 H HIS E 67 10.386 39.141 -4.507 1.00 0.00 H
+ATOM 5284 HA HIS E 67 8.287 41.273 -4.551 1.00 0.00 H
+ATOM 5285 1HB HIS E 67 9.478 39.681 -6.850 1.00 0.00 H
+ATOM 5286 2HB HIS E 67 8.365 41.045 -6.974 1.00 0.00 H
+ATOM 5287 HD2 HIS E 67 11.651 40.921 -7.997 1.00 0.00 H
+ATOM 5288 HE1 HIS E 67 11.889 44.178 -5.288 1.00 0.00 H
+ATOM 5289 HE2 HIS E 67 13.010 42.981 -7.228 1.00 0.00 H
+ATOM 5290 N GLY E 68 7.509 38.340 -4.149 1.00 38.17 N
+ATOM 5291 CA GLY E 68 6.458 37.328 -4.173 1.00 32.69 C
+ATOM 5292 C GLY E 68 7.075 35.975 -4.470 1.00 34.22 C
+ATOM 5293 O GLY E 68 8.223 35.718 -4.108 1.00 34.43 O
+ATOM 5294 H GLY E 68 8.261 38.253 -3.468 1.00 0.00 H
+ATOM 5295 1HA GLY E 68 5.951 37.301 -3.209 1.00 0.00 H
+ATOM 5296 2HA GLY E 68 5.716 37.574 -4.930 1.00 0.00 H
+ATOM 5297 N VAL E 69 6.309 35.084 -5.079 1.00 34.34 N
+ATOM 5298 CA VAL E 69 6.856 33.763 -5.345 1.00 37.45 C
+ATOM 5299 C VAL E 69 6.814 33.473 -6.829 1.00 37.90 C
+ATOM 5300 O VAL E 69 6.042 34.085 -7.573 1.00 36.22 O
+ATOM 5301 CB VAL E 69 6.090 32.675 -4.576 1.00 49.57 C
+ATOM 5302 CG1 VAL E 69 6.188 32.937 -3.086 1.00 52.41 C
+ATOM 5303 CG2 VAL E 69 4.647 32.638 -5.028 1.00 51.77 C
+ATOM 5304 H VAL E 69 5.368 35.319 -5.359 1.00 0.00 H
+ATOM 5305 HA VAL E 69 7.898 33.737 -5.028 1.00 0.00 H
+ATOM 5306 HB VAL E 69 6.562 31.711 -4.770 1.00 0.00 H
+ATOM 5307 1HG1 VAL E 69 5.669 32.149 -2.544 1.00 0.00 H
+ATOM 5308 2HG1 VAL E 69 7.227 32.953 -2.798 1.00 0.00 H
+ATOM 5309 3HG1 VAL E 69 5.735 33.895 -2.850 1.00 0.00 H
+ATOM 5310 1HG2 VAL E 69 4.120 31.854 -4.484 1.00 0.00 H
+ATOM 5311 2HG2 VAL E 69 4.175 33.599 -4.829 1.00 0.00 H
+ATOM 5312 3HG2 VAL E 69 4.611 32.427 -6.097 1.00 0.00 H
+ATOM 5313 N ILE E 70 7.675 32.565 -7.255 1.00 37.11 N
+ATOM 5314 CA ILE E 70 7.743 32.170 -8.649 1.00 35.98 C
+ATOM 5315 C ILE E 70 8.259 30.740 -8.737 1.00 37.05 C
+ATOM 5316 O ILE E 70 9.012 30.305 -7.871 1.00 37.83 O
+ATOM 5317 CB ILE E 70 8.652 33.151 -9.431 1.00 42.11 C
+ATOM 5318 CG1 ILE E 70 8.501 32.956 -10.924 1.00 40.58 C
+ATOM 5319 CG2 ILE E 70 10.109 32.957 -9.026 1.00 39.04 C
+ATOM 5320 CD1 ILE E 70 9.065 34.105 -11.714 1.00 37.62 C
+ATOM 5321 H ILE E 70 8.301 32.133 -6.578 1.00 0.00 H
+ATOM 5322 HA ILE E 70 6.740 32.204 -9.075 1.00 0.00 H
+ATOM 5323 HB ILE E 70 8.355 34.173 -9.206 1.00 0.00 H
+ATOM 5324 1HG1 ILE E 70 9.019 32.045 -11.229 1.00 0.00 H
+ATOM 5325 2HG1 ILE E 70 7.444 32.854 -11.160 1.00 0.00 H
+ATOM 5326 1HG2 ILE E 70 10.740 33.654 -9.564 1.00 0.00 H
+ATOM 5327 2HG2 ILE E 70 10.208 33.133 -7.953 1.00 0.00 H
+ATOM 5328 3HG2 ILE E 70 10.409 31.937 -9.266 1.00 0.00 H
+ATOM 5329 1HD1 ILE E 70 8.914 33.918 -12.756 1.00 0.00 H
+ATOM 5330 2HD1 ILE E 70 8.554 35.029 -11.436 1.00 0.00 H
+ATOM 5331 3HD1 ILE E 70 10.125 34.204 -11.507 1.00 0.00 H
+ATOM 5332 N GLU E 71 7.849 29.999 -9.754 1.00 37.09 N
+ATOM 5333 CA GLU E 71 8.419 28.669 -9.923 1.00 38.16 C
+ATOM 5334 C GLU E 71 9.238 28.605 -11.198 1.00 42.87 C
+ATOM 5335 O GLU E 71 8.829 29.151 -12.232 1.00 44.45 O
+ATOM 5336 CB GLU E 71 7.331 27.585 -9.958 1.00 34.48 C
+ATOM 5337 CG GLU E 71 6.567 27.402 -8.659 1.00 37.03 C
+ATOM 5338 CD GLU E 71 5.549 26.288 -8.715 1.00 32.53 C
+ATOM 5339 OE1 GLU E 71 5.373 25.717 -9.764 1.00 44.21 O
+ATOM 5340 OE2 GLU E 71 4.954 26.005 -7.702 1.00 48.42 O
+ATOM 5341 H GLU E 71 7.191 30.369 -10.423 1.00 0.00 H
+ATOM 5342 HA GLU E 71 9.085 28.463 -9.089 1.00 0.00 H
+ATOM 5343 1HB GLU E 71 6.610 27.817 -10.739 1.00 0.00 H
+ATOM 5344 2HB GLU E 71 7.792 26.626 -10.209 1.00 0.00 H
+ATOM 5345 1HG GLU E 71 7.279 27.178 -7.879 1.00 0.00 H
+ATOM 5346 2HG GLU E 71 6.068 28.335 -8.408 1.00 0.00 H
+ATOM 5347 N SER E 72 10.377 27.923 -11.123 1.00 44.08 N
+ATOM 5348 CA SER E 72 11.223 27.711 -12.288 1.00 46.09 C
+ATOM 5349 C SER E 72 10.830 26.395 -12.920 1.00 47.54 C
+ATOM 5350 O SER E 72 10.223 25.552 -12.250 1.00 47.15 O
+ATOM 5351 CB SER E 72 12.688 27.724 -11.896 1.00 38.46 C
+ATOM 5352 OG SER E 72 12.995 26.652 -11.072 1.00 34.66 O
+ATOM 5353 H SER E 72 10.633 27.504 -10.235 1.00 0.00 H
+ATOM 5354 HA SER E 72 11.042 28.502 -13.014 1.00 0.00 H
+ATOM 5355 1HB SER E 72 13.313 27.691 -12.790 1.00 0.00 H
+ATOM 5356 2HB SER E 72 12.911 28.651 -11.374 1.00 0.00 H
+ATOM 5357 HG SER E 72 13.212 25.909 -11.660 1.00 0.00 H
+ATOM 5358 N GLU E 73 11.178 26.231 -14.192 1.00 50.56 N
+ATOM 5359 CA GLU E 73 10.877 25.037 -14.976 1.00 58.13 C
+ATOM 5360 C GLU E 73 12.078 24.619 -15.832 1.00 60.47 C
+ATOM 5361 O GLU E 73 13.150 25.217 -15.764 1.00 60.25 O
+ATOM 5362 CB GLU E 73 9.629 25.256 -15.851 1.00 55.82 C
+ATOM 5363 CG GLU E 73 8.345 25.587 -15.075 1.00 66.41 C
+ATOM 5364 CD GLU E 73 7.146 25.758 -15.967 1.00 69.25 C
+ATOM 5365 OE1 GLU E 73 6.757 24.803 -16.597 1.00 80.98 O
+ATOM 5366 OE2 GLU E 73 6.619 26.858 -16.022 1.00 58.66 O
+ATOM 5367 H GLU E 73 11.682 26.987 -14.651 1.00 0.00 H
+ATOM 5368 HA GLU E 73 10.659 24.219 -14.292 1.00 0.00 H
+ATOM 5369 1HB GLU E 73 9.793 26.066 -16.535 1.00 0.00 H
+ATOM 5370 2HB GLU E 73 9.433 24.366 -16.447 1.00 0.00 H
+ATOM 5371 1HG GLU E 73 8.143 24.789 -14.355 1.00 0.00 H
+ATOM 5372 2HG GLU E 73 8.497 26.508 -14.517 1.00 0.00 H
+ATOM 5373 N GLY E 74 11.904 23.550 -16.598 1.00 64.05 N
+ATOM 5374 CA GLY E 74 12.956 23.082 -17.492 1.00 69.49 C
+ATOM 5375 C GLY E 74 12.492 21.859 -18.268 1.00 72.64 C
+ATOM 5376 O GLY E 74 11.423 21.312 -17.988 1.00 74.13 O
+ATOM 5377 H GLY E 74 11.014 23.075 -16.593 1.00 0.00 H
+ATOM 5378 1HA GLY E 74 13.227 23.880 -18.185 1.00 0.00 H
+ATOM 5379 2HA GLY E 74 13.846 22.839 -16.916 1.00 0.00 H
+ATOM 5380 N LYS E 75 13.297 21.437 -19.236 1.00 74.02 N
+ATOM 5381 CA LYS E 75 12.968 20.293 -20.078 1.00 75.02 C
+ATOM 5382 C LYS E 75 14.185 19.864 -20.892 1.00 76.38 C
+ATOM 5383 O LYS E 75 15.183 20.588 -20.923 1.00 77.12 O
+ATOM 5384 OXT LYS E 75 14.259 18.713 -21.291 1.00 0.00 O
+ATOM 5385 CB LYS E 75 11.788 20.640 -21.002 1.00 71.81 C
+ATOM 5386 CG LYS E 75 11.271 19.496 -21.862 1.00 45.00 C
+ATOM 5387 CD LYS E 75 10.015 19.915 -22.636 1.00 45.00 C
+ATOM 5388 CE LYS E 75 9.471 18.770 -23.480 1.00 45.00 C
+ATOM 5389 NZ LYS E 75 8.253 19.167 -24.244 1.00 45.00 N
+ATOM 5390 H LYS E 75 14.160 21.938 -19.401 1.00 0.00 H
+ATOM 5391 HA LYS E 75 12.680 19.457 -19.438 1.00 0.00 H
+ATOM 5392 1HB LYS E 75 10.944 20.990 -20.409 1.00 0.00 H
+ATOM 5393 2HB LYS E 75 12.075 21.455 -21.668 1.00 0.00 H
+ATOM 5394 1HG LYS E 75 12.043 19.201 -22.573 1.00 0.00 H
+ATOM 5395 2HG LYS E 75 11.035 18.641 -21.230 1.00 0.00 H
+ATOM 5396 1HD LYS E 75 9.245 20.235 -21.930 1.00 0.00 H
+ATOM 5397 2HD LYS E 75 10.252 20.755 -23.290 1.00 0.00 H
+ATOM 5398 1HE LYS E 75 10.239 18.449 -24.181 1.00 0.00 H
+ATOM 5399 2HE LYS E 75 9.219 17.936 -22.825 1.00 0.00 H
+ATOM 5400 1HZ LYS E 75 7.926 18.381 -24.787 1.00 0.00 H
+ATOM 5401 2HZ LYS E 75 7.529 19.456 -23.601 1.00 0.00 H
+ATOM 5402 3HZ LYS E 75 8.478 19.933 -24.863 1.00 0.00 H
+TER
+ATOM 5404 N SER F 7 20.445 47.073 -2.288 1.00 53.23 N
+ATOM 5405 CA SER F 7 20.629 46.894 -3.721 1.00 52.37 C
+ATOM 5406 C SER F 7 19.458 46.117 -4.321 1.00 49.16 C
+ATOM 5407 O SER F 7 19.345 44.890 -4.183 1.00 51.08 O
+ATOM 5408 CB SER F 7 21.950 46.207 -3.985 1.00 59.52 C
+ATOM 5409 OG SER F 7 22.149 45.993 -5.359 1.00 70.93 O
+ATOM 5410 1H SER F 7 21.065 47.798 -1.956 1.00 0.00 H
+ATOM 5411 2H SER F 7 19.486 47.340 -2.111 1.00 0.00 H
+ATOM 5412 3H SER F 7 20.649 46.209 -1.810 1.00 0.00 H
+ATOM 5413 HA SER F 7 20.655 47.877 -4.193 1.00 0.00 H
+ATOM 5414 1HB SER F 7 22.765 46.822 -3.584 1.00 0.00 H
+ATOM 5415 2HB SER F 7 21.973 45.268 -3.454 1.00 0.00 H
+ATOM 5416 HG SER F 7 22.215 46.864 -5.763 1.00 0.00 H
+ATOM 5417 N ASP F 8 18.592 46.862 -4.993 1.00 45.53 N
+ATOM 5418 CA ASP F 8 17.371 46.365 -5.621 1.00 45.17 C
+ATOM 5419 C ASP F 8 17.640 45.364 -6.740 1.00 42.72 C
+ATOM 5420 O ASP F 8 18.656 45.462 -7.442 1.00 41.25 O
+ATOM 5421 CB ASP F 8 16.588 47.556 -6.167 1.00 53.26 C
+ATOM 5422 CG ASP F 8 16.045 48.435 -5.043 1.00 58.02 C
+ATOM 5423 OD1 ASP F 8 15.172 48.001 -4.320 1.00 58.06 O
+ATOM 5424 OD2 ASP F 8 16.567 49.527 -4.883 1.00 48.46 O
+ATOM 5425 H ASP F 8 18.777 47.851 -5.074 1.00 0.00 H
+ATOM 5426 HA ASP F 8 16.769 45.869 -4.856 1.00 0.00 H
+ATOM 5427 1HB ASP F 8 17.231 48.161 -6.809 1.00 0.00 H
+ATOM 5428 2HB ASP F 8 15.756 47.200 -6.777 1.00 0.00 H
+ATOM 5429 N PHE F 9 16.697 44.436 -6.922 1.00 41.22 N
+ATOM 5430 CA PHE F 9 16.778 43.421 -7.970 1.00 40.11 C
+ATOM 5431 C PHE F 9 15.431 43.154 -8.598 1.00 38.59 C
+ATOM 5432 O PHE F 9 14.396 43.541 -8.051 1.00 34.95 O
+ATOM 5433 CB PHE F 9 17.288 42.074 -7.424 1.00 35.28 C
+ATOM 5434 CG PHE F 9 16.379 41.380 -6.466 1.00 40.55 C
+ATOM 5435 CD1 PHE F 9 15.433 40.477 -6.934 1.00 31.87 C
+ATOM 5436 CD2 PHE F 9 16.477 41.586 -5.109 1.00 46.80 C
+ATOM 5437 CE1 PHE F 9 14.601 39.801 -6.070 1.00 42.85 C
+ATOM 5438 CE2 PHE F 9 15.643 40.907 -4.244 1.00 49.21 C
+ATOM 5439 CZ PHE F 9 14.709 40.017 -4.726 1.00 45.04 C
+ATOM 5440 H PHE F 9 15.903 44.430 -6.299 1.00 0.00 H
+ATOM 5441 HA PHE F 9 17.440 43.780 -8.752 1.00 0.00 H
+ATOM 5442 1HB PHE F 9 17.446 41.393 -8.244 1.00 0.00 H
+ATOM 5443 2HB PHE F 9 18.228 42.215 -6.942 1.00 0.00 H
+ATOM 5444 HD1 PHE F 9 15.356 40.308 -8.005 1.00 0.00 H
+ATOM 5445 HD2 PHE F 9 17.221 42.288 -4.722 1.00 0.00 H
+ATOM 5446 HE1 PHE F 9 13.863 39.099 -6.459 1.00 0.00 H
+ATOM 5447 HE2 PHE F 9 15.722 41.072 -3.177 1.00 0.00 H
+ATOM 5448 HZ PHE F 9 14.068 39.494 -4.035 1.00 0.00 H
+ATOM 5449 N VAL F 10 15.469 42.499 -9.755 1.00 39.17 N
+ATOM 5450 CA VAL F 10 14.271 42.096 -10.480 1.00 36.93 C
+ATOM 5451 C VAL F 10 14.338 40.602 -10.806 1.00 36.74 C
+ATOM 5452 O VAL F 10 15.422 40.010 -10.819 1.00 37.47 O
+ATOM 5453 CB VAL F 10 14.150 42.920 -11.782 1.00 41.43 C
+ATOM 5454 CG1 VAL F 10 14.062 44.422 -11.455 1.00 33.61 C
+ATOM 5455 CG2 VAL F 10 15.348 42.646 -12.662 1.00 43.36 C
+ATOM 5456 H VAL F 10 16.385 42.265 -10.130 1.00 0.00 H
+ATOM 5457 HA VAL F 10 13.393 42.280 -9.859 1.00 0.00 H
+ATOM 5458 HB VAL F 10 13.235 42.629 -12.306 1.00 0.00 H
+ATOM 5459 1HG1 VAL F 10 13.977 44.979 -12.368 1.00 0.00 H
+ATOM 5460 2HG1 VAL F 10 13.195 44.613 -10.826 1.00 0.00 H
+ATOM 5461 3HG1 VAL F 10 14.963 44.735 -10.934 1.00 0.00 H
+ATOM 5462 1HG2 VAL F 10 15.259 43.216 -13.589 1.00 0.00 H
+ATOM 5463 2HG2 VAL F 10 16.262 42.938 -12.140 1.00 0.00 H
+ATOM 5464 3HG2 VAL F 10 15.386 41.586 -12.885 1.00 0.00 H
+ATOM 5465 N VAL F 11 13.189 39.991 -11.083 1.00 36.96 N
+ATOM 5466 CA VAL F 11 13.134 38.572 -11.443 1.00 37.10 C
+ATOM 5467 C VAL F 11 12.598 38.388 -12.854 1.00 40.55 C
+ATOM 5468 O VAL F 11 11.532 38.914 -13.170 1.00 40.75 O
+ATOM 5469 CB VAL F 11 12.198 37.798 -10.489 1.00 30.32 C
+ATOM 5470 CG1 VAL F 11 12.146 36.329 -10.878 1.00 25.69 C
+ATOM 5471 CG2 VAL F 11 12.629 37.973 -9.032 1.00 32.64 C
+ATOM 5472 H VAL F 11 12.322 40.527 -11.035 1.00 0.00 H
+ATOM 5473 HA VAL F 11 14.140 38.154 -11.390 1.00 0.00 H
+ATOM 5474 HB VAL F 11 11.204 38.177 -10.611 1.00 0.00 H
+ATOM 5475 1HG1 VAL F 11 11.457 35.814 -10.216 1.00 0.00 H
+ATOM 5476 2HG1 VAL F 11 11.802 36.230 -11.909 1.00 0.00 H
+ATOM 5477 3HG1 VAL F 11 13.135 35.897 -10.787 1.00 0.00 H
+ATOM 5478 1HG2 VAL F 11 11.938 37.435 -8.376 1.00 0.00 H
+ATOM 5479 2HG2 VAL F 11 13.605 37.587 -8.903 1.00 0.00 H
+ATOM 5480 3HG2 VAL F 11 12.629 39.022 -8.771 1.00 0.00 H
+ATOM 5481 N ILE F 12 13.308 37.642 -13.708 1.00 39.33 N
+ATOM 5482 CA ILE F 12 12.824 37.369 -15.064 1.00 36.54 C
+ATOM 5483 C ILE F 12 12.713 35.866 -15.334 1.00 36.07 C
+ATOM 5484 O ILE F 12 13.700 35.134 -15.239 1.00 37.62 O
+ATOM 5485 CB ILE F 12 13.771 37.944 -16.142 1.00 35.23 C
+ATOM 5486 CG1 ILE F 12 13.993 39.431 -15.941 1.00 39.75 C
+ATOM 5487 CG2 ILE F 12 13.159 37.699 -17.530 1.00 44.40 C
+ATOM 5488 CD1 ILE F 12 15.235 39.740 -15.140 1.00 39.72 C
+ATOM 5489 H ILE F 12 14.190 37.255 -13.398 1.00 0.00 H
+ATOM 5490 HA ILE F 12 11.839 37.807 -15.185 1.00 0.00 H
+ATOM 5491 HB ILE F 12 14.739 37.450 -16.081 1.00 0.00 H
+ATOM 5492 1HG1 ILE F 12 14.093 39.894 -16.911 1.00 0.00 H
+ATOM 5493 2HG1 ILE F 12 13.131 39.864 -15.436 1.00 0.00 H
+ATOM 5494 1HG2 ILE F 12 13.817 38.093 -18.296 1.00 0.00 H
+ATOM 5495 2HG2 ILE F 12 13.023 36.631 -17.689 1.00 0.00 H
+ATOM 5496 3HG2 ILE F 12 12.194 38.201 -17.593 1.00 0.00 H
+ATOM 5497 1HD1 ILE F 12 15.345 40.814 -15.054 1.00 0.00 H
+ATOM 5498 2HD1 ILE F 12 15.158 39.296 -14.144 1.00 0.00 H
+ATOM 5499 3HD1 ILE F 12 16.097 39.326 -15.645 1.00 0.00 H
+ATOM 5500 N LYS F 13 11.523 35.408 -15.703 1.00 34.73 N
+ATOM 5501 CA LYS F 13 11.311 34.010 -16.048 1.00 38.44 C
+ATOM 5502 C LYS F 13 11.039 33.813 -17.518 1.00 39.35 C
+ATOM 5503 O LYS F 13 10.092 34.383 -18.071 1.00 38.41 O
+ATOM 5504 CB LYS F 13 10.177 33.405 -15.264 1.00 38.13 C
+ATOM 5505 CG LYS F 13 9.899 31.974 -15.655 1.00 36.41 C
+ATOM 5506 CD LYS F 13 8.771 31.380 -14.879 1.00 36.71 C
+ATOM 5507 CE LYS F 13 8.419 30.014 -15.448 1.00 34.98 C
+ATOM 5508 NZ LYS F 13 7.361 29.352 -14.674 1.00 42.98 N
+ATOM 5509 H LYS F 13 10.732 36.047 -15.730 1.00 0.00 H
+ATOM 5510 HA LYS F 13 12.222 33.453 -15.816 1.00 0.00 H
+ATOM 5511 1HB LYS F 13 10.437 33.424 -14.222 1.00 0.00 H
+ATOM 5512 2HB LYS F 13 9.286 33.994 -15.396 1.00 0.00 H
+ATOM 5513 1HG LYS F 13 9.652 31.928 -16.714 1.00 0.00 H
+ATOM 5514 2HG LYS F 13 10.796 31.374 -15.493 1.00 0.00 H
+ATOM 5515 1HD LYS F 13 9.055 31.274 -13.827 1.00 0.00 H
+ATOM 5516 2HD LYS F 13 7.901 32.034 -14.943 1.00 0.00 H
+ATOM 5517 1HE LYS F 13 8.079 30.142 -16.476 1.00 0.00 H
+ATOM 5518 2HE LYS F 13 9.307 29.380 -15.445 1.00 0.00 H
+ATOM 5519 1HZ LYS F 13 7.140 28.432 -15.094 1.00 0.00 H
+ATOM 5520 2HZ LYS F 13 7.722 29.228 -13.713 1.00 0.00 H
+ATOM 5521 3HZ LYS F 13 6.531 29.916 -14.663 1.00 0.00 H
+ATOM 5522 N ALA F 14 11.847 33.025 -18.183 1.00 40.96 N
+ATOM 5523 CA ALA F 14 11.615 32.829 -19.603 1.00 44.82 C
+ATOM 5524 C ALA F 14 10.322 32.072 -19.853 1.00 48.48 C
+ATOM 5525 O ALA F 14 10.111 30.985 -19.304 1.00 47.55 O
+ATOM 5526 CB ALA F 14 12.761 32.074 -20.213 1.00 38.69 C
+ATOM 5527 H ALA F 14 12.618 32.550 -17.701 1.00 0.00 H
+ATOM 5528 HA ALA F 14 11.529 33.811 -20.068 1.00 0.00 H
+ATOM 5529 1HB ALA F 14 12.598 31.935 -21.276 1.00 0.00 H
+ATOM 5530 2HB ALA F 14 13.675 32.611 -20.061 1.00 0.00 H
+ATOM 5531 3HB ALA F 14 12.814 31.126 -19.724 1.00 0.00 H
+ATOM 5532 N LEU F 15 9.480 32.581 -20.753 1.00 50.08 N
+ATOM 5533 CA LEU F 15 8.260 31.873 -21.132 1.00 51.95 C
+ATOM 5534 C LEU F 15 8.447 31.152 -22.462 1.00 52.96 C
+ATOM 5535 O LEU F 15 7.610 30.335 -22.871 1.00 55.35 O
+ATOM 5536 CB LEU F 15 7.077 32.848 -21.165 1.00 44.44 C
+ATOM 5537 CG LEU F 15 6.286 33.033 -19.819 1.00 42.57 C
+ATOM 5538 CD1 LEU F 15 7.228 33.054 -18.638 1.00 46.26 C
+ATOM 5539 CD2 LEU F 15 5.531 34.364 -19.882 1.00 37.34 C
+ATOM 5540 H LEU F 15 9.670 33.485 -21.188 1.00 0.00 H
+ATOM 5541 HA LEU F 15 8.048 31.122 -20.370 1.00 0.00 H
+ATOM 5542 1HB LEU F 15 7.447 33.816 -21.454 1.00 0.00 H
+ATOM 5543 2HB LEU F 15 6.374 32.512 -21.924 1.00 0.00 H
+ATOM 5544 HG LEU F 15 5.587 32.211 -19.685 1.00 0.00 H
+ATOM 5545 1HD1 LEU F 15 6.660 33.192 -17.721 1.00 0.00 H
+ATOM 5546 2HD1 LEU F 15 7.770 32.113 -18.584 1.00 0.00 H
+ATOM 5547 3HD1 LEU F 15 7.907 33.847 -18.755 1.00 0.00 H
+ATOM 5548 1HD2 LEU F 15 4.971 34.517 -18.958 1.00 0.00 H
+ATOM 5549 2HD2 LEU F 15 6.233 35.177 -20.012 1.00 0.00 H
+ATOM 5550 3HD2 LEU F 15 4.848 34.354 -20.709 1.00 0.00 H
+ATOM 5551 N GLU F 16 9.583 31.426 -23.098 1.00 53.20 N
+ATOM 5552 CA GLU F 16 9.972 30.837 -24.376 1.00 54.01 C
+ATOM 5553 C GLU F 16 11.490 30.704 -24.459 1.00 53.96 C
+ATOM 5554 O GLU F 16 12.219 31.323 -23.695 1.00 53.25 O
+ATOM 5555 CB GLU F 16 9.445 31.662 -25.562 1.00 47.21 C
+ATOM 5556 CG GLU F 16 9.949 33.109 -25.645 1.00 53.28 C
+ATOM 5557 CD GLU F 16 9.367 33.857 -26.848 1.00 59.94 C
+ATOM 5558 OE1 GLU F 16 8.687 33.236 -27.629 1.00 66.15 O
+ATOM 5559 OE2 GLU F 16 9.561 35.055 -26.949 1.00 55.63 O
+ATOM 5560 H GLU F 16 10.202 32.103 -22.674 1.00 0.00 H
+ATOM 5561 HA GLU F 16 9.548 29.834 -24.440 1.00 0.00 H
+ATOM 5562 1HB GLU F 16 9.735 31.172 -26.494 1.00 0.00 H
+ATOM 5563 2HB GLU F 16 8.355 31.690 -25.534 1.00 0.00 H
+ATOM 5564 1HG GLU F 16 9.681 33.630 -24.728 1.00 0.00 H
+ATOM 5565 2HG GLU F 16 11.042 33.094 -25.719 1.00 0.00 H
+ATOM 5566 N ASP F 17 11.969 29.859 -25.358 1.00 54.13 N
+ATOM 5567 CA ASP F 17 13.410 29.713 -25.541 1.00 52.21 C
+ATOM 5568 C ASP F 17 14.043 30.994 -26.070 1.00 49.99 C
+ATOM 5569 O ASP F 17 13.421 31.716 -26.849 1.00 47.14 O
+ATOM 5570 CB ASP F 17 13.711 28.540 -26.463 1.00 46.18 C
+ATOM 5571 CG ASP F 17 13.433 27.207 -25.789 1.00 56.57 C
+ATOM 5572 OD1 ASP F 17 13.249 27.198 -24.580 1.00 65.92 O
+ATOM 5573 OD2 ASP F 17 13.388 26.213 -26.471 1.00 53.46 O
+ATOM 5574 H ASP F 17 11.334 29.346 -25.951 1.00 0.00 H
+ATOM 5575 HA ASP F 17 13.853 29.497 -24.580 1.00 0.00 H
+ATOM 5576 1HB ASP F 17 13.115 28.618 -27.370 1.00 0.00 H
+ATOM 5577 2HB ASP F 17 14.765 28.571 -26.750 1.00 0.00 H
+ATOM 5578 N GLY F 18 15.289 31.264 -25.676 1.00 47.52 N
+ATOM 5579 CA GLY F 18 16.007 32.420 -26.209 1.00 44.92 C
+ATOM 5580 C GLY F 18 15.680 33.797 -25.603 1.00 45.01 C
+ATOM 5581 O GLY F 18 15.901 34.813 -26.261 1.00 50.15 O
+ATOM 5582 H GLY F 18 15.778 30.630 -25.034 1.00 0.00 H
+ATOM 5583 1HA GLY F 18 17.072 32.236 -26.086 1.00 0.00 H
+ATOM 5584 2HA GLY F 18 15.833 32.463 -27.282 1.00 0.00 H
+ATOM 5585 N VAL F 19 15.130 33.858 -24.391 1.00 43.49 N
+ATOM 5586 CA VAL F 19 14.849 35.163 -23.787 1.00 42.10 C
+ATOM 5587 C VAL F 19 16.156 35.844 -23.442 1.00 39.62 C
+ATOM 5588 O VAL F 19 17.063 35.216 -22.898 1.00 39.76 O
+ATOM 5589 CB VAL F 19 13.954 35.037 -22.541 1.00 53.61 C
+ATOM 5590 CG1 VAL F 19 13.846 36.388 -21.802 1.00 47.46 C
+ATOM 5591 CG2 VAL F 19 12.586 34.594 -22.989 1.00 39.48 C
+ATOM 5592 H VAL F 19 14.962 33.011 -23.854 1.00 0.00 H
+ATOM 5593 HA VAL F 19 14.319 35.779 -24.515 1.00 0.00 H
+ATOM 5594 HB VAL F 19 14.371 34.313 -21.876 1.00 0.00 H
+ATOM 5595 1HG1 VAL F 19 13.218 36.274 -20.930 1.00 0.00 H
+ATOM 5596 2HG1 VAL F 19 14.840 36.709 -21.483 1.00 0.00 H
+ATOM 5597 3HG1 VAL F 19 13.416 37.141 -22.468 1.00 0.00 H
+ATOM 5598 1HG2 VAL F 19 11.936 34.485 -22.144 1.00 0.00 H
+ATOM 5599 2HG2 VAL F 19 12.166 35.331 -23.670 1.00 0.00 H
+ATOM 5600 3HG2 VAL F 19 12.675 33.648 -23.501 1.00 0.00 H
+ATOM 5601 N ASN F 20 16.280 37.117 -23.784 1.00 38.75 N
+ATOM 5602 CA ASN F 20 17.519 37.826 -23.526 1.00 39.53 C
+ATOM 5603 C ASN F 20 17.364 38.965 -22.530 1.00 40.54 C
+ATOM 5604 O ASN F 20 16.600 39.911 -22.751 1.00 39.41 O
+ATOM 5605 CB ASN F 20 18.129 38.316 -24.826 1.00 56.19 C
+ATOM 5606 CG ASN F 20 18.611 37.170 -25.710 1.00 62.75 C
+ATOM 5607 OD1 ASN F 20 19.485 36.386 -25.317 1.00 68.35 O
+ATOM 5608 ND2 ASN F 20 18.063 37.067 -26.895 1.00 55.15 N
+ATOM 5609 H ASN F 20 15.497 37.599 -24.221 1.00 0.00 H
+ATOM 5610 HA ASN F 20 18.226 37.125 -23.083 1.00 0.00 H
+ATOM 5611 1HB ASN F 20 17.386 38.889 -25.379 1.00 0.00 H
+ATOM 5612 2HB ASN F 20 18.964 38.982 -24.612 1.00 0.00 H
+ATOM 5613 1HD2 ASN F 20 18.342 36.331 -27.512 1.00 0.00 H
+ATOM 5614 2HD2 ASN F 20 17.360 37.714 -27.180 1.00 0.00 H
+ATOM 5615 N VAL F 21 18.078 38.853 -21.410 1.00 39.54 N
+ATOM 5616 CA VAL F 21 18.049 39.904 -20.405 1.00 40.49 C
+ATOM 5617 C VAL F 21 19.339 40.691 -20.544 1.00 39.67 C
+ATOM 5618 O VAL F 21 20.439 40.159 -20.374 1.00 40.01 O
+ATOM 5619 CB VAL F 21 17.900 39.337 -18.995 1.00 35.10 C
+ATOM 5620 CG1 VAL F 21 17.887 40.471 -18.011 1.00 34.18 C
+ATOM 5621 CG2 VAL F 21 16.629 38.544 -18.925 1.00 28.34 C
+ATOM 5622 H VAL F 21 18.666 38.029 -21.271 1.00 0.00 H
+ATOM 5623 HA VAL F 21 17.208 40.571 -20.599 1.00 0.00 H
+ATOM 5624 HB VAL F 21 18.750 38.698 -18.760 1.00 0.00 H
+ATOM 5625 1HG1 VAL F 21 17.786 40.091 -17.004 1.00 0.00 H
+ATOM 5626 2HG1 VAL F 21 18.817 41.032 -18.093 1.00 0.00 H
+ATOM 5627 3HG1 VAL F 21 17.048 41.121 -18.240 1.00 0.00 H
+ATOM 5628 1HG2 VAL F 21 16.507 38.143 -17.928 1.00 0.00 H
+ATOM 5629 2HG2 VAL F 21 15.792 39.191 -19.163 1.00 0.00 H
+ATOM 5630 3HG2 VAL F 21 16.676 37.726 -19.647 1.00 0.00 H
+ATOM 5631 N ILE F 22 19.198 41.947 -20.920 1.00 39.44 N
+ATOM 5632 CA ILE F 22 20.329 42.755 -21.311 1.00 38.00 C
+ATOM 5633 C ILE F 22 20.710 43.822 -20.301 1.00 36.94 C
+ATOM 5634 O ILE F 22 19.880 44.624 -19.869 1.00 38.49 O
+ATOM 5635 CB ILE F 22 20.018 43.423 -22.652 1.00 38.59 C
+ATOM 5636 CG1 ILE F 22 19.726 42.357 -23.712 1.00 40.78 C
+ATOM 5637 CG2 ILE F 22 21.175 44.283 -23.077 1.00 33.56 C
+ATOM 5638 CD1 ILE F 22 19.158 42.928 -24.991 1.00 37.80 C
+ATOM 5639 H ILE F 22 18.270 42.336 -21.001 1.00 0.00 H
+ATOM 5640 HA ILE F 22 21.175 42.099 -21.448 1.00 0.00 H
+ATOM 5641 HB ILE F 22 19.135 44.019 -22.553 1.00 0.00 H
+ATOM 5642 1HG1 ILE F 22 20.644 41.824 -23.939 1.00 0.00 H
+ATOM 5643 2HG1 ILE F 22 19.001 41.646 -23.311 1.00 0.00 H
+ATOM 5644 1HG2 ILE F 22 20.927 44.737 -24.018 1.00 0.00 H
+ATOM 5645 2HG2 ILE F 22 21.361 45.052 -22.337 1.00 0.00 H
+ATOM 5646 3HG2 ILE F 22 22.070 43.667 -23.189 1.00 0.00 H
+ATOM 5647 1HD1 ILE F 22 18.969 42.119 -25.697 1.00 0.00 H
+ATOM 5648 2HD1 ILE F 22 18.220 43.448 -24.774 1.00 0.00 H
+ATOM 5649 3HD1 ILE F 22 19.870 43.627 -25.421 1.00 0.00 H
+ATOM 5650 N GLY F 23 21.979 43.827 -19.915 1.00 34.33 N
+ATOM 5651 CA GLY F 23 22.475 44.838 -19.000 1.00 36.67 C
+ATOM 5652 C GLY F 23 22.991 46.034 -19.788 1.00 39.62 C
+ATOM 5653 O GLY F 23 23.807 45.881 -20.716 1.00 37.69 O
+ATOM 5654 H GLY F 23 22.610 43.135 -20.300 1.00 0.00 H
+ATOM 5655 1HA GLY F 23 21.676 45.155 -18.328 1.00 0.00 H
+ATOM 5656 2HA GLY F 23 23.275 44.423 -18.387 1.00 0.00 H
+ATOM 5657 N LEU F 24 22.531 47.221 -19.365 1.00 38.88 N
+ATOM 5658 CA LEU F 24 22.897 48.524 -19.922 1.00 40.32 C
+ATOM 5659 C LEU F 24 23.834 49.245 -18.961 1.00 43.68 C
+ATOM 5660 O LEU F 24 23.542 49.359 -17.756 1.00 42.09 O
+ATOM 5661 CB LEU F 24 21.647 49.379 -20.141 1.00 38.65 C
+ATOM 5662 CG LEU F 24 20.785 49.062 -21.380 1.00 44.42 C
+ATOM 5663 CD1 LEU F 24 20.058 47.725 -21.186 1.00 38.53 C
+ATOM 5664 CD2 LEU F 24 19.779 50.181 -21.608 1.00 37.93 C
+ATOM 5665 H LEU F 24 21.845 47.218 -18.612 1.00 0.00 H
+ATOM 5666 HA LEU F 24 23.404 48.376 -20.870 1.00 0.00 H
+ATOM 5667 1HB LEU F 24 21.031 49.230 -19.283 1.00 0.00 H
+ATOM 5668 2HB LEU F 24 21.937 50.429 -20.181 1.00 0.00 H
+ATOM 5669 HG LEU F 24 21.424 48.985 -22.240 1.00 0.00 H
+ATOM 5670 1HD1 LEU F 24 19.466 47.506 -22.068 1.00 0.00 H
+ATOM 5671 2HD1 LEU F 24 20.772 46.938 -21.041 1.00 0.00 H
+ATOM 5672 3HD1 LEU F 24 19.406 47.781 -20.314 1.00 0.00 H
+ATOM 5673 1HD2 LEU F 24 19.180 49.958 -22.495 1.00 0.00 H
+ATOM 5674 2HD2 LEU F 24 19.125 50.268 -20.750 1.00 0.00 H
+ATOM 5675 3HD2 LEU F 24 20.307 51.123 -21.760 1.00 0.00 H
+ATOM 5676 N THR F 25 24.949 49.748 -19.497 1.00 44.59 N
+ATOM 5677 CA THR F 25 25.999 50.319 -18.660 1.00 44.82 C
+ATOM 5678 C THR F 25 25.622 51.571 -17.894 1.00 45.84 C
+ATOM 5679 O THR F 25 24.921 52.449 -18.396 1.00 47.96 O
+ATOM 5680 CB THR F 25 27.255 50.669 -19.488 1.00 44.21 C
+ATOM 5681 OG1 THR F 25 26.921 51.602 -20.521 1.00 42.26 O
+ATOM 5682 CG2 THR F 25 27.839 49.433 -20.104 1.00 24.51 C
+ATOM 5683 H THR F 25 25.097 49.648 -20.496 1.00 0.00 H
+ATOM 5684 HA THR F 25 26.281 49.559 -17.948 1.00 0.00 H
+ATOM 5685 HB THR F 25 28.002 51.125 -18.835 1.00 0.00 H
+ATOM 5686 HG1 THR F 25 27.141 52.526 -20.241 1.00 0.00 H
+ATOM 5687 1HG2 THR F 25 28.726 49.696 -20.681 1.00 0.00 H
+ATOM 5688 2HG2 THR F 25 28.110 48.740 -19.312 1.00 0.00 H
+ATOM 5689 3HG2 THR F 25 27.110 48.972 -20.755 1.00 0.00 H
+ATOM 5690 N ARG F 26 26.168 51.649 -16.680 1.00 46.16 N
+ATOM 5691 CA ARG F 26 26.060 52.805 -15.803 1.00 43.69 C
+ATOM 5692 C ARG F 26 27.106 53.859 -16.154 1.00 42.02 C
+ATOM 5693 O ARG F 26 28.281 53.539 -16.329 1.00 40.52 O
+ATOM 5694 CB ARG F 26 26.250 52.401 -14.345 1.00 34.37 C
+ATOM 5695 CG ARG F 26 26.037 53.535 -13.335 1.00 34.18 C
+ATOM 5696 CD ARG F 26 26.258 53.100 -11.927 1.00 43.66 C
+ATOM 5697 NE ARG F 26 25.344 52.053 -11.531 1.00 45.04 N
+ATOM 5698 CZ ARG F 26 24.074 52.239 -11.145 1.00 45.20 C
+ATOM 5699 NH1 ARG F 26 23.553 53.445 -11.103 1.00 34.87 N
+ATOM 5700 NH2 ARG F 26 23.373 51.181 -10.815 1.00 35.35 N
+ATOM 5701 H ARG F 26 26.678 50.832 -16.353 1.00 0.00 H
+ATOM 5702 HA ARG F 26 25.069 53.242 -15.929 1.00 0.00 H
+ATOM 5703 1HB ARG F 26 25.564 51.589 -14.093 1.00 0.00 H
+ATOM 5704 2HB ARG F 26 27.262 52.018 -14.203 1.00 0.00 H
+ATOM 5705 1HG ARG F 26 26.743 54.336 -13.540 1.00 0.00 H
+ATOM 5706 2HG ARG F 26 25.022 53.915 -13.421 1.00 0.00 H
+ATOM 5707 1HD ARG F 26 27.273 52.728 -11.816 1.00 0.00 H
+ATOM 5708 2HD ARG F 26 26.112 53.947 -11.261 1.00 0.00 H
+ATOM 5709 HE ARG F 26 25.680 51.083 -11.522 1.00 0.00 H
+ATOM 5710 1HH1 ARG F 26 24.117 54.238 -11.357 1.00 0.00 H
+ATOM 5711 2HH1 ARG F 26 22.596 53.576 -10.803 1.00 0.00 H
+ATOM 5712 1HH2 ARG F 26 23.841 50.270 -10.859 1.00 0.00 H
+ATOM 5713 2HH2 ARG F 26 22.395 51.251 -10.533 1.00 0.00 H
+ATOM 5714 N GLY F 27 26.690 55.122 -16.226 1.00 42.51 N
+ATOM 5715 CA GLY F 27 27.625 56.208 -16.493 1.00 45.89 C
+ATOM 5716 C GLY F 27 27.187 57.050 -17.682 1.00 49.67 C
+ATOM 5717 O GLY F 27 26.103 56.847 -18.230 1.00 48.89 O
+ATOM 5718 H GLY F 27 25.710 55.330 -16.100 1.00 0.00 H
+ATOM 5719 1HA GLY F 27 27.706 56.840 -15.607 1.00 0.00 H
+ATOM 5720 2HA GLY F 27 28.617 55.801 -16.682 1.00 0.00 H
+ATOM 5721 N ALA F 28 28.019 58.012 -18.070 1.00 49.63 N
+ATOM 5722 CA ALA F 28 27.693 58.903 -19.180 1.00 49.70 C
+ATOM 5723 C ALA F 28 27.452 58.112 -20.459 1.00 48.81 C
+ATOM 5724 O ALA F 28 26.576 58.438 -21.251 1.00 47.72 O
+ATOM 5725 CB ALA F 28 28.802 59.911 -19.402 1.00 45.40 C
+ATOM 5726 H ALA F 28 28.897 58.134 -17.582 1.00 0.00 H
+ATOM 5727 HA ALA F 28 26.766 59.430 -18.926 1.00 0.00 H
+ATOM 5728 1HB ALA F 28 28.530 60.578 -20.219 1.00 0.00 H
+ATOM 5729 2HB ALA F 28 28.961 60.490 -18.499 1.00 0.00 H
+ATOM 5730 3HB ALA F 28 29.721 59.380 -19.661 1.00 0.00 H
+ATOM 5731 N ASP F 29 28.252 57.062 -20.656 1.00 48.40 N
+ATOM 5732 CA ASP F 29 28.089 56.221 -21.832 1.00 48.54 C
+ATOM 5733 C ASP F 29 27.187 55.042 -21.501 1.00 49.46 C
+ATOM 5734 O ASP F 29 27.546 54.186 -20.685 1.00 50.85 O
+ATOM 5735 CB ASP F 29 29.444 55.701 -22.320 1.00 52.70 C
+ATOM 5736 CG ASP F 29 30.337 56.789 -22.919 1.00 63.30 C
+ATOM 5737 OD1 ASP F 29 29.822 57.701 -23.518 1.00 66.10 O
+ATOM 5738 OD2 ASP F 29 31.529 56.697 -22.759 1.00 69.63 O
+ATOM 5739 H ASP F 29 28.957 56.843 -19.975 1.00 0.00 H
+ATOM 5740 HA ASP F 29 27.626 56.804 -22.623 1.00 0.00 H
+ATOM 5741 1HB ASP F 29 29.974 55.225 -21.497 1.00 0.00 H
+ATOM 5742 2HB ASP F 29 29.273 54.936 -23.083 1.00 0.00 H
+ATOM 5743 N THR F 30 26.030 54.991 -22.157 1.00 47.92 N
+ATOM 5744 CA THR F 30 25.078 53.912 -21.914 1.00 45.68 C
+ATOM 5745 C THR F 30 25.052 52.990 -23.130 1.00 47.12 C
+ATOM 5746 O THR F 30 24.761 53.424 -24.242 1.00 47.27 O
+ATOM 5747 CB THR F 30 23.657 54.445 -21.641 1.00 35.92 C
+ATOM 5748 OG1 THR F 30 23.662 55.284 -20.469 1.00 44.04 O
+ATOM 5749 CG2 THR F 30 22.706 53.262 -21.405 1.00 41.74 C
+ATOM 5750 H THR F 30 25.804 55.726 -22.811 1.00 0.00 H
+ATOM 5751 HA THR F 30 25.391 53.341 -21.050 1.00 0.00 H
+ATOM 5752 HB THR F 30 23.315 55.027 -22.488 1.00 0.00 H
+ATOM 5753 HG1 THR F 30 24.189 56.074 -20.633 1.00 0.00 H
+ATOM 5754 1HG2 THR F 30 21.706 53.639 -21.210 1.00 0.00 H
+ATOM 5755 2HG2 THR F 30 22.685 52.628 -22.289 1.00 0.00 H
+ATOM 5756 3HG2 THR F 30 23.059 52.682 -20.546 1.00 0.00 H
+ATOM 5757 N ARG F 31 25.370 51.722 -22.910 1.00 48.43 N
+ATOM 5758 CA ARG F 31 25.434 50.752 -23.997 1.00 48.66 C
+ATOM 5759 C ARG F 31 25.218 49.339 -23.475 1.00 50.52 C
+ATOM 5760 O ARG F 31 25.229 49.105 -22.270 1.00 53.76 O
+ATOM 5761 CB ARG F 31 26.784 50.868 -24.694 1.00 39.75 C
+ATOM 5762 CG ARG F 31 27.981 50.541 -23.806 1.00 47.22 C
+ATOM 5763 CD ARG F 31 29.267 51.119 -24.329 1.00 53.34 C
+ATOM 5764 NE ARG F 31 29.701 50.521 -25.591 1.00 67.16 N
+ATOM 5765 CZ ARG F 31 30.716 50.984 -26.343 1.00 66.09 C
+ATOM 5766 NH1 ARG F 31 31.398 52.048 -25.963 1.00 72.25 N
+ATOM 5767 NH2 ARG F 31 31.038 50.375 -27.469 1.00 63.93 N
+ATOM 5768 H ARG F 31 25.644 51.456 -21.972 1.00 0.00 H
+ATOM 5769 HA ARG F 31 24.647 50.976 -24.718 1.00 0.00 H
+ATOM 5770 1HB ARG F 31 26.812 50.202 -25.557 1.00 0.00 H
+ATOM 5771 2HB ARG F 31 26.922 51.886 -25.061 1.00 0.00 H
+ATOM 5772 1HG ARG F 31 27.807 50.961 -22.818 1.00 0.00 H
+ATOM 5773 2HG ARG F 31 28.091 49.453 -23.723 1.00 0.00 H
+ATOM 5774 1HD ARG F 31 29.143 52.200 -24.484 1.00 0.00 H
+ATOM 5775 2HD ARG F 31 30.055 50.954 -23.589 1.00 0.00 H
+ATOM 5776 HE ARG F 31 29.209 49.702 -25.925 1.00 0.00 H
+ATOM 5777 1HH1 ARG F 31 31.162 52.526 -25.102 1.00 0.00 H
+ATOM 5778 2HH1 ARG F 31 32.156 52.388 -26.531 1.00 0.00 H
+ATOM 5779 1HH2 ARG F 31 30.523 49.563 -27.768 1.00 0.00 H
+ATOM 5780 2HH2 ARG F 31 31.795 50.718 -28.030 1.00 0.00 H
+ATOM 5781 N PHE F 32 25.005 48.384 -24.363 1.00 50.15 N
+ATOM 5782 CA PHE F 32 24.839 47.019 -23.872 1.00 49.06 C
+ATOM 5783 C PHE F 32 26.197 46.470 -23.475 1.00 48.26 C
+ATOM 5784 O PHE F 32 27.174 46.664 -24.200 1.00 48.50 O
+ATOM 5785 CB PHE F 32 24.249 46.114 -24.948 1.00 46.05 C
+ATOM 5786 CG PHE F 32 22.837 46.428 -25.311 1.00 48.52 C
+ATOM 5787 CD1 PHE F 32 22.091 47.316 -24.557 1.00 55.28 C
+ATOM 5788 CD2 PHE F 32 22.248 45.831 -26.415 1.00 50.28 C
+ATOM 5789 CE1 PHE F 32 20.781 47.604 -24.902 1.00 49.22 C
+ATOM 5790 CE2 PHE F 32 20.946 46.114 -26.757 1.00 45.34 C
+ATOM 5791 CZ PHE F 32 20.215 47.003 -25.999 1.00 51.46 C
+ATOM 5792 H PHE F 32 24.977 48.584 -25.353 1.00 0.00 H
+ATOM 5793 HA PHE F 32 24.186 47.025 -22.996 1.00 0.00 H
+ATOM 5794 1HB PHE F 32 24.859 46.167 -25.848 1.00 0.00 H
+ATOM 5795 2HB PHE F 32 24.284 45.080 -24.596 1.00 0.00 H
+ATOM 5796 HD1 PHE F 32 22.550 47.782 -23.691 1.00 0.00 H
+ATOM 5797 HD2 PHE F 32 22.828 45.129 -27.014 1.00 0.00 H
+ATOM 5798 HE1 PHE F 32 20.194 48.308 -24.310 1.00 0.00 H
+ATOM 5799 HE2 PHE F 32 20.494 45.640 -27.627 1.00 0.00 H
+ATOM 5800 HZ PHE F 32 19.194 47.234 -26.268 1.00 0.00 H
+ATOM 5801 N HIS F 33 26.260 45.754 -22.357 1.00 44.71 N
+ATOM 5802 CA HIS F 33 27.524 45.123 -21.987 1.00 39.77 C
+ATOM 5803 C HIS F 33 27.361 43.621 -21.797 1.00 37.49 C
+ATOM 5804 O HIS F 33 28.329 42.869 -21.913 1.00 36.38 O
+ATOM 5805 CB HIS F 33 28.103 45.759 -20.722 1.00 37.86 C
+ATOM 5806 CG HIS F 33 27.362 45.471 -19.456 1.00 40.95 C
+ATOM 5807 ND1 HIS F 33 27.567 44.313 -18.748 1.00 40.61 N
+ATOM 5808 CD2 HIS F 33 26.423 46.165 -18.774 1.00 39.10 C
+ATOM 5809 CE1 HIS F 33 26.798 44.306 -17.685 1.00 41.12 C
+ATOM 5810 NE2 HIS F 33 26.094 45.415 -17.673 1.00 42.95 N
+ATOM 5811 H HIS F 33 25.433 45.668 -21.773 1.00 0.00 H
+ATOM 5812 HA HIS F 33 28.249 45.266 -22.786 1.00 0.00 H
+ATOM 5813 1HB HIS F 33 29.130 45.418 -20.592 1.00 0.00 H
+ATOM 5814 2HB HIS F 33 28.138 46.821 -20.859 1.00 0.00 H
+ATOM 5815 HD2 HIS F 33 26.009 47.130 -19.044 1.00 0.00 H
+ATOM 5816 HE1 HIS F 33 26.756 43.513 -16.938 1.00 0.00 H
+ATOM 5817 HE2 HIS F 33 25.426 45.656 -16.957 1.00 0.00 H
+ATOM 5818 N HIS F 34 26.131 43.175 -21.539 1.00 33.93 N
+ATOM 5819 CA HIS F 34 25.901 41.745 -21.313 1.00 34.60 C
+ATOM 5820 C HIS F 34 24.488 41.314 -21.647 1.00 34.04 C
+ATOM 5821 O HIS F 34 23.523 42.001 -21.337 1.00 31.77 O
+ATOM 5822 CB HIS F 34 26.194 41.336 -19.863 1.00 38.00 C
+ATOM 5823 CG HIS F 34 26.059 39.840 -19.624 1.00 39.78 C
+ATOM 5824 ND1 HIS F 34 26.983 38.924 -20.088 1.00 44.47 N
+ATOM 5825 CD2 HIS F 34 25.101 39.116 -18.982 1.00 44.75 C
+ATOM 5826 CE1 HIS F 34 26.600 37.700 -19.740 1.00 38.55 C
+ATOM 5827 NE2 HIS F 34 25.462 37.791 -19.070 1.00 43.91 N
+ATOM 5828 H HIS F 34 25.370 43.846 -21.446 1.00 0.00 H
+ATOM 5829 HA HIS F 34 26.569 41.175 -21.954 1.00 0.00 H
+ATOM 5830 1HB HIS F 34 27.213 41.628 -19.604 1.00 0.00 H
+ATOM 5831 2HB HIS F 34 25.518 41.860 -19.189 1.00 0.00 H
+ATOM 5832 HD2 HIS F 34 24.209 39.508 -18.492 1.00 0.00 H
+ATOM 5833 HE1 HIS F 34 27.131 36.776 -19.969 1.00 0.00 H
+ATOM 5834 HE2 HIS F 34 24.926 36.998 -18.681 1.00 0.00 H
+ATOM 5835 N SER F 35 24.366 40.139 -22.255 1.00 34.66 N
+ATOM 5836 CA SER F 35 23.053 39.581 -22.568 1.00 40.44 C
+ATOM 5837 C SER F 35 22.941 38.151 -22.052 1.00 41.28 C
+ATOM 5838 O SER F 35 23.617 37.246 -22.548 1.00 39.54 O
+ATOM 5839 CB SER F 35 22.819 39.617 -24.068 1.00 44.91 C
+ATOM 5840 OG SER F 35 21.602 39.024 -24.405 1.00 49.51 O
+ATOM 5841 H SER F 35 25.199 39.616 -22.492 1.00 0.00 H
+ATOM 5842 HA SER F 35 22.290 40.177 -22.075 1.00 0.00 H
+ATOM 5843 1HB SER F 35 22.827 40.655 -24.413 1.00 0.00 H
+ATOM 5844 2HB SER F 35 23.630 39.093 -24.574 1.00 0.00 H
+ATOM 5845 HG SER F 35 21.682 38.096 -24.153 1.00 0.00 H
+ATOM 5846 N GLU F 36 22.104 37.959 -21.033 1.00 43.47 N
+ATOM 5847 CA GLU F 36 21.943 36.647 -20.424 1.00 42.45 C
+ATOM 5848 C GLU F 36 20.824 35.883 -21.113 1.00 44.76 C
+ATOM 5849 O GLU F 36 19.687 36.355 -21.183 1.00 42.51 O
+ATOM 5850 CB GLU F 36 21.648 36.744 -18.920 1.00 37.11 C
+ATOM 5851 CG GLU F 36 21.616 35.373 -18.213 1.00 29.33 C
+ATOM 5852 CD GLU F 36 22.989 34.731 -18.099 1.00 29.12 C
+ATOM 5853 OE1 GLU F 36 23.975 35.427 -18.232 1.00 37.20 O
+ATOM 5854 OE2 GLU F 36 23.056 33.531 -17.903 1.00 35.63 O
+ATOM 5855 H GLU F 36 21.565 38.746 -20.683 1.00 0.00 H
+ATOM 5856 HA GLU F 36 22.868 36.087 -20.555 1.00 0.00 H
+ATOM 5857 1HB GLU F 36 22.402 37.366 -18.437 1.00 0.00 H
+ATOM 5858 2HB GLU F 36 20.682 37.221 -18.771 1.00 0.00 H
+ATOM 5859 1HG GLU F 36 21.222 35.501 -17.211 1.00 0.00 H
+ATOM 5860 2HG GLU F 36 20.944 34.704 -18.754 1.00 0.00 H
+ATOM 5861 N LYS F 37 21.159 34.716 -21.649 1.00 46.11 N
+ATOM 5862 CA LYS F 37 20.181 33.904 -22.365 1.00 49.04 C
+ATOM 5863 C LYS F 37 19.425 32.975 -21.419 1.00 48.90 C
+ATOM 5864 O LYS F 37 20.034 32.156 -20.723 1.00 46.53 O
+ATOM 5865 CB LYS F 37 20.881 33.087 -23.452 1.00 53.95 C
+ATOM 5866 CG LYS F 37 19.956 32.230 -24.316 1.00 48.69 C
+ATOM 5867 CD LYS F 37 20.756 31.455 -25.386 1.00 45.00 C
+ATOM 5868 CE LYS F 37 19.855 30.523 -26.201 1.00 45.00 C
+ATOM 5869 NZ LYS F 37 20.624 29.697 -27.178 1.00 45.00 N
+ATOM 5870 H LYS F 37 22.111 34.392 -21.559 1.00 0.00 H
+ATOM 5871 HA LYS F 37 19.461 34.567 -22.840 1.00 0.00 H
+ATOM 5872 1HB LYS F 37 21.400 33.773 -24.122 1.00 0.00 H
+ATOM 5873 2HB LYS F 37 21.625 32.436 -22.996 1.00 0.00 H
+ATOM 5874 1HG LYS F 37 19.408 31.519 -23.683 1.00 0.00 H
+ATOM 5875 2HG LYS F 37 19.228 32.877 -24.809 1.00 0.00 H
+ATOM 5876 1HD LYS F 37 21.224 32.168 -26.068 1.00 0.00 H
+ATOM 5877 2HD LYS F 37 21.540 30.864 -24.908 1.00 0.00 H
+ATOM 5878 1HE LYS F 37 19.327 29.860 -25.526 1.00 0.00 H
+ATOM 5879 2HE LYS F 37 19.130 31.122 -26.751 1.00 0.00 H
+ATOM 5880 1HZ LYS F 37 19.984 29.100 -27.687 1.00 0.00 H
+ATOM 5881 2HZ LYS F 37 21.113 30.297 -27.825 1.00 0.00 H
+ATOM 5882 3HZ LYS F 37 21.286 29.124 -26.678 1.00 0.00 H
+ATOM 5883 N LEU F 38 18.102 33.124 -21.390 1.00 49.50 N
+ATOM 5884 CA LEU F 38 17.237 32.318 -20.542 1.00 49.73 C
+ATOM 5885 C LEU F 38 16.332 31.456 -21.425 1.00 50.68 C
+ATOM 5886 O LEU F 38 15.543 31.983 -22.215 1.00 48.59 O
+ATOM 5887 CB LEU F 38 16.366 33.224 -19.651 1.00 41.32 C
+ATOM 5888 CG LEU F 38 17.088 34.272 -18.828 1.00 48.31 C
+ATOM 5889 CD1 LEU F 38 16.051 35.091 -18.042 1.00 34.51 C
+ATOM 5890 CD2 LEU F 38 18.069 33.614 -17.925 1.00 51.29 C
+ATOM 5891 H LEU F 38 17.685 33.830 -21.985 1.00 0.00 H
+ATOM 5892 HA LEU F 38 17.843 31.662 -19.920 1.00 0.00 H
+ATOM 5893 1HB LEU F 38 15.681 33.754 -20.273 1.00 0.00 H
+ATOM 5894 2HB LEU F 38 15.799 32.594 -18.961 1.00 0.00 H
+ATOM 5895 HG LEU F 38 17.622 34.952 -19.501 1.00 0.00 H
+ATOM 5896 1HD1 LEU F 38 16.558 35.854 -17.468 1.00 0.00 H
+ATOM 5897 2HD1 LEU F 38 15.356 35.564 -18.738 1.00 0.00 H
+ATOM 5898 3HD1 LEU F 38 15.496 34.437 -17.364 1.00 0.00 H
+ATOM 5899 1HD2 LEU F 38 18.601 34.366 -17.363 1.00 0.00 H
+ATOM 5900 2HD2 LEU F 38 17.538 32.945 -17.247 1.00 0.00 H
+ATOM 5901 3HD2 LEU F 38 18.781 33.047 -18.521 1.00 0.00 H
+ATOM 5902 N ASP F 39 16.448 30.141 -21.320 1.00 52.46 N
+ATOM 5903 CA ASP F 39 15.592 29.298 -22.150 1.00 53.07 C
+ATOM 5904 C ASP F 39 14.308 29.029 -21.398 1.00 53.16 C
+ATOM 5905 O ASP F 39 14.228 29.367 -20.218 1.00 53.06 O
+ATOM 5906 CB ASP F 39 16.308 28.045 -22.629 1.00 61.00 C
+ATOM 5907 CG ASP F 39 17.355 28.389 -23.711 1.00 66.70 C
+ATOM 5908 OD1 ASP F 39 17.126 29.328 -24.488 1.00 58.50 O
+ATOM 5909 OD2 ASP F 39 18.362 27.722 -23.769 1.00 63.86 O
+ATOM 5910 H ASP F 39 17.107 29.731 -20.655 1.00 0.00 H
+ATOM 5911 HA ASP F 39 15.335 29.857 -23.040 1.00 0.00 H
+ATOM 5912 1HB ASP F 39 16.807 27.555 -21.785 1.00 0.00 H
+ATOM 5913 2HB ASP F 39 15.580 27.344 -23.046 1.00 0.00 H
+ATOM 5914 N LYS F 40 13.291 28.486 -22.065 1.00 51.08 N
+ATOM 5915 CA LYS F 40 11.987 28.380 -21.426 1.00 48.08 C
+ATOM 5916 C LYS F 40 12.080 27.724 -20.058 1.00 46.10 C
+ATOM 5917 O LYS F 40 12.604 26.616 -19.910 1.00 41.07 O
+ATOM 5918 CB LYS F 40 11.032 27.588 -22.323 1.00 48.20 C
+ATOM 5919 CG LYS F 40 9.591 27.538 -21.851 1.00 41.66 C
+ATOM 5920 CD LYS F 40 8.704 26.800 -22.861 1.00 50.67 C
+ATOM 5921 CE LYS F 40 7.259 26.730 -22.394 1.00 51.73 C
+ATOM 5922 NZ LYS F 40 6.601 28.065 -22.443 1.00 61.40 N
+ATOM 5923 H LYS F 40 13.394 28.167 -23.032 1.00 0.00 H
+ATOM 5924 HA LYS F 40 11.585 29.385 -21.296 1.00 0.00 H
+ATOM 5925 1HB LYS F 40 11.048 28.001 -23.327 1.00 0.00 H
+ATOM 5926 2HB LYS F 40 11.389 26.562 -22.400 1.00 0.00 H
+ATOM 5927 1HG LYS F 40 9.542 27.033 -20.887 1.00 0.00 H
+ATOM 5928 2HG LYS F 40 9.223 28.549 -21.728 1.00 0.00 H
+ATOM 5929 1HD LYS F 40 8.736 27.329 -23.815 1.00 0.00 H
+ATOM 5930 2HD LYS F 40 9.082 25.789 -23.011 1.00 0.00 H
+ATOM 5931 1HE LYS F 40 6.705 26.038 -23.028 1.00 0.00 H
+ATOM 5932 2HE LYS F 40 7.238 26.365 -21.368 1.00 0.00 H
+ATOM 5933 1HZ LYS F 40 5.651 27.997 -22.122 1.00 0.00 H
+ATOM 5934 2HZ LYS F 40 7.109 28.720 -21.857 1.00 0.00 H
+ATOM 5935 3HZ LYS F 40 6.607 28.428 -23.389 1.00 0.00 H
+ATOM 5936 N GLY F 41 11.538 28.416 -19.057 1.00 44.45 N
+ATOM 5937 CA GLY F 41 11.526 27.937 -17.685 1.00 45.77 C
+ATOM 5938 C GLY F 41 12.684 28.436 -16.815 1.00 45.28 C
+ATOM 5939 O GLY F 41 12.625 28.330 -15.587 1.00 44.22 O
+ATOM 5940 H GLY F 41 11.120 29.326 -19.246 1.00 0.00 H
+ATOM 5941 1HA GLY F 41 10.581 28.227 -17.224 1.00 0.00 H
+ATOM 5942 2HA GLY F 41 11.549 26.849 -17.708 1.00 0.00 H
+ATOM 5943 N GLU F 42 13.736 28.996 -17.408 1.00 43.93 N
+ATOM 5944 CA GLU F 42 14.835 29.461 -16.559 1.00 42.40 C
+ATOM 5945 C GLU F 42 14.468 30.765 -15.861 1.00 42.47 C
+ATOM 5946 O GLU F 42 13.857 31.658 -16.455 1.00 41.54 O
+ATOM 5947 CB GLU F 42 16.152 29.614 -17.346 1.00 41.23 C
+ATOM 5948 CG GLU F 42 16.787 28.269 -17.792 1.00 47.47 C
+ATOM 5949 CD GLU F 42 18.162 28.404 -18.435 1.00 46.98 C
+ATOM 5950 OE1 GLU F 42 18.291 29.096 -19.416 1.00 38.26 O
+ATOM 5951 OE2 GLU F 42 19.091 27.798 -17.938 1.00 51.01 O
+ATOM 5952 H GLU F 42 13.783 29.078 -18.423 1.00 0.00 H
+ATOM 5953 HA GLU F 42 15.009 28.709 -15.785 1.00 0.00 H
+ATOM 5954 1HB GLU F 42 15.969 30.206 -18.246 1.00 0.00 H
+ATOM 5955 2HB GLU F 42 16.884 30.152 -16.742 1.00 0.00 H
+ATOM 5956 1HG GLU F 42 16.885 27.629 -16.912 1.00 0.00 H
+ATOM 5957 2HG GLU F 42 16.111 27.776 -18.492 1.00 0.00 H
+ATOM 5958 N VAL F 43 14.851 30.868 -14.583 1.00 39.47 N
+ATOM 5959 CA VAL F 43 14.564 32.078 -13.810 1.00 39.31 C
+ATOM 5960 C VAL F 43 15.832 32.808 -13.423 1.00 41.06 C
+ATOM 5961 O VAL F 43 16.746 32.222 -12.849 1.00 39.97 O
+ATOM 5962 CB VAL F 43 13.762 31.756 -12.519 1.00 38.51 C
+ATOM 5963 CG1 VAL F 43 13.544 33.037 -11.706 1.00 33.82 C
+ATOM 5964 CG2 VAL F 43 12.411 31.171 -12.883 1.00 30.32 C
+ATOM 5965 H VAL F 43 15.353 30.091 -14.149 1.00 0.00 H
+ATOM 5966 HA VAL F 43 13.963 32.744 -14.421 1.00 0.00 H
+ATOM 5967 HB VAL F 43 14.325 31.050 -11.910 1.00 0.00 H
+ATOM 5968 1HG1 VAL F 43 12.983 32.812 -10.800 1.00 0.00 H
+ATOM 5969 2HG1 VAL F 43 14.505 33.472 -11.432 1.00 0.00 H
+ATOM 5970 3HG1 VAL F 43 12.983 33.750 -12.314 1.00 0.00 H
+ATOM 5971 1HG2 VAL F 43 11.843 30.945 -11.978 1.00 0.00 H
+ATOM 5972 2HG2 VAL F 43 11.877 31.887 -13.468 1.00 0.00 H
+ATOM 5973 3HG2 VAL F 43 12.553 30.263 -13.463 1.00 0.00 H
+ATOM 5974 N LEU F 44 15.883 34.090 -13.754 1.00 38.07 N
+ATOM 5975 CA LEU F 44 17.028 34.925 -13.433 1.00 39.91 C
+ATOM 5976 C LEU F 44 16.668 36.008 -12.438 1.00 38.48 C
+ATOM 5977 O LEU F 44 15.749 36.789 -12.663 1.00 40.44 O
+ATOM 5978 CB LEU F 44 17.559 35.584 -14.695 1.00 37.17 C
+ATOM 5979 CG LEU F 44 18.737 36.546 -14.511 1.00 41.27 C
+ATOM 5980 CD1 LEU F 44 19.961 35.766 -14.027 1.00 29.55 C
+ATOM 5981 CD2 LEU F 44 19.005 37.251 -15.831 1.00 28.52 C
+ATOM 5982 H LEU F 44 15.097 34.499 -14.252 1.00 0.00 H
+ATOM 5983 HA LEU F 44 17.805 34.303 -12.997 1.00 0.00 H
+ATOM 5984 1HB LEU F 44 17.875 34.802 -15.352 1.00 0.00 H
+ATOM 5985 2HB LEU F 44 16.744 36.132 -15.165 1.00 0.00 H
+ATOM 5986 HG LEU F 44 18.489 37.286 -13.749 1.00 0.00 H
+ATOM 5987 1HD1 LEU F 44 20.790 36.451 -13.889 1.00 0.00 H
+ATOM 5988 2HD1 LEU F 44 19.733 35.278 -13.078 1.00 0.00 H
+ATOM 5989 3HD1 LEU F 44 20.231 35.014 -14.766 1.00 0.00 H
+ATOM 5990 1HD2 LEU F 44 19.836 37.947 -15.715 1.00 0.00 H
+ATOM 5991 2HD2 LEU F 44 19.249 36.523 -16.595 1.00 0.00 H
+ATOM 5992 3HD2 LEU F 44 18.116 37.796 -16.129 1.00 0.00 H
+ATOM 5993 N ILE F 45 17.382 36.043 -11.329 1.00 36.57 N
+ATOM 5994 CA ILE F 45 17.137 37.057 -10.325 1.00 34.97 C
+ATOM 5995 C ILE F 45 18.370 37.953 -10.330 1.00 35.10 C
+ATOM 5996 O ILE F 45 19.479 37.473 -10.108 1.00 37.12 O
+ATOM 5997 CB ILE F 45 16.924 36.409 -8.954 1.00 42.90 C
+ATOM 5998 CG1 ILE F 45 15.766 35.379 -9.065 1.00 33.26 C
+ATOM 5999 CG2 ILE F 45 16.564 37.506 -7.983 1.00 34.01 C
+ATOM 6000 CD1 ILE F 45 15.554 34.520 -7.863 1.00 40.62 C
+ATOM 6001 H ILE F 45 18.110 35.355 -11.178 1.00 0.00 H
+ATOM 6002 HA ILE F 45 16.267 37.646 -10.589 1.00 0.00 H
+ATOM 6003 HB ILE F 45 17.822 35.889 -8.631 1.00 0.00 H
+ATOM 6004 1HG1 ILE F 45 14.862 35.895 -9.276 1.00 0.00 H
+ATOM 6005 2HG1 ILE F 45 15.985 34.717 -9.898 1.00 0.00 H
+ATOM 6006 1HG2 ILE F 45 16.384 37.098 -6.999 1.00 0.00 H
+ATOM 6007 2HG2 ILE F 45 17.373 38.231 -7.937 1.00 0.00 H
+ATOM 6008 3HG2 ILE F 45 15.678 37.999 -8.333 1.00 0.00 H
+ATOM 6009 1HD1 ILE F 45 14.738 33.835 -8.067 1.00 0.00 H
+ATOM 6010 2HD1 ILE F 45 16.463 33.952 -7.644 1.00 0.00 H
+ATOM 6011 3HD1 ILE F 45 15.300 35.145 -7.018 1.00 0.00 H
+ATOM 6012 N ALA F 46 18.209 39.243 -10.628 1.00 33.06 N
+ATOM 6013 CA ALA F 46 19.420 40.045 -10.814 1.00 33.25 C
+ATOM 6014 C ALA F 46 19.340 41.453 -10.258 1.00 37.47 C
+ATOM 6015 O ALA F 46 18.333 42.151 -10.403 1.00 38.14 O
+ATOM 6016 CB ALA F 46 19.722 40.123 -12.305 1.00 22.68 C
+ATOM 6017 H ALA F 46 17.277 39.628 -10.760 1.00 0.00 H
+ATOM 6018 HA ALA F 46 20.240 39.548 -10.304 1.00 0.00 H
+ATOM 6019 1HB ALA F 46 20.648 40.682 -12.459 1.00 0.00 H
+ATOM 6020 2HB ALA F 46 19.834 39.118 -12.706 1.00 0.00 H
+ATOM 6021 3HB ALA F 46 18.901 40.627 -12.813 1.00 0.00 H
+ATOM 6022 N GLN F 47 20.448 41.866 -9.640 1.00 37.58 N
+ATOM 6023 CA GLN F 47 20.592 43.187 -9.042 1.00 39.40 C
+ATOM 6024 C GLN F 47 21.091 44.249 -9.991 1.00 40.67 C
+ATOM 6025 O GLN F 47 21.805 43.968 -10.956 1.00 42.55 O
+ATOM 6026 CB GLN F 47 21.559 43.144 -7.855 1.00 34.99 C
+ATOM 6027 CG GLN F 47 21.085 42.356 -6.664 1.00 32.98 C
+ATOM 6028 CD GLN F 47 22.089 42.364 -5.562 1.00 36.63 C
+ATOM 6029 OE1 GLN F 47 23.245 41.960 -5.761 1.00 32.46 O
+ATOM 6030 NE2 GLN F 47 21.679 42.830 -4.384 1.00 32.16 N
+ATOM 6031 H GLN F 47 21.236 41.224 -9.555 1.00 0.00 H
+ATOM 6032 HA GLN F 47 19.627 43.505 -8.678 1.00 0.00 H
+ATOM 6033 1HB GLN F 47 22.512 42.728 -8.179 1.00 0.00 H
+ATOM 6034 2HB GLN F 47 21.751 44.167 -7.514 1.00 0.00 H
+ATOM 6035 1HG GLN F 47 20.196 42.836 -6.273 1.00 0.00 H
+ATOM 6036 2HG GLN F 47 20.877 41.325 -6.953 1.00 0.00 H
+ATOM 6037 1HE2 GLN F 47 22.308 42.862 -3.611 1.00 0.00 H
+ATOM 6038 2HE2 GLN F 47 20.733 43.205 -4.279 1.00 0.00 H
+ATOM 6039 N PHE F 48 20.773 45.490 -9.650 1.00 37.11 N
+ATOM 6040 CA PHE F 48 21.372 46.631 -10.325 1.00 35.94 C
+ATOM 6041 C PHE F 48 22.729 46.817 -9.660 1.00 36.28 C
+ATOM 6042 O PHE F 48 22.861 46.582 -8.458 1.00 33.96 O
+ATOM 6043 CB PHE F 48 20.494 47.862 -10.193 1.00 37.00 C
+ATOM 6044 CG PHE F 48 19.233 47.748 -10.981 1.00 46.55 C
+ATOM 6045 CD1 PHE F 48 19.237 47.961 -12.348 1.00 45.42 C
+ATOM 6046 CD2 PHE F 48 18.038 47.404 -10.358 1.00 42.67 C
+ATOM 6047 CE1 PHE F 48 18.079 47.830 -13.072 1.00 48.04 C
+ATOM 6048 CE2 PHE F 48 16.882 47.272 -11.087 1.00 45.74 C
+ATOM 6049 CZ PHE F 48 16.911 47.481 -12.445 1.00 42.16 C
+ATOM 6050 H PHE F 48 20.123 45.631 -8.877 1.00 0.00 H
+ATOM 6051 HA PHE F 48 21.519 46.406 -11.382 1.00 0.00 H
+ATOM 6052 1HB PHE F 48 20.241 48.033 -9.150 1.00 0.00 H
+ATOM 6053 2HB PHE F 48 21.046 48.723 -10.556 1.00 0.00 H
+ATOM 6054 HD1 PHE F 48 20.174 48.228 -12.846 1.00 0.00 H
+ATOM 6055 HD2 PHE F 48 18.030 47.231 -9.280 1.00 0.00 H
+ATOM 6056 HE1 PHE F 48 18.088 47.990 -14.136 1.00 0.00 H
+ATOM 6057 HE2 PHE F 48 15.949 46.996 -10.595 1.00 0.00 H
+ATOM 6058 HZ PHE F 48 16.023 47.361 -13.021 1.00 0.00 H
+ATOM 6059 N THR F 49 23.750 47.155 -10.443 1.00 39.52 N
+ATOM 6060 CA THR F 49 25.109 47.196 -9.902 1.00 37.75 C
+ATOM 6061 C THR F 49 25.891 48.441 -10.257 1.00 39.59 C
+ATOM 6062 O THR F 49 25.408 49.348 -10.928 1.00 44.02 O
+ATOM 6063 CB THR F 49 25.953 45.995 -10.379 1.00 37.49 C
+ATOM 6064 OG1 THR F 49 26.250 46.135 -11.784 1.00 35.66 O
+ATOM 6065 CG2 THR F 49 25.206 44.671 -10.152 1.00 28.68 C
+ATOM 6066 H THR F 49 23.576 47.400 -11.415 1.00 0.00 H
+ATOM 6067 HA THR F 49 25.042 47.155 -8.815 1.00 0.00 H
+ATOM 6068 HB THR F 49 26.885 45.967 -9.821 1.00 0.00 H
+ATOM 6069 HG1 THR F 49 25.505 45.781 -12.284 1.00 0.00 H
+ATOM 6070 1HG2 THR F 49 25.828 43.847 -10.492 1.00 0.00 H
+ATOM 6071 2HG2 THR F 49 24.981 44.545 -9.092 1.00 0.00 H
+ATOM 6072 3HG2 THR F 49 24.278 44.672 -10.716 1.00 0.00 H
+ATOM 6073 N GLU F 50 27.147 48.435 -9.835 1.00 38.96 N
+ATOM 6074 CA GLU F 50 28.122 49.456 -10.169 1.00 40.51 C
+ATOM 6075 C GLU F 50 28.283 49.603 -11.686 1.00 41.70 C
+ATOM 6076 O GLU F 50 28.675 50.668 -12.164 1.00 42.95 O
+ATOM 6077 CB GLU F 50 29.471 49.115 -9.529 1.00 38.92 C
+ATOM 6078 CG GLU F 50 30.563 50.147 -9.753 1.00 43.54 C
+ATOM 6079 CD GLU F 50 31.839 49.839 -8.997 1.00 52.50 C
+ATOM 6080 OE1 GLU F 50 31.877 48.848 -8.306 1.00 59.45 O
+ATOM 6081 OE2 GLU F 50 32.774 50.601 -9.112 1.00 57.33 O
+ATOM 6082 H GLU F 50 27.454 47.666 -9.263 1.00 0.00 H
+ATOM 6083 HA GLU F 50 27.774 50.411 -9.771 1.00 0.00 H
+ATOM 6084 1HB GLU F 50 29.340 48.991 -8.452 1.00 0.00 H
+ATOM 6085 2HB GLU F 50 29.826 48.164 -9.924 1.00 0.00 H
+ATOM 6086 1HG GLU F 50 30.789 50.181 -10.822 1.00 0.00 H
+ATOM 6087 2HG GLU F 50 30.193 51.124 -9.455 1.00 0.00 H
+ATOM 6088 N HIS F 51 28.047 48.517 -12.440 1.00 39.35 N
+ATOM 6089 CA HIS F 51 28.231 48.563 -13.882 1.00 41.65 C
+ATOM 6090 C HIS F 51 26.910 48.537 -14.659 1.00 43.23 C
+ATOM 6091 O HIS F 51 26.877 48.999 -15.798 1.00 42.73 O
+ATOM 6092 CB HIS F 51 29.132 47.404 -14.336 1.00 37.97 C
+ATOM 6093 CG HIS F 51 30.536 47.491 -13.783 1.00 43.93 C
+ATOM 6094 ND1 HIS F 51 30.873 47.045 -12.522 1.00 44.86 N
+ATOM 6095 CD2 HIS F 51 31.676 47.975 -14.326 1.00 44.06 C
+ATOM 6096 CE1 HIS F 51 32.162 47.260 -12.311 1.00 35.24 C
+ATOM 6097 NE2 HIS F 51 32.672 47.819 -13.392 1.00 45.59 N
+ATOM 6098 H HIS F 51 27.689 47.664 -12.022 1.00 0.00 H
+ATOM 6099 HA HIS F 51 28.739 49.490 -14.145 1.00 0.00 H
+ATOM 6100 1HB HIS F 51 28.692 46.454 -14.022 1.00 0.00 H
+ATOM 6101 2HB HIS F 51 29.193 47.393 -15.425 1.00 0.00 H
+ATOM 6102 HD2 HIS F 51 31.784 48.408 -15.320 1.00 0.00 H
+ATOM 6103 HE1 HIS F 51 32.710 47.015 -11.398 1.00 0.00 H
+ATOM 6104 HE2 HIS F 51 33.637 48.096 -13.516 1.00 0.00 H
+ATOM 6105 N THR F 52 25.819 48.045 -14.045 1.00 42.28 N
+ATOM 6106 CA THR F 52 24.512 47.985 -14.735 1.00 41.21 C
+ATOM 6107 C THR F 52 23.482 48.937 -14.112 1.00 41.29 C
+ATOM 6108 O THR F 52 23.113 48.783 -12.944 1.00 39.68 O
+ATOM 6109 CB THR F 52 23.891 46.564 -14.695 1.00 37.38 C
+ATOM 6110 OG1 THR F 52 24.761 45.615 -15.330 1.00 42.45 O
+ATOM 6111 CG2 THR F 52 22.525 46.558 -15.408 1.00 28.93 C
+ATOM 6112 H THR F 52 25.913 47.670 -13.107 1.00 0.00 H
+ATOM 6113 HA THR F 52 24.653 48.281 -15.776 1.00 0.00 H
+ATOM 6114 HB THR F 52 23.741 46.262 -13.656 1.00 0.00 H
+ATOM 6115 HG1 THR F 52 25.537 45.471 -14.784 1.00 0.00 H
+ATOM 6116 1HG2 THR F 52 22.092 45.558 -15.368 1.00 0.00 H
+ATOM 6117 2HG2 THR F 52 21.851 47.260 -14.918 1.00 0.00 H
+ATOM 6118 3HG2 THR F 52 22.658 46.853 -16.447 1.00 0.00 H
+ATOM 6119 N SER F 53 22.982 49.886 -14.912 1.00 38.82 N
+ATOM 6120 CA SER F 53 21.989 50.856 -14.424 1.00 37.09 C
+ATOM 6121 C SER F 53 20.600 50.562 -14.962 1.00 37.53 C
+ATOM 6122 O SER F 53 19.595 51.063 -14.446 1.00 36.46 O
+ATOM 6123 CB SER F 53 22.368 52.269 -14.791 1.00 39.56 C
+ATOM 6124 OG SER F 53 22.409 52.441 -16.175 1.00 49.50 O
+ATOM 6125 H SER F 53 23.307 49.926 -15.878 1.00 0.00 H
+ATOM 6126 HA SER F 53 21.944 50.789 -13.336 1.00 0.00 H
+ATOM 6127 1HB SER F 53 21.630 52.946 -14.363 1.00 0.00 H
+ATOM 6128 2HB SER F 53 23.318 52.517 -14.357 1.00 0.00 H
+ATOM 6129 HG SER F 53 21.684 51.921 -16.530 1.00 0.00 H
+ATOM 6130 N ALA F 54 20.535 49.742 -16.003 1.00 34.98 N
+ATOM 6131 CA ALA F 54 19.234 49.397 -16.549 1.00 37.24 C
+ATOM 6132 C ALA F 54 19.247 47.983 -17.093 1.00 36.65 C
+ATOM 6133 O ALA F 54 20.270 47.484 -17.570 1.00 35.23 O
+ATOM 6134 CB ALA F 54 18.805 50.389 -17.619 1.00 41.85 C
+ATOM 6135 H ALA F 54 21.393 49.381 -16.419 1.00 0.00 H
+ATOM 6136 HA ALA F 54 18.508 49.433 -15.745 1.00 0.00 H
+ATOM 6137 1HB ALA F 54 17.815 50.108 -17.978 1.00 0.00 H
+ATOM 6138 2HB ALA F 54 18.769 51.388 -17.191 1.00 0.00 H
+ATOM 6139 3HB ALA F 54 19.486 50.388 -18.431 1.00 0.00 H
+ATOM 6140 N ILE F 55 18.081 47.355 -17.030 1.00 37.60 N
+ATOM 6141 CA ILE F 55 17.877 46.016 -17.546 1.00 39.01 C
+ATOM 6142 C ILE F 55 16.804 46.001 -18.624 1.00 40.52 C
+ATOM 6143 O ILE F 55 15.686 46.471 -18.420 1.00 40.76 O
+ATOM 6144 CB ILE F 55 17.516 45.036 -16.408 1.00 34.26 C
+ATOM 6145 CG1 ILE F 55 18.689 44.960 -15.382 1.00 36.78 C
+ATOM 6146 CG2 ILE F 55 17.202 43.671 -16.989 1.00 22.30 C
+ATOM 6147 CD1 ILE F 55 18.358 44.212 -14.092 1.00 38.69 C
+ATOM 6148 H ILE F 55 17.290 47.847 -16.625 1.00 0.00 H
+ATOM 6149 HA ILE F 55 18.807 45.677 -17.993 1.00 0.00 H
+ATOM 6150 HB ILE F 55 16.644 45.410 -15.872 1.00 0.00 H
+ATOM 6151 1HG1 ILE F 55 19.535 44.465 -15.863 1.00 0.00 H
+ATOM 6152 2HG1 ILE F 55 18.990 45.964 -15.115 1.00 0.00 H
+ATOM 6153 1HG2 ILE F 55 16.942 42.979 -16.189 1.00 0.00 H
+ATOM 6154 2HG2 ILE F 55 16.366 43.749 -17.684 1.00 0.00 H
+ATOM 6155 3HG2 ILE F 55 18.082 43.307 -17.520 1.00 0.00 H
+ATOM 6156 1HD1 ILE F 55 19.235 44.209 -13.436 1.00 0.00 H
+ATOM 6157 2HD1 ILE F 55 17.530 44.707 -13.581 1.00 0.00 H
+ATOM 6158 3HD1 ILE F 55 18.077 43.186 -14.325 1.00 0.00 H
+ATOM 6159 N LYS F 56 17.151 45.473 -19.782 1.00 42.15 N
+ATOM 6160 CA LYS F 56 16.205 45.409 -20.883 1.00 41.15 C
+ATOM 6161 C LYS F 56 15.850 43.957 -21.158 1.00 40.69 C
+ATOM 6162 O LYS F 56 16.733 43.110 -21.240 1.00 40.17 O
+ATOM 6163 CB LYS F 56 16.794 46.104 -22.108 1.00 45.74 C
+ATOM 6164 CG LYS F 56 15.910 46.157 -23.318 1.00 54.20 C
+ATOM 6165 CD LYS F 56 16.603 46.933 -24.429 1.00 60.27 C
+ATOM 6166 CE LYS F 56 15.698 47.110 -25.630 1.00 60.97 C
+ATOM 6167 NZ LYS F 56 16.356 47.895 -26.719 1.00 54.86 N
+ATOM 6168 H LYS F 56 18.095 45.113 -19.897 1.00 0.00 H
+ATOM 6169 HA LYS F 56 15.292 45.925 -20.600 1.00 0.00 H
+ATOM 6170 1HB LYS F 56 17.039 47.132 -21.848 1.00 0.00 H
+ATOM 6171 2HB LYS F 56 17.709 45.625 -22.392 1.00 0.00 H
+ATOM 6172 1HG LYS F 56 15.699 45.140 -23.663 1.00 0.00 H
+ATOM 6173 2HG LYS F 56 14.962 46.640 -23.065 1.00 0.00 H
+ATOM 6174 1HD LYS F 56 16.901 47.922 -24.065 1.00 0.00 H
+ATOM 6175 2HD LYS F 56 17.498 46.393 -24.737 1.00 0.00 H
+ATOM 6176 1HE LYS F 56 15.413 46.135 -26.018 1.00 0.00 H
+ATOM 6177 2HE LYS F 56 14.811 47.626 -25.311 1.00 0.00 H
+ATOM 6178 1HZ LYS F 56 15.715 48.013 -27.501 1.00 0.00 H
+ATOM 6179 2HZ LYS F 56 16.641 48.820 -26.379 1.00 0.00 H
+ATOM 6180 3HZ LYS F 56 17.173 47.414 -27.030 1.00 0.00 H
+ATOM 6181 N VAL F 57 14.564 43.652 -21.248 1.00 39.19 N
+ATOM 6182 CA VAL F 57 14.173 42.271 -21.479 1.00 40.91 C
+ATOM 6183 C VAL F 57 13.507 42.108 -22.839 1.00 45.03 C
+ATOM 6184 O VAL F 57 12.520 42.782 -23.170 1.00 49.06 O
+ATOM 6185 CB VAL F 57 13.228 41.772 -20.373 1.00 42.08 C
+ATOM 6186 CG1 VAL F 57 12.852 40.301 -20.655 1.00 39.52 C
+ATOM 6187 CG2 VAL F 57 13.902 41.935 -19.006 1.00 31.84 C
+ATOM 6188 H VAL F 57 13.863 44.378 -21.155 1.00 0.00 H
+ATOM 6189 HA VAL F 57 15.065 41.646 -21.464 1.00 0.00 H
+ATOM 6190 HB VAL F 57 12.309 42.356 -20.394 1.00 0.00 H
+ATOM 6191 1HG1 VAL F 57 12.175 39.934 -19.891 1.00 0.00 H
+ATOM 6192 2HG1 VAL F 57 12.364 40.224 -21.629 1.00 0.00 H
+ATOM 6193 3HG1 VAL F 57 13.756 39.691 -20.657 1.00 0.00 H
+ATOM 6194 1HG2 VAL F 57 13.227 41.592 -18.230 1.00 0.00 H
+ATOM 6195 2HG2 VAL F 57 14.814 41.351 -18.985 1.00 0.00 H
+ATOM 6196 3HG2 VAL F 57 14.138 42.987 -18.839 1.00 0.00 H
+ATOM 6197 N ARG F 58 14.080 41.203 -23.627 1.00 44.12 N
+ATOM 6198 CA ARG F 58 13.630 40.895 -24.976 1.00 43.27 C
+ATOM 6199 C ARG F 58 13.158 39.445 -25.085 1.00 43.21 C
+ATOM 6200 O ARG F 58 13.873 38.508 -24.722 1.00 42.23 O
+ATOM 6201 CB ARG F 58 14.767 41.140 -25.953 1.00 45.50 C
+ATOM 6202 CG ARG F 58 14.486 40.762 -27.392 1.00 45.00 C
+ATOM 6203 CD ARG F 58 15.677 40.992 -28.254 1.00 45.00 C
+ATOM 6204 NE ARG F 58 15.925 42.382 -28.450 1.00 45.00 N
+ATOM 6205 CZ ARG F 58 17.050 42.907 -28.934 1.00 45.00 C
+ATOM 6206 NH1 ARG F 58 18.084 42.138 -29.269 1.00 45.00 N
+ATOM 6207 NH2 ARG F 58 17.066 44.213 -29.058 1.00 45.00 N
+ATOM 6208 H ARG F 58 14.897 40.708 -23.274 1.00 0.00 H
+ATOM 6209 HA ARG F 58 12.797 41.552 -25.225 1.00 0.00 H
+ATOM 6210 1HB ARG F 58 15.016 42.208 -25.943 1.00 0.00 H
+ATOM 6211 2HB ARG F 58 15.650 40.597 -25.626 1.00 0.00 H
+ATOM 6212 1HG ARG F 58 14.217 39.710 -27.450 1.00 0.00 H
+ATOM 6213 2HG ARG F 58 13.662 41.379 -27.768 1.00 0.00 H
+ATOM 6214 1HD ARG F 58 16.553 40.557 -27.777 1.00 0.00 H
+ATOM 6215 2HD ARG F 58 15.527 40.531 -29.229 1.00 0.00 H
+ATOM 6216 HE ARG F 58 15.177 43.046 -28.214 1.00 0.00 H
+ATOM 6217 1HH1 ARG F 58 18.023 41.131 -29.159 1.00 0.00 H
+ATOM 6218 2HH1 ARG F 58 18.930 42.548 -29.635 1.00 0.00 H
+ATOM 6219 1HH2 ARG F 58 16.220 44.720 -28.790 1.00 0.00 H
+ATOM 6220 2HH2 ARG F 58 17.858 44.692 -29.413 1.00 0.00 H
+ATOM 6221 N GLY F 59 11.956 39.254 -25.612 1.00 43.49 N
+ATOM 6222 CA GLY F 59 11.373 37.919 -25.713 1.00 41.33 C
+ATOM 6223 C GLY F 59 10.285 37.800 -24.664 1.00 42.08 C
+ATOM 6224 O GLY F 59 10.180 38.660 -23.793 1.00 36.65 O
+ATOM 6225 H GLY F 59 11.404 40.050 -25.913 1.00 0.00 H
+ATOM 6226 1HA GLY F 59 10.953 37.763 -26.707 1.00 0.00 H
+ATOM 6227 2HA GLY F 59 12.135 37.158 -25.551 1.00 0.00 H
+ATOM 6228 N LYS F 60 9.469 36.761 -24.758 1.00 44.93 N
+ATOM 6229 CA LYS F 60 8.346 36.616 -23.842 1.00 47.81 C
+ATOM 6230 C LYS F 60 8.815 36.073 -22.502 1.00 46.31 C
+ATOM 6231 O LYS F 60 9.464 35.023 -22.438 1.00 42.85 O
+ATOM 6232 CB LYS F 60 7.273 35.740 -24.498 1.00 55.52 C
+ATOM 6233 CG LYS F 60 5.926 35.638 -23.788 1.00 65.79 C
+ATOM 6234 CD LYS F 60 4.937 34.912 -24.715 1.00 71.29 C
+ATOM 6235 CE LYS F 60 3.504 34.926 -24.201 1.00 68.65 C
+ATOM 6236 NZ LYS F 60 3.303 34.005 -23.074 1.00 64.87 N
+ATOM 6237 H LYS F 60 9.611 36.077 -25.498 1.00 0.00 H
+ATOM 6238 HA LYS F 60 7.927 37.594 -23.665 1.00 0.00 H
+ATOM 6239 1HB LYS F 60 7.086 36.106 -25.510 1.00 0.00 H
+ATOM 6240 2HB LYS F 60 7.647 34.727 -24.592 1.00 0.00 H
+ATOM 6241 1HG LYS F 60 6.034 35.086 -22.863 1.00 0.00 H
+ATOM 6242 2HG LYS F 60 5.548 36.636 -23.555 1.00 0.00 H
+ATOM 6243 1HD LYS F 60 4.961 35.384 -25.698 1.00 0.00 H
+ATOM 6244 2HD LYS F 60 5.258 33.872 -24.826 1.00 0.00 H
+ATOM 6245 1HE LYS F 60 3.259 35.938 -23.874 1.00 0.00 H
+ATOM 6246 2HE LYS F 60 2.837 34.645 -25.015 1.00 0.00 H
+ATOM 6247 1HZ LYS F 60 2.340 34.053 -22.771 1.00 0.00 H
+ATOM 6248 2HZ LYS F 60 3.518 33.062 -23.367 1.00 0.00 H
+ATOM 6249 3HZ LYS F 60 3.909 34.272 -22.315 1.00 0.00 H
+ATOM 6250 N ALA F 61 8.504 36.813 -21.442 1.00 46.54 N
+ATOM 6251 CA ALA F 61 8.965 36.451 -20.105 1.00 48.19 C
+ATOM 6252 C ALA F 61 8.099 37.069 -19.009 1.00 47.38 C
+ATOM 6253 O ALA F 61 7.517 38.139 -19.169 1.00 46.24 O
+ATOM 6254 CB ALA F 61 10.408 36.889 -19.919 1.00 40.31 C
+ATOM 6255 H ALA F 61 7.932 37.642 -21.587 1.00 0.00 H
+ATOM 6256 HA ALA F 61 8.912 35.374 -20.017 1.00 0.00 H
+ATOM 6257 1HB ALA F 61 10.756 36.587 -18.938 1.00 0.00 H
+ATOM 6258 2HB ALA F 61 11.011 36.418 -20.679 1.00 0.00 H
+ATOM 6259 3HB ALA F 61 10.484 37.969 -20.010 1.00 0.00 H
+ATOM 6260 N TYR F 62 8.054 36.394 -17.869 1.00 47.92 N
+ATOM 6261 CA TYR F 62 7.344 36.898 -16.697 1.00 46.84 C
+ATOM 6262 C TYR F 62 8.311 37.653 -15.805 1.00 45.28 C
+ATOM 6263 O TYR F 62 9.328 37.107 -15.384 1.00 43.46 O
+ATOM 6264 CB TYR F 62 6.651 35.747 -15.969 1.00 49.47 C
+ATOM 6265 CG TYR F 62 5.996 36.099 -14.649 1.00 51.98 C
+ATOM 6266 CD1 TYR F 62 5.198 37.234 -14.501 1.00 54.77 C
+ATOM 6267 CD2 TYR F 62 6.187 35.252 -13.577 1.00 55.38 C
+ATOM 6268 CE1 TYR F 62 4.605 37.498 -13.278 1.00 54.94 C
+ATOM 6269 CE2 TYR F 62 5.597 35.518 -12.368 1.00 58.89 C
+ATOM 6270 CZ TYR F 62 4.813 36.631 -12.213 1.00 56.20 C
+ATOM 6271 OH TYR F 62 4.230 36.869 -10.996 1.00 56.87 O
+ATOM 6272 H TYR F 62 8.569 35.520 -17.813 1.00 0.00 H
+ATOM 6273 HA TYR F 62 6.584 37.603 -17.023 1.00 0.00 H
+ATOM 6274 1HB TYR F 62 5.873 35.344 -16.622 1.00 0.00 H
+ATOM 6275 2HB TYR F 62 7.354 34.951 -15.796 1.00 0.00 H
+ATOM 6276 HD1 TYR F 62 5.034 37.909 -15.341 1.00 0.00 H
+ATOM 6277 HD2 TYR F 62 6.804 34.364 -13.696 1.00 0.00 H
+ATOM 6278 HE1 TYR F 62 3.979 38.371 -13.158 1.00 0.00 H
+ATOM 6279 HE2 TYR F 62 5.751 34.842 -11.526 1.00 0.00 H
+ATOM 6280 HH TYR F 62 4.167 36.040 -10.509 1.00 0.00 H
+ATOM 6281 N ILE F 63 8.023 38.931 -15.565 1.00 43.73 N
+ATOM 6282 CA ILE F 63 8.937 39.767 -14.811 1.00 42.42 C
+ATOM 6283 C ILE F 63 8.336 40.266 -13.491 1.00 41.80 C
+ATOM 6284 O ILE F 63 7.201 40.747 -13.438 1.00 38.64 O
+ATOM 6285 CB ILE F 63 9.340 40.983 -15.663 1.00 30.73 C
+ATOM 6286 CG1 ILE F 63 9.999 40.525 -16.956 1.00 37.38 C
+ATOM 6287 CG2 ILE F 63 10.303 41.872 -14.886 1.00 24.99 C
+ATOM 6288 CD1 ILE F 63 10.138 41.634 -17.956 1.00 33.93 C
+ATOM 6289 H ILE F 63 7.178 39.353 -15.931 1.00 0.00 H
+ATOM 6290 HA ILE F 63 9.815 39.189 -14.600 1.00 0.00 H
+ATOM 6291 HB ILE F 63 8.468 41.538 -15.923 1.00 0.00 H
+ATOM 6292 1HG1 ILE F 63 10.981 40.124 -16.733 1.00 0.00 H
+ATOM 6293 2HG1 ILE F 63 9.396 39.740 -17.409 1.00 0.00 H
+ATOM 6294 1HG2 ILE F 63 10.567 42.718 -15.500 1.00 0.00 H
+ATOM 6295 2HG2 ILE F 63 9.826 42.219 -13.976 1.00 0.00 H
+ATOM 6296 3HG2 ILE F 63 11.200 41.306 -14.632 1.00 0.00 H
+ATOM 6297 1HD1 ILE F 63 10.601 41.252 -18.853 1.00 0.00 H
+ATOM 6298 2HD1 ILE F 63 9.149 42.027 -18.200 1.00 0.00 H
+ATOM 6299 3HD1 ILE F 63 10.753 42.429 -17.541 1.00 0.00 H
+ATOM 6300 N GLN F 64 9.098 40.133 -12.407 1.00 40.47 N
+ATOM 6301 CA GLN F 64 8.631 40.651 -11.124 1.00 40.71 C
+ATOM 6302 C GLN F 64 9.593 41.749 -10.687 1.00 40.44 C
+ATOM 6303 O GLN F 64 10.811 41.571 -10.744 1.00 41.30 O
+ATOM 6304 CB GLN F 64 8.599 39.553 -10.046 1.00 38.86 C
+ATOM 6305 CG GLN F 64 7.752 38.316 -10.387 1.00 37.64 C
+ATOM 6306 CD GLN F 64 7.762 37.247 -9.272 1.00 39.68 C
+ATOM 6307 OE1 GLN F 64 8.779 37.047 -8.597 1.00 39.30 O
+ATOM 6308 NE2 GLN F 64 6.621 36.572 -9.097 1.00 36.74 N
+ATOM 6309 H GLN F 64 10.011 39.700 -12.500 1.00 0.00 H
+ATOM 6310 HA GLN F 64 7.643 41.088 -11.240 1.00 0.00 H
+ATOM 6311 1HB GLN F 64 9.588 39.260 -9.775 1.00 0.00 H
+ATOM 6312 2HB GLN F 64 8.150 39.980 -9.151 1.00 0.00 H
+ATOM 6313 1HG GLN F 64 6.727 38.606 -10.570 1.00 0.00 H
+ATOM 6314 2HG GLN F 64 8.168 37.854 -11.286 1.00 0.00 H
+ATOM 6315 1HE2 GLN F 64 6.537 35.832 -8.399 1.00 0.00 H
+ATOM 6316 2HE2 GLN F 64 5.826 36.780 -9.675 1.00 0.00 H
+ATOM 6317 N THR F 65 9.053 42.887 -10.256 1.00 39.50 N
+ATOM 6318 CA THR F 65 9.902 43.970 -9.783 1.00 40.24 C
+ATOM 6319 C THR F 65 9.332 44.507 -8.487 1.00 42.33 C
+ATOM 6320 O THR F 65 8.238 44.131 -8.058 1.00 42.64 O
+ATOM 6321 CB THR F 65 10.010 45.166 -10.762 1.00 40.05 C
+ATOM 6322 OG1 THR F 65 8.795 45.926 -10.735 1.00 38.71 O
+ATOM 6323 CG2 THR F 65 10.253 44.684 -12.194 1.00 44.02 C
+ATOM 6324 H THR F 65 8.043 43.004 -10.241 1.00 0.00 H
+ATOM 6325 HA THR F 65 10.902 43.589 -9.582 1.00 0.00 H
+ATOM 6326 HB THR F 65 10.838 45.795 -10.457 1.00 0.00 H
+ATOM 6327 HG1 THR F 65 8.456 45.946 -9.835 1.00 0.00 H
+ATOM 6328 1HG2 THR F 65 10.334 45.542 -12.856 1.00 0.00 H
+ATOM 6329 2HG2 THR F 65 11.171 44.106 -12.239 1.00 0.00 H
+ATOM 6330 3HG2 THR F 65 9.420 44.064 -12.511 1.00 0.00 H
+ATOM 6331 N ARG F 66 10.026 45.451 -7.897 1.00 42.28 N
+ATOM 6332 CA ARG F 66 9.576 46.089 -6.674 1.00 44.02 C
+ATOM 6333 C ARG F 66 8.241 46.828 -6.843 1.00 46.87 C
+ATOM 6334 O ARG F 66 7.583 47.147 -5.856 1.00 44.44 O
+ATOM 6335 CB ARG F 66 10.643 47.002 -6.099 1.00 51.68 C
+ATOM 6336 CG ARG F 66 10.351 47.444 -4.676 1.00 60.76 C
+ATOM 6337 CD ARG F 66 11.556 48.002 -3.971 1.00 73.60 C
+ATOM 6338 NE ARG F 66 11.993 49.296 -4.455 1.00 83.93 N
+ATOM 6339 CZ ARG F 66 11.455 50.472 -4.065 1.00 90.09 C
+ATOM 6340 NH1 ARG F 66 11.944 51.605 -4.506 1.00 83.98 N
+ATOM 6341 NH2 ARG F 66 10.439 50.482 -3.215 1.00 92.57 N
+ATOM 6342 H ARG F 66 10.919 45.720 -8.293 1.00 0.00 H
+ATOM 6343 HA ARG F 66 9.406 45.299 -5.938 1.00 0.00 H
+ATOM 6344 1HB ARG F 66 11.612 46.504 -6.113 1.00 0.00 H
+ATOM 6345 2HB ARG F 66 10.722 47.901 -6.714 1.00 0.00 H
+ATOM 6346 1HG ARG F 66 9.572 48.208 -4.692 1.00 0.00 H
+ATOM 6347 2HG ARG F 66 9.998 46.580 -4.107 1.00 0.00 H
+ATOM 6348 1HD ARG F 66 11.335 48.099 -2.909 1.00 0.00 H
+ATOM 6349 2HD ARG F 66 12.391 47.305 -4.097 1.00 0.00 H
+ATOM 6350 HE ARG F 66 12.787 49.322 -5.088 1.00 0.00 H
+ATOM 6351 1HH1 ARG F 66 12.732 51.607 -5.139 1.00 0.00 H
+ATOM 6352 2HH1 ARG F 66 11.551 52.484 -4.187 1.00 0.00 H
+ATOM 6353 1HH2 ARG F 66 10.060 49.611 -2.872 1.00 0.00 H
+ATOM 6354 2HH2 ARG F 66 10.044 51.357 -2.910 1.00 0.00 H
+ATOM 6355 N HIS F 67 7.860 47.161 -8.089 1.00 47.18 N
+ATOM 6356 CA HIS F 67 6.640 47.930 -8.292 1.00 45.39 C
+ATOM 6357 C HIS F 67 5.453 47.050 -8.706 1.00 46.54 C
+ATOM 6358 O HIS F 67 4.406 47.566 -9.104 1.00 47.55 O
+ATOM 6359 CB HIS F 67 6.845 48.980 -9.390 1.00 40.52 C
+ATOM 6360 CG HIS F 67 7.946 49.942 -9.109 1.00 45.54 C
+ATOM 6361 ND1 HIS F 67 8.161 50.498 -7.865 1.00 48.04 N
+ATOM 6362 CD2 HIS F 67 8.877 50.475 -9.926 1.00 48.44 C
+ATOM 6363 CE1 HIS F 67 9.198 51.318 -7.935 1.00 35.50 C
+ATOM 6364 NE2 HIS F 67 9.637 51.324 -9.172 1.00 53.17 N
+ATOM 6365 H HIS F 67 8.389 46.854 -8.902 1.00 0.00 H
+ATOM 6366 HA HIS F 67 6.371 48.443 -7.370 1.00 0.00 H
+ATOM 6367 1HB HIS F 67 7.063 48.475 -10.335 1.00 0.00 H
+ATOM 6368 2HB HIS F 67 5.925 49.550 -9.528 1.00 0.00 H
+ATOM 6369 HD2 HIS F 67 9.000 50.278 -10.990 1.00 0.00 H
+ATOM 6370 HE1 HIS F 67 9.611 51.903 -7.114 1.00 0.00 H
+ATOM 6371 HE2 HIS F 67 10.413 51.872 -9.537 1.00 0.00 H
+ATOM 6372 N GLY F 68 5.611 45.726 -8.631 1.00 45.83 N
+ATOM 6373 CA GLY F 68 4.539 44.825 -9.057 1.00 48.29 C
+ATOM 6374 C GLY F 68 5.057 43.874 -10.123 1.00 50.24 C
+ATOM 6375 O GLY F 68 6.244 43.550 -10.149 1.00 48.89 O
+ATOM 6376 H GLY F 68 6.481 45.327 -8.289 1.00 0.00 H
+ATOM 6377 1HA GLY F 68 4.179 44.257 -8.197 1.00 0.00 H
+ATOM 6378 2HA GLY F 68 3.698 45.395 -9.444 1.00 0.00 H
+ATOM 6379 N VAL F 69 4.173 43.382 -10.982 1.00 50.76 N
+ATOM 6380 CA VAL F 69 4.629 42.440 -11.995 1.00 52.66 C
+ATOM 6381 C VAL F 69 4.250 42.912 -13.384 1.00 54.67 C
+ATOM 6382 O VAL F 69 3.353 43.747 -13.542 1.00 54.76 O
+ATOM 6383 CB VAL F 69 4.048 41.043 -11.754 1.00 59.25 C
+ATOM 6384 CG1 VAL F 69 4.468 40.528 -10.382 1.00 39.74 C
+ATOM 6385 CG2 VAL F 69 2.541 41.081 -11.887 1.00 56.20 C
+ATOM 6386 H VAL F 69 3.201 43.660 -10.937 1.00 0.00 H
+ATOM 6387 HA VAL F 69 5.717 42.372 -11.951 1.00 0.00 H
+ATOM 6388 HB VAL F 69 4.465 40.373 -12.494 1.00 0.00 H
+ATOM 6389 1HG1 VAL F 69 4.078 39.520 -10.234 1.00 0.00 H
+ATOM 6390 2HG1 VAL F 69 5.546 40.511 -10.316 1.00 0.00 H
+ATOM 6391 3HG1 VAL F 69 4.075 41.180 -9.607 1.00 0.00 H
+ATOM 6392 1HG2 VAL F 69 2.141 40.078 -11.739 1.00 0.00 H
+ATOM 6393 2HG2 VAL F 69 2.123 41.755 -11.141 1.00 0.00 H
+ATOM 6394 3HG2 VAL F 69 2.276 41.433 -12.887 1.00 0.00 H
+ATOM 6395 N ILE F 70 4.951 42.385 -14.382 1.00 56.98 N
+ATOM 6396 CA ILE F 70 4.687 42.718 -15.773 1.00 55.30 C
+ATOM 6397 C ILE F 70 5.180 41.579 -16.664 1.00 56.78 C
+ATOM 6398 O ILE F 70 6.105 40.865 -16.293 1.00 55.68 O
+ATOM 6399 CB ILE F 70 5.385 44.054 -16.125 1.00 53.90 C
+ATOM 6400 CG1 ILE F 70 4.875 44.612 -17.435 1.00 64.42 C
+ATOM 6401 CG2 ILE F 70 6.898 43.844 -16.214 1.00 42.40 C
+ATOM 6402 CD1 ILE F 70 5.237 46.066 -17.614 1.00 63.04 C
+ATOM 6403 H ILE F 70 5.692 41.725 -14.160 1.00 0.00 H
+ATOM 6404 HA ILE F 70 3.613 42.830 -15.911 1.00 0.00 H
+ATOM 6405 HB ILE F 70 5.171 44.785 -15.354 1.00 0.00 H
+ATOM 6406 1HG1 ILE F 70 5.298 44.050 -18.266 1.00 0.00 H
+ATOM 6407 2HG1 ILE F 70 3.790 44.520 -17.464 1.00 0.00 H
+ATOM 6408 1HG2 ILE F 70 7.387 44.781 -16.449 1.00 0.00 H
+ATOM 6409 2HG2 ILE F 70 7.267 43.471 -15.257 1.00 0.00 H
+ATOM 6410 3HG2 ILE F 70 7.108 43.120 -17.000 1.00 0.00 H
+ATOM 6411 1HD1 ILE F 70 4.832 46.417 -18.549 1.00 0.00 H
+ATOM 6412 2HD1 ILE F 70 4.808 46.648 -16.797 1.00 0.00 H
+ATOM 6413 3HD1 ILE F 70 6.317 46.182 -17.609 1.00 0.00 H
+ATOM 6414 N GLU F 71 4.567 41.386 -17.825 1.00 57.47 N
+ATOM 6415 CA GLU F 71 5.102 40.384 -18.743 1.00 56.39 C
+ATOM 6416 C GLU F 71 5.645 41.052 -20.000 1.00 57.69 C
+ATOM 6417 O GLU F 71 5.036 41.999 -20.519 1.00 57.45 O
+ATOM 6418 CB GLU F 71 4.038 39.344 -19.136 1.00 50.41 C
+ATOM 6419 CG GLU F 71 3.529 38.460 -17.992 1.00 63.38 C
+ATOM 6420 CD GLU F 71 2.533 37.408 -18.443 1.00 69.41 C
+ATOM 6421 OE1 GLU F 71 2.175 37.404 -19.597 1.00 72.35 O
+ATOM 6422 OE2 GLU F 71 2.143 36.604 -17.629 1.00 77.08 O
+ATOM 6423 H GLU F 71 3.773 41.955 -18.084 1.00 0.00 H
+ATOM 6424 HA GLU F 71 5.928 39.860 -18.259 1.00 0.00 H
+ATOM 6425 1HB GLU F 71 3.183 39.848 -19.584 1.00 0.00 H
+ATOM 6426 2HB GLU F 71 4.459 38.682 -19.895 1.00 0.00 H
+ATOM 6427 1HG GLU F 71 4.374 37.961 -17.545 1.00 0.00 H
+ATOM 6428 2HG GLU F 71 3.065 39.089 -17.233 1.00 0.00 H
+ATOM 6429 N SER F 72 6.775 40.546 -20.492 1.00 56.47 N
+ATOM 6430 CA SER F 72 7.380 41.017 -21.738 1.00 54.99 C
+ATOM 6431 C SER F 72 6.903 40.112 -22.852 1.00 55.01 C
+ATOM 6432 O SER F 72 6.414 39.016 -22.570 1.00 51.39 O
+ATOM 6433 CB SER F 72 8.895 41.019 -21.635 1.00 34.06 C
+ATOM 6434 OG SER F 72 9.398 39.725 -21.507 1.00 31.33 O
+ATOM 6435 H SER F 72 7.207 39.770 -19.999 1.00 0.00 H
+ATOM 6436 HA SER F 72 7.039 42.029 -21.948 1.00 0.00 H
+ATOM 6437 1HB SER F 72 9.323 41.500 -22.520 1.00 0.00 H
+ATOM 6438 2HB SER F 72 9.184 41.604 -20.775 1.00 0.00 H
+ATOM 6439 HG SER F 72 9.513 39.384 -22.413 1.00 0.00 H
+ATOM 6440 N GLU F 73 7.064 40.547 -24.104 1.00 58.38 N
+ATOM 6441 CA GLU F 73 6.618 39.754 -25.251 1.00 60.64 C
+ATOM 6442 C GLU F 73 7.697 39.618 -26.336 1.00 61.16 C
+ATOM 6443 O GLU F 73 8.691 40.345 -26.344 1.00 57.90 O
+ATOM 6444 CB GLU F 73 5.334 40.356 -25.830 1.00 58.58 C
+ATOM 6445 CG GLU F 73 4.191 40.451 -24.819 1.00 66.14 C
+ATOM 6446 CD GLU F 73 2.940 41.057 -25.376 1.00 65.17 C
+ATOM 6447 OE1 GLU F 73 2.577 40.731 -26.478 1.00 70.03 O
+ATOM 6448 OE2 GLU F 73 2.347 41.873 -24.689 1.00 58.56 O
+ATOM 6449 H GLU F 73 7.487 41.461 -24.255 1.00 0.00 H
+ATOM 6450 HA GLU F 73 6.372 38.755 -24.902 1.00 0.00 H
+ATOM 6451 1HB GLU F 73 5.521 41.332 -26.208 1.00 0.00 H
+ATOM 6452 2HB GLU F 73 4.989 39.748 -26.668 1.00 0.00 H
+ATOM 6453 1HG GLU F 73 3.968 39.453 -24.436 1.00 0.00 H
+ATOM 6454 2HG GLU F 73 4.517 41.064 -23.984 1.00 0.00 H
+ATOM 6455 N GLY F 74 7.501 38.642 -27.220 1.00 64.24 N
+ATOM 6456 CA GLY F 74 8.424 38.388 -28.319 1.00 66.54 C
+ATOM 6457 C GLY F 74 7.725 38.577 -29.665 1.00 70.23 C
+ATOM 6458 O GLY F 74 6.526 38.366 -29.777 1.00 73.50 O
+ATOM 6459 OXT GLY F 74 8.382 38.920 -30.642 1.00 0.00 O
+ATOM 6460 H GLY F 74 6.672 38.074 -27.136 1.00 0.00 H
+ATOM 6461 1HA GLY F 74 9.279 39.057 -28.251 1.00 0.00 H
+ATOM 6462 2HA GLY F 74 8.804 37.369 -28.243 1.00 0.00 H
+TER
+ATOM 6464 N SER G 7 18.200 52.229 -5.012 1.00 61.74 N
+ATOM 6465 CA SER G 7 17.913 53.449 -5.754 1.00 59.95 C
+ATOM 6466 C SER G 7 16.752 53.229 -6.715 1.00 58.71 C
+ATOM 6467 O SER G 7 16.705 52.243 -7.464 1.00 58.07 O
+ATOM 6468 CB SER G 7 19.139 53.935 -6.496 1.00 61.54 C
+ATOM 6469 OG SER G 7 18.823 55.041 -7.283 1.00 72.12 O
+ATOM 6470 1H SER G 7 19.027 52.356 -4.449 1.00 0.00 H
+ATOM 6471 2H SER G 7 17.411 52.020 -4.412 1.00 0.00 H
+ATOM 6472 3H SER G 7 18.340 51.463 -5.654 1.00 0.00 H
+ATOM 6473 HA SER G 7 17.616 54.222 -5.043 1.00 0.00 H
+ATOM 6474 1HB SER G 7 19.919 54.202 -5.781 1.00 0.00 H
+ATOM 6475 2HB SER G 7 19.529 53.145 -7.123 1.00 0.00 H
+ATOM 6476 HG SER G 7 18.113 54.752 -7.870 1.00 0.00 H
+ATOM 6477 N ASP G 8 15.817 54.168 -6.693 1.00 54.37 N
+ATOM 6478 CA ASP G 8 14.585 54.063 -7.461 1.00 53.26 C
+ATOM 6479 C ASP G 8 14.780 53.939 -8.965 1.00 52.36 C
+ATOM 6480 O ASP G 8 15.704 54.520 -9.554 1.00 51.01 O
+ATOM 6481 CB ASP G 8 13.654 55.231 -7.147 1.00 46.34 C
+ATOM 6482 CG ASP G 8 13.061 55.130 -5.735 1.00 60.09 C
+ATOM 6483 OD1 ASP G 8 13.243 54.116 -5.093 1.00 49.06 O
+ATOM 6484 OD2 ASP G 8 12.413 56.061 -5.318 1.00 53.19 O
+ATOM 6485 H ASP G 8 15.940 54.969 -6.088 1.00 0.00 H
+ATOM 6486 HA ASP G 8 14.076 53.155 -7.132 1.00 0.00 H
+ATOM 6487 1HB ASP G 8 14.196 56.175 -7.235 1.00 0.00 H
+ATOM 6488 2HB ASP G 8 12.838 55.249 -7.872 1.00 0.00 H
+ATOM 6489 N PHE G 9 13.848 53.189 -9.548 1.00 49.81 N
+ATOM 6490 CA PHE G 9 13.773 52.869 -10.964 1.00 49.91 C
+ATOM 6491 C PHE G 9 12.340 52.860 -11.448 1.00 48.07 C
+ATOM 6492 O PHE G 9 11.402 52.856 -10.646 1.00 46.42 O
+ATOM 6493 CB PHE G 9 14.366 51.475 -11.240 1.00 41.56 C
+ATOM 6494 CG PHE G 9 13.639 50.339 -10.578 1.00 43.04 C
+ATOM 6495 CD1 PHE G 9 12.608 49.686 -11.234 1.00 41.62 C
+ATOM 6496 CD2 PHE G 9 13.999 49.901 -9.310 1.00 48.72 C
+ATOM 6497 CE1 PHE G 9 11.945 48.630 -10.648 1.00 50.60 C
+ATOM 6498 CE2 PHE G 9 13.335 48.840 -8.718 1.00 48.80 C
+ATOM 6499 CZ PHE G 9 12.307 48.206 -9.393 1.00 47.21 C
+ATOM 6500 H PHE G 9 13.147 52.786 -8.947 1.00 0.00 H
+ATOM 6501 HA PHE G 9 14.310 53.629 -11.523 1.00 0.00 H
+ATOM 6502 1HB PHE G 9 14.347 51.280 -12.305 1.00 0.00 H
+ATOM 6503 2HB PHE G 9 15.385 51.443 -10.928 1.00 0.00 H
+ATOM 6504 HD1 PHE G 9 12.322 50.025 -12.227 1.00 0.00 H
+ATOM 6505 HD2 PHE G 9 14.816 50.400 -8.778 1.00 0.00 H
+ATOM 6506 HE1 PHE G 9 11.137 48.136 -11.185 1.00 0.00 H
+ATOM 6507 HE2 PHE G 9 13.625 48.504 -7.721 1.00 0.00 H
+ATOM 6508 HZ PHE G 9 11.790 47.383 -8.931 1.00 0.00 H
+ATOM 6509 N VAL G 10 12.182 52.858 -12.765 1.00 47.01 N
+ATOM 6510 CA VAL G 10 10.864 52.780 -13.377 1.00 47.50 C
+ATOM 6511 C VAL G 10 10.835 51.597 -14.343 1.00 46.98 C
+ATOM 6512 O VAL G 10 11.876 51.199 -14.871 1.00 46.57 O
+ATOM 6513 CB VAL G 10 10.570 54.087 -14.146 1.00 50.73 C
+ATOM 6514 CG1 VAL G 10 10.634 55.292 -13.183 1.00 48.99 C
+ATOM 6515 CG2 VAL G 10 11.570 54.244 -15.287 1.00 51.83 C
+ATOM 6516 H VAL G 10 13.014 52.906 -13.347 1.00 0.00 H
+ATOM 6517 HA VAL G 10 10.110 52.626 -12.604 1.00 0.00 H
+ATOM 6518 HB VAL G 10 9.554 54.043 -14.553 1.00 0.00 H
+ATOM 6519 1HG1 VAL G 10 10.421 56.201 -13.726 1.00 0.00 H
+ATOM 6520 2HG1 VAL G 10 9.907 55.165 -12.381 1.00 0.00 H
+ATOM 6521 3HG1 VAL G 10 11.634 55.362 -12.756 1.00 0.00 H
+ATOM 6522 1HG2 VAL G 10 11.356 55.162 -15.836 1.00 0.00 H
+ATOM 6523 2HG2 VAL G 10 12.584 54.290 -14.881 1.00 0.00 H
+ATOM 6524 3HG2 VAL G 10 11.488 53.390 -15.963 1.00 0.00 H
+ATOM 6525 N VAL G 11 9.645 51.052 -14.597 1.00 49.48 N
+ATOM 6526 CA VAL G 11 9.497 49.960 -15.564 1.00 48.67 C
+ATOM 6527 C VAL G 11 8.683 50.445 -16.748 1.00 51.49 C
+ATOM 6528 O VAL G 11 7.570 50.931 -16.568 1.00 50.61 O
+ATOM 6529 CB VAL G 11 8.751 48.766 -14.946 1.00 47.41 C
+ATOM 6530 CG1 VAL G 11 8.616 47.654 -15.973 1.00 31.06 C
+ATOM 6531 CG2 VAL G 11 9.442 48.302 -13.676 1.00 50.37 C
+ATOM 6532 H VAL G 11 8.823 51.399 -14.105 1.00 0.00 H
+ATOM 6533 HA VAL G 11 10.479 49.643 -15.910 1.00 0.00 H
+ATOM 6534 HB VAL G 11 7.764 49.071 -14.715 1.00 0.00 H
+ATOM 6535 1HG1 VAL G 11 8.056 46.833 -15.534 1.00 0.00 H
+ATOM 6536 2HG1 VAL G 11 8.082 48.032 -16.848 1.00 0.00 H
+ATOM 6537 3HG1 VAL G 11 9.594 47.306 -16.273 1.00 0.00 H
+ATOM 6538 1HG2 VAL G 11 8.878 47.474 -13.244 1.00 0.00 H
+ATOM 6539 2HG2 VAL G 11 10.436 47.977 -13.894 1.00 0.00 H
+ATOM 6540 3HG2 VAL G 11 9.481 49.120 -12.965 1.00 0.00 H
+ATOM 6541 N ILE G 12 9.227 50.331 -17.956 1.00 51.84 N
+ATOM 6542 CA ILE G 12 8.535 50.800 -19.148 1.00 48.13 C
+ATOM 6543 C ILE G 12 8.321 49.678 -20.168 1.00 45.09 C
+ATOM 6544 O ILE G 12 9.286 49.059 -20.627 1.00 41.90 O
+ATOM 6545 CB ILE G 12 9.360 51.921 -19.806 1.00 46.36 C
+ATOM 6546 CG1 ILE G 12 9.581 53.070 -18.803 1.00 48.98 C
+ATOM 6547 CG2 ILE G 12 8.610 52.444 -21.043 1.00 56.08 C
+ATOM 6548 CD1 ILE G 12 10.631 54.029 -19.228 1.00 46.08 C
+ATOM 6549 H ILE G 12 10.157 49.935 -18.044 1.00 0.00 H
+ATOM 6550 HA ILE G 12 7.559 51.191 -18.863 1.00 0.00 H
+ATOM 6551 HB ILE G 12 10.337 51.537 -20.100 1.00 0.00 H
+ATOM 6552 1HG1 ILE G 12 8.657 53.612 -18.689 1.00 0.00 H
+ATOM 6553 2HG1 ILE G 12 9.869 52.667 -17.839 1.00 0.00 H
+ATOM 6554 1HG2 ILE G 12 9.182 53.235 -21.512 1.00 0.00 H
+ATOM 6555 2HG2 ILE G 12 8.469 51.630 -21.754 1.00 0.00 H
+ATOM 6556 3HG2 ILE G 12 7.638 52.830 -20.742 1.00 0.00 H
+ATOM 6557 1HD1 ILE G 12 10.727 54.821 -18.482 1.00 0.00 H
+ATOM 6558 2HD1 ILE G 12 11.581 53.504 -19.323 1.00 0.00 H
+ATOM 6559 3HD1 ILE G 12 10.364 54.451 -20.175 1.00 0.00 H
+ATOM 6560 N LYS G 13 7.067 49.425 -20.550 1.00 43.78 N
+ATOM 6561 CA LYS G 13 6.770 48.395 -21.547 1.00 47.68 C
+ATOM 6562 C LYS G 13 6.163 48.935 -22.815 1.00 51.29 C
+ATOM 6563 O LYS G 13 5.093 49.547 -22.809 1.00 52.50 O
+ATOM 6564 CB LYS G 13 5.819 47.342 -21.021 1.00 34.03 C
+ATOM 6565 CG LYS G 13 5.460 46.313 -22.084 1.00 34.55 C
+ATOM 6566 CD LYS G 13 4.532 45.255 -21.574 1.00 42.29 C
+ATOM 6567 CE LYS G 13 4.071 44.366 -22.723 1.00 41.48 C
+ATOM 6568 NZ LYS G 13 3.200 43.274 -22.265 1.00 45.77 N
+ATOM 6569 H LYS G 13 6.302 49.944 -20.123 1.00 0.00 H
+ATOM 6570 HA LYS G 13 7.701 47.906 -21.821 1.00 0.00 H
+ATOM 6571 1HB LYS G 13 6.278 46.833 -20.192 1.00 0.00 H
+ATOM 6572 2HB LYS G 13 4.910 47.808 -20.672 1.00 0.00 H
+ATOM 6573 1HG LYS G 13 4.975 46.813 -22.922 1.00 0.00 H
+ATOM 6574 2HG LYS G 13 6.373 45.841 -22.456 1.00 0.00 H
+ATOM 6575 1HD LYS G 13 5.051 44.639 -20.835 1.00 0.00 H
+ATOM 6576 2HD LYS G 13 3.667 45.719 -21.105 1.00 0.00 H
+ATOM 6577 1HE LYS G 13 3.528 44.976 -23.444 1.00 0.00 H
+ATOM 6578 2HE LYS G 13 4.943 43.933 -23.210 1.00 0.00 H
+ATOM 6579 1HZ LYS G 13 2.918 42.700 -23.077 1.00 0.00 H
+ATOM 6580 2HZ LYS G 13 3.747 42.705 -21.601 1.00 0.00 H
+ATOM 6581 3HZ LYS G 13 2.382 43.640 -21.814 1.00 0.00 H
+ATOM 6582 N ALA G 14 6.838 48.710 -23.926 1.00 52.49 N
+ATOM 6583 CA ALA G 14 6.305 49.232 -25.169 1.00 54.97 C
+ATOM 6584 C ALA G 14 4.992 48.556 -25.521 1.00 55.39 C
+ATOM 6585 O ALA G 14 4.907 47.325 -25.565 1.00 55.52 O
+ATOM 6586 CB ALA G 14 7.297 49.024 -26.279 1.00 43.15 C
+ATOM 6587 H ALA G 14 7.709 48.174 -23.903 1.00 0.00 H
+ATOM 6588 HA ALA G 14 6.112 50.290 -25.033 1.00 0.00 H
+ATOM 6589 1HB ALA G 14 6.913 49.425 -27.211 1.00 0.00 H
+ATOM 6590 2HB ALA G 14 8.189 49.518 -26.018 1.00 0.00 H
+ATOM 6591 3HB ALA G 14 7.481 47.968 -26.385 1.00 0.00 H
+ATOM 6592 N LEU G 15 3.986 49.354 -25.864 1.00 59.73 N
+ATOM 6593 CA LEU G 15 2.715 48.785 -26.293 1.00 63.06 C
+ATOM 6594 C LEU G 15 2.595 48.872 -27.814 1.00 65.63 C
+ATOM 6595 O LEU G 15 1.656 48.345 -28.416 1.00 67.89 O
+ATOM 6596 CB LEU G 15 1.573 49.490 -25.563 1.00 65.37 C
+ATOM 6597 CG LEU G 15 1.597 49.331 -23.990 1.00 59.88 C
+ATOM 6598 CD1 LEU G 15 0.483 50.170 -23.357 1.00 53.58 C
+ATOM 6599 CD2 LEU G 15 1.446 47.874 -23.623 1.00 56.74 C
+ATOM 6600 H LEU G 15 4.080 50.370 -25.818 1.00 0.00 H
+ATOM 6601 HA LEU G 15 2.692 47.733 -26.014 1.00 0.00 H
+ATOM 6602 1HB LEU G 15 1.642 50.539 -25.797 1.00 0.00 H
+ATOM 6603 2HB LEU G 15 0.626 49.108 -25.934 1.00 0.00 H
+ATOM 6604 HG LEU G 15 2.536 49.667 -23.610 1.00 0.00 H
+ATOM 6605 1HD1 LEU G 15 0.504 50.065 -22.279 1.00 0.00 H
+ATOM 6606 2HD1 LEU G 15 0.625 51.211 -23.603 1.00 0.00 H
+ATOM 6607 3HD1 LEU G 15 -0.481 49.834 -23.729 1.00 0.00 H
+ATOM 6608 1HD2 LEU G 15 1.480 47.765 -22.537 1.00 0.00 H
+ATOM 6609 2HD2 LEU G 15 0.492 47.501 -23.994 1.00 0.00 H
+ATOM 6610 3HD2 LEU G 15 2.261 47.304 -24.068 1.00 0.00 H
+ATOM 6611 N GLU G 16 3.590 49.512 -28.421 1.00 65.50 N
+ATOM 6612 CA GLU G 16 3.688 49.686 -29.867 1.00 64.73 C
+ATOM 6613 C GLU G 16 5.156 49.761 -30.280 1.00 63.18 C
+ATOM 6614 O GLU G 16 6.029 50.025 -29.461 1.00 61.52 O
+ATOM 6615 CB GLU G 16 2.929 50.933 -30.344 1.00 58.04 C
+ATOM 6616 CG GLU G 16 3.446 52.282 -29.838 1.00 63.44 C
+ATOM 6617 CD GLU G 16 2.598 53.434 -30.368 1.00 62.85 C
+ATOM 6618 OE1 GLU G 16 1.746 53.181 -31.189 1.00 57.09 O
+ATOM 6619 OE2 GLU G 16 2.768 54.552 -29.918 1.00 60.30 O
+ATOM 6620 H GLU G 16 4.313 49.906 -27.839 1.00 0.00 H
+ATOM 6621 HA GLU G 16 3.248 48.814 -30.352 1.00 0.00 H
+ATOM 6622 1HB GLU G 16 2.945 50.968 -31.432 1.00 0.00 H
+ATOM 6623 2HB GLU G 16 1.885 50.856 -30.036 1.00 0.00 H
+ATOM 6624 1HG GLU G 16 3.445 52.291 -28.751 1.00 0.00 H
+ATOM 6625 2HG GLU G 16 4.478 52.410 -30.171 1.00 0.00 H
+ATOM 6626 N ASP G 17 5.444 49.489 -31.544 1.00 61.46 N
+ATOM 6627 CA ASP G 17 6.825 49.581 -32.002 1.00 60.15 C
+ATOM 6628 C ASP G 17 7.375 51.003 -31.951 1.00 57.93 C
+ATOM 6629 O ASP G 17 6.695 51.942 -32.362 1.00 56.35 O
+ATOM 6630 CB ASP G 17 6.945 49.062 -33.436 1.00 61.18 C
+ATOM 6631 CG ASP G 17 6.767 47.555 -33.557 1.00 64.12 C
+ATOM 6632 OD1 ASP G 17 6.806 46.873 -32.546 1.00 73.27 O
+ATOM 6633 OD2 ASP G 17 6.587 47.093 -34.659 1.00 63.28 O
+ATOM 6634 H ASP G 17 4.704 49.256 -32.191 1.00 0.00 H
+ATOM 6635 HA ASP G 17 7.432 48.967 -31.358 1.00 0.00 H
+ATOM 6636 1HB ASP G 17 6.209 49.562 -34.069 1.00 0.00 H
+ATOM 6637 2HB ASP G 17 7.933 49.320 -33.821 1.00 0.00 H
+ATOM 6638 N GLY G 18 8.643 51.145 -31.558 1.00 57.11 N
+ATOM 6639 CA GLY G 18 9.317 52.439 -31.630 1.00 53.69 C
+ATOM 6640 C GLY G 18 9.156 53.348 -30.411 1.00 55.50 C
+ATOM 6641 O GLY G 18 9.301 54.566 -30.533 1.00 55.59 O
+ATOM 6642 H GLY G 18 9.150 50.354 -31.164 1.00 0.00 H
+ATOM 6643 1HA GLY G 18 10.380 52.254 -31.788 1.00 0.00 H
+ATOM 6644 2HA GLY G 18 8.965 52.967 -32.515 1.00 0.00 H
+ATOM 6645 N VAL G 19 8.834 52.786 -29.250 1.00 52.95 N
+ATOM 6646 CA VAL G 19 8.704 53.632 -28.064 1.00 49.63 C
+ATOM 6647 C VAL G 19 10.061 54.203 -27.737 1.00 48.48 C
+ATOM 6648 O VAL G 19 11.059 53.485 -27.733 1.00 47.74 O
+ATOM 6649 CB VAL G 19 8.132 52.871 -26.861 1.00 57.29 C
+ATOM 6650 CG1 VAL G 19 8.196 53.736 -25.589 1.00 57.55 C
+ATOM 6651 CG2 VAL G 19 6.705 52.520 -27.166 1.00 56.28 C
+ATOM 6652 H VAL G 19 8.751 51.775 -29.192 1.00 0.00 H
+ATOM 6653 HA VAL G 19 8.024 54.453 -28.292 1.00 0.00 H
+ATOM 6654 HB VAL G 19 8.697 51.993 -26.696 1.00 0.00 H
+ATOM 6655 1HG1 VAL G 19 7.794 53.182 -24.749 1.00 0.00 H
+ATOM 6656 2HG1 VAL G 19 9.232 53.999 -25.374 1.00 0.00 H
+ATOM 6657 3HG1 VAL G 19 7.613 54.648 -25.736 1.00 0.00 H
+ATOM 6658 1HG2 VAL G 19 6.279 51.989 -26.348 1.00 0.00 H
+ATOM 6659 2HG2 VAL G 19 6.137 53.429 -27.332 1.00 0.00 H
+ATOM 6660 3HG2 VAL G 19 6.666 51.908 -28.056 1.00 0.00 H
+ATOM 6661 N ASN G 20 10.106 55.504 -27.510 1.00 50.04 N
+ATOM 6662 CA ASN G 20 11.356 56.193 -27.260 1.00 51.75 C
+ATOM 6663 C ASN G 20 11.494 56.621 -25.804 1.00 52.54 C
+ATOM 6664 O ASN G 20 10.720 57.451 -25.314 1.00 54.73 O
+ATOM 6665 CB ASN G 20 11.495 57.376 -28.201 1.00 56.13 C
+ATOM 6666 CG ASN G 20 12.840 58.027 -28.140 1.00 60.88 C
+ATOM 6667 OD1 ASN G 20 13.684 57.670 -27.322 1.00 60.83 O
+ATOM 6668 ND2 ASN G 20 13.051 58.987 -29.008 1.00 64.39 N
+ATOM 6669 H ASN G 20 9.240 56.035 -27.508 1.00 0.00 H
+ATOM 6670 HA ASN G 20 12.176 55.502 -27.459 1.00 0.00 H
+ATOM 6671 1HB ASN G 20 11.311 57.043 -29.222 1.00 0.00 H
+ATOM 6672 2HB ASN G 20 10.744 58.118 -27.966 1.00 0.00 H
+ATOM 6673 1HD2 ASN G 20 13.927 59.470 -29.028 1.00 0.00 H
+ATOM 6674 2HD2 ASN G 20 12.331 59.239 -29.652 1.00 0.00 H
+ATOM 6675 N VAL G 21 12.429 55.998 -25.092 1.00 52.87 N
+ATOM 6676 CA VAL G 21 12.664 56.340 -23.698 1.00 51.46 C
+ATOM 6677 C VAL G 21 13.929 57.200 -23.644 1.00 51.54 C
+ATOM 6678 O VAL G 21 14.972 56.809 -24.169 1.00 52.69 O
+ATOM 6679 CB VAL G 21 12.825 55.085 -22.833 1.00 42.46 C
+ATOM 6680 CG1 VAL G 21 13.073 55.513 -21.394 1.00 41.31 C
+ATOM 6681 CG2 VAL G 21 11.576 54.212 -22.970 1.00 36.32 C
+ATOM 6682 H VAL G 21 13.012 55.293 -25.540 1.00 0.00 H
+ATOM 6683 HA VAL G 21 11.824 56.918 -23.319 1.00 0.00 H
+ATOM 6684 HB VAL G 21 13.697 54.522 -23.163 1.00 0.00 H
+ATOM 6685 1HG1 VAL G 21 13.204 54.643 -20.765 1.00 0.00 H
+ATOM 6686 2HG1 VAL G 21 13.972 56.128 -21.348 1.00 0.00 H
+ATOM 6687 3HG1 VAL G 21 12.222 56.092 -21.043 1.00 0.00 H
+ATOM 6688 1HG2 VAL G 21 11.685 53.318 -22.360 1.00 0.00 H
+ATOM 6689 2HG2 VAL G 21 10.708 54.775 -22.642 1.00 0.00 H
+ATOM 6690 3HG2 VAL G 21 11.448 53.922 -24.016 1.00 0.00 H
+ATOM 6691 N ILE G 22 13.822 58.393 -23.063 1.00 50.90 N
+ATOM 6692 CA ILE G 22 14.917 59.361 -23.085 1.00 50.89 C
+ATOM 6693 C ILE G 22 15.447 59.714 -21.697 1.00 50.07 C
+ATOM 6694 O ILE G 22 14.684 60.068 -20.795 1.00 49.60 O
+ATOM 6695 CB ILE G 22 14.452 60.667 -23.760 1.00 47.44 C
+ATOM 6696 CG1 ILE G 22 13.889 60.380 -25.153 1.00 48.04 C
+ATOM 6697 CG2 ILE G 22 15.605 61.645 -23.857 1.00 59.38 C
+ATOM 6698 CD1 ILE G 22 12.365 60.219 -25.151 1.00 47.85 C
+ATOM 6699 H ILE G 22 12.941 58.650 -22.635 1.00 0.00 H
+ATOM 6700 HA ILE G 22 15.736 58.940 -23.660 1.00 0.00 H
+ATOM 6701 HB ILE G 22 13.668 61.102 -23.180 1.00 0.00 H
+ATOM 6702 1HG1 ILE G 22 14.152 61.196 -25.823 1.00 0.00 H
+ATOM 6703 2HG1 ILE G 22 14.338 59.463 -25.535 1.00 0.00 H
+ATOM 6704 1HG2 ILE G 22 15.264 62.564 -24.328 1.00 0.00 H
+ATOM 6705 2HG2 ILE G 22 15.986 61.871 -22.863 1.00 0.00 H
+ATOM 6706 3HG2 ILE G 22 16.398 61.196 -24.460 1.00 0.00 H
+ATOM 6707 1HD1 ILE G 22 12.013 60.013 -26.157 1.00 0.00 H
+ATOM 6708 2HD1 ILE G 22 12.088 59.398 -24.501 1.00 0.00 H
+ATOM 6709 3HD1 ILE G 22 11.900 61.132 -24.788 1.00 0.00 H
+ATOM 6710 N GLY G 23 16.765 59.607 -21.516 1.00 49.82 N
+ATOM 6711 CA GLY G 23 17.373 59.995 -20.247 1.00 52.35 C
+ATOM 6712 C GLY G 23 17.790 61.462 -20.311 1.00 55.10 C
+ATOM 6713 O GLY G 23 18.473 61.884 -21.253 1.00 54.70 O
+ATOM 6714 H GLY G 23 17.350 59.305 -22.291 1.00 0.00 H
+ATOM 6715 1HA GLY G 23 16.664 59.847 -19.432 1.00 0.00 H
+ATOM 6716 2HA GLY G 23 18.241 59.369 -20.044 1.00 0.00 H
+ATOM 6717 N LEU G 24 17.408 62.219 -19.281 1.00 56.58 N
+ATOM 6718 CA LEU G 24 17.700 63.648 -19.167 1.00 57.87 C
+ATOM 6719 C LEU G 24 18.790 63.893 -18.129 1.00 59.43 C
+ATOM 6720 O LEU G 24 18.732 63.371 -17.001 1.00 59.41 O
+ATOM 6721 CB LEU G 24 16.440 64.416 -18.773 1.00 55.64 C
+ATOM 6722 CG LEU G 24 15.366 64.646 -19.873 1.00 53.47 C
+ATOM 6723 CD1 LEU G 24 14.629 63.330 -20.170 1.00 62.87 C
+ATOM 6724 CD2 LEU G 24 14.378 65.711 -19.394 1.00 55.07 C
+ATOM 6725 H LEU G 24 16.842 61.793 -18.554 1.00 0.00 H
+ATOM 6726 HA LEU G 24 18.048 64.015 -20.128 1.00 0.00 H
+ATOM 6727 1HB LEU G 24 15.978 63.848 -18.007 1.00 0.00 H
+ATOM 6728 2HB LEU G 24 16.731 65.383 -18.369 1.00 0.00 H
+ATOM 6729 HG LEU G 24 15.851 64.980 -20.791 1.00 0.00 H
+ATOM 6730 1HD1 LEU G 24 13.884 63.498 -20.945 1.00 0.00 H
+ATOM 6731 2HD1 LEU G 24 15.324 62.588 -20.511 1.00 0.00 H
+ATOM 6732 3HD1 LEU G 24 14.136 62.971 -19.267 1.00 0.00 H
+ATOM 6733 1HD2 LEU G 24 13.623 65.884 -20.165 1.00 0.00 H
+ATOM 6734 2HD2 LEU G 24 13.890 65.374 -18.484 1.00 0.00 H
+ATOM 6735 3HD2 LEU G 24 14.911 66.641 -19.199 1.00 0.00 H
+ATOM 6736 N THR G 25 19.774 64.706 -18.518 1.00 60.64 N
+ATOM 6737 CA THR G 25 20.978 64.934 -17.726 1.00 60.46 C
+ATOM 6738 C THR G 25 20.761 65.550 -16.355 1.00 60.21 C
+ATOM 6739 O THR G 25 19.892 66.400 -16.159 1.00 61.34 O
+ATOM 6740 CB THR G 25 21.961 65.858 -18.482 1.00 65.65 C
+ATOM 6741 OG1 THR G 25 21.316 67.119 -18.787 1.00 61.38 O
+ATOM 6742 CG2 THR G 25 22.443 65.198 -19.765 1.00 60.35 C
+ATOM 6743 H THR G 25 19.712 65.128 -19.439 1.00 0.00 H
+ATOM 6744 HA THR G 25 21.461 63.979 -17.596 1.00 0.00 H
+ATOM 6745 HB THR G 25 22.829 66.058 -17.850 1.00 0.00 H
+ATOM 6746 HG1 THR G 25 21.600 67.827 -18.156 1.00 0.00 H
+ATOM 6747 1HG2 THR G 25 23.134 65.867 -20.266 1.00 0.00 H
+ATOM 6748 2HG2 THR G 25 22.948 64.269 -19.517 1.00 0.00 H
+ATOM 6749 3HG2 THR G 25 21.608 64.985 -20.413 1.00 0.00 H
+ATOM 6750 N ARG G 26 21.610 65.117 -15.424 1.00 60.41 N
+ATOM 6751 CA ARG G 26 21.677 65.651 -14.071 1.00 60.27 C
+ATOM 6752 C ARG G 26 22.663 66.811 -14.020 1.00 59.98 C
+ATOM 6753 O ARG G 26 23.784 66.701 -14.516 1.00 60.00 O
+ATOM 6754 CB ARG G 26 22.120 64.576 -13.080 1.00 51.99 C
+ATOM 6755 CG ARG G 26 22.087 65.008 -11.610 1.00 51.73 C
+ATOM 6756 CD ARG G 26 22.546 63.931 -10.675 1.00 54.06 C
+ATOM 6757 NE ARG G 26 21.722 62.739 -10.752 1.00 54.75 N
+ATOM 6758 CZ ARG G 26 20.536 62.584 -10.150 1.00 52.91 C
+ATOM 6759 NH1 ARG G 26 20.025 63.553 -9.432 1.00 59.37 N
+ATOM 6760 NH2 ARG G 26 19.906 61.442 -10.305 1.00 46.27 N
+ATOM 6761 H ARG G 26 22.235 64.359 -15.684 1.00 0.00 H
+ATOM 6762 HA ARG G 26 20.692 66.020 -13.787 1.00 0.00 H
+ATOM 6763 1HB ARG G 26 21.495 63.691 -13.189 1.00 0.00 H
+ATOM 6764 2HB ARG G 26 23.144 64.276 -13.310 1.00 0.00 H
+ATOM 6765 1HG ARG G 26 22.745 65.865 -11.475 1.00 0.00 H
+ATOM 6766 2HG ARG G 26 21.070 65.287 -11.337 1.00 0.00 H
+ATOM 6767 1HD ARG G 26 23.566 63.656 -10.914 1.00 0.00 H
+ATOM 6768 2HD ARG G 26 22.509 64.301 -9.654 1.00 0.00 H
+ATOM 6769 HE ARG G 26 22.066 61.933 -11.287 1.00 0.00 H
+ATOM 6770 1HH1 ARG G 26 20.535 64.413 -9.329 1.00 0.00 H
+ATOM 6771 2HH1 ARG G 26 19.131 63.432 -8.978 1.00 0.00 H
+ATOM 6772 1HH2 ARG G 26 20.365 60.721 -10.866 1.00 0.00 H
+ATOM 6773 2HH2 ARG G 26 18.988 61.277 -9.893 1.00 0.00 H
+ATOM 6774 N GLY G 27 22.254 67.922 -13.417 1.00 59.23 N
+ATOM 6775 CA GLY G 27 23.130 69.082 -13.302 1.00 59.14 C
+ATOM 6776 C GLY G 27 22.426 70.349 -13.767 1.00 61.13 C
+ATOM 6777 O GLY G 27 21.244 70.331 -14.092 1.00 56.15 O
+ATOM 6778 H GLY G 27 21.319 67.967 -13.039 1.00 0.00 H
+ATOM 6779 1HA GLY G 27 23.444 69.195 -12.268 1.00 0.00 H
+ATOM 6780 2HA GLY G 27 24.029 68.925 -13.895 1.00 0.00 H
+ATOM 6781 N ALA G 28 23.163 71.461 -13.781 1.00 62.56 N
+ATOM 6782 CA ALA G 28 22.583 72.747 -14.175 1.00 62.52 C
+ATOM 6783 C ALA G 28 22.068 72.717 -15.615 1.00 61.42 C
+ATOM 6784 O ALA G 28 21.058 73.353 -15.929 1.00 60.27 O
+ATOM 6785 CB ALA G 28 23.635 73.839 -14.040 1.00 58.79 C
+ATOM 6786 H ALA G 28 24.127 71.415 -13.500 1.00 0.00 H
+ATOM 6787 HA ALA G 28 21.750 72.966 -13.517 1.00 0.00 H
+ATOM 6788 1HB ALA G 28 23.193 74.796 -14.311 1.00 0.00 H
+ATOM 6789 2HB ALA G 28 23.985 73.881 -13.012 1.00 0.00 H
+ATOM 6790 3HB ALA G 28 24.473 73.625 -14.702 1.00 0.00 H
+ATOM 6791 N ASP G 29 22.756 71.995 -16.488 1.00 60.96 N
+ATOM 6792 CA ASP G 29 22.356 71.901 -17.885 1.00 61.78 C
+ATOM 6793 C ASP G 29 21.476 70.675 -18.119 1.00 60.91 C
+ATOM 6794 O ASP G 29 21.925 69.540 -17.925 1.00 63.23 O
+ATOM 6795 CB ASP G 29 23.584 71.833 -18.797 1.00 62.84 C
+ATOM 6796 CG ASP G 29 24.392 73.140 -18.829 1.00 77.50 C
+ATOM 6797 OD1 ASP G 29 23.805 74.192 -18.744 1.00 70.31 O
+ATOM 6798 OD2 ASP G 29 25.592 73.063 -18.929 1.00 84.72 O
+ATOM 6799 H ASP G 29 23.573 71.491 -16.171 1.00 0.00 H
+ATOM 6800 HA ASP G 29 21.781 72.791 -18.142 1.00 0.00 H
+ATOM 6801 1HB ASP G 29 24.238 71.027 -18.469 1.00 0.00 H
+ATOM 6802 2HB ASP G 29 23.264 71.600 -19.814 1.00 0.00 H
+ATOM 6803 N THR G 30 20.233 70.909 -18.544 1.00 59.89 N
+ATOM 6804 CA THR G 30 19.311 69.806 -18.793 1.00 59.85 C
+ATOM 6805 C THR G 30 19.160 69.571 -20.293 1.00 60.46 C
+ATOM 6806 O THR G 30 18.740 70.457 -21.037 1.00 60.76 O
+ATOM 6807 CB THR G 30 17.924 70.051 -18.170 1.00 53.02 C
+ATOM 6808 OG1 THR G 30 18.043 70.197 -16.742 1.00 53.53 O
+ATOM 6809 CG2 THR G 30 17.004 68.860 -18.477 1.00 50.17 C
+ATOM 6810 H THR G 30 19.926 71.862 -18.682 1.00 0.00 H
+ATOM 6811 HA THR G 30 19.716 68.900 -18.343 1.00 0.00 H
+ATOM 6812 HB THR G 30 17.500 70.959 -18.583 1.00 0.00 H
+ATOM 6813 HG1 THR G 30 18.561 70.978 -16.537 1.00 0.00 H
+ATOM 6814 1HG2 THR G 30 16.023 69.031 -18.035 1.00 0.00 H
+ATOM 6815 2HG2 THR G 30 16.900 68.748 -19.556 1.00 0.00 H
+ATOM 6816 3HG2 THR G 30 17.436 67.948 -18.059 1.00 0.00 H
+ATOM 6817 N ARG G 31 19.514 68.370 -20.715 1.00 60.86 N
+ATOM 6818 CA ARG G 31 19.482 67.955 -22.111 1.00 59.55 C
+ATOM 6819 C ARG G 31 19.399 66.438 -22.158 1.00 58.36 C
+ATOM 6820 O ARG G 31 19.490 65.797 -21.115 1.00 57.72 O
+ATOM 6821 CB ARG G 31 20.725 68.484 -22.814 1.00 57.87 C
+ATOM 6822 CG ARG G 31 22.028 67.962 -22.241 1.00 45.00 C
+ATOM 6823 CD ARG G 31 23.208 68.635 -22.822 1.00 45.00 C
+ATOM 6824 NE ARG G 31 24.453 68.128 -22.258 1.00 45.00 N
+ATOM 6825 CZ ARG G 31 25.652 68.719 -22.400 1.00 45.00 C
+ATOM 6826 NH1 ARG G 31 25.753 69.839 -23.079 1.00 45.00 N
+ATOM 6827 NH2 ARG G 31 26.727 68.177 -21.853 1.00 45.00 N
+ATOM 6828 H ARG G 31 19.892 67.727 -20.029 1.00 0.00 H
+ATOM 6829 HA ARG G 31 18.597 68.373 -22.589 1.00 0.00 H
+ATOM 6830 1HB ARG G 31 20.696 68.200 -23.864 1.00 0.00 H
+ATOM 6831 2HB ARG G 31 20.741 69.575 -22.763 1.00 0.00 H
+ATOM 6832 1HG ARG G 31 22.042 68.135 -21.163 1.00 0.00 H
+ATOM 6833 2HG ARG G 31 22.105 66.892 -22.440 1.00 0.00 H
+ATOM 6834 1HD ARG G 31 23.226 68.471 -23.900 1.00 0.00 H
+ATOM 6835 2HD ARG G 31 23.150 69.705 -22.615 1.00 0.00 H
+ATOM 6836 HE ARG G 31 24.409 67.265 -21.729 1.00 0.00 H
+ATOM 6837 1HH1 ARG G 31 24.930 70.255 -23.493 1.00 0.00 H
+ATOM 6838 2HH1 ARG G 31 26.649 70.288 -23.182 1.00 0.00 H
+ATOM 6839 1HH2 ARG G 31 26.650 67.317 -21.331 1.00 0.00 H
+ATOM 6840 2HH2 ARG G 31 27.625 68.624 -21.958 1.00 0.00 H
+ATOM 6841 N PHE G 32 19.176 65.833 -23.315 1.00 55.75 N
+ATOM 6842 CA PHE G 32 19.166 64.376 -23.268 1.00 57.90 C
+ATOM 6843 C PHE G 32 20.590 63.882 -23.447 1.00 58.50 C
+ATOM 6844 O PHE G 32 21.413 64.576 -24.046 1.00 60.52 O
+ATOM 6845 CB PHE G 32 18.271 63.754 -24.340 1.00 57.48 C
+ATOM 6846 CG PHE G 32 18.771 63.825 -25.753 1.00 58.70 C
+ATOM 6847 CD1 PHE G 32 18.460 64.877 -26.608 1.00 53.58 C
+ATOM 6848 CD2 PHE G 32 19.543 62.784 -26.241 1.00 55.34 C
+ATOM 6849 CE1 PHE G 32 18.929 64.877 -27.918 1.00 53.78 C
+ATOM 6850 CE2 PHE G 32 20.007 62.779 -27.531 1.00 60.76 C
+ATOM 6851 CZ PHE G 32 19.704 63.824 -28.376 1.00 57.26 C
+ATOM 6852 H PHE G 32 19.060 66.339 -24.182 1.00 0.00 H
+ATOM 6853 HA PHE G 32 18.807 64.049 -22.297 1.00 0.00 H
+ATOM 6854 1HB PHE G 32 18.149 62.708 -24.096 1.00 0.00 H
+ATOM 6855 2HB PHE G 32 17.289 64.215 -24.300 1.00 0.00 H
+ATOM 6856 HD1 PHE G 32 17.843 65.702 -26.248 1.00 0.00 H
+ATOM 6857 HD2 PHE G 32 19.778 61.955 -25.583 1.00 0.00 H
+ATOM 6858 HE1 PHE G 32 18.688 65.701 -28.589 1.00 0.00 H
+ATOM 6859 HE2 PHE G 32 20.612 61.945 -27.886 1.00 0.00 H
+ATOM 6860 HZ PHE G 32 20.072 63.819 -29.401 1.00 0.00 H
+ATOM 6861 N HIS G 33 20.875 62.675 -22.979 1.00 54.22 N
+ATOM 6862 CA HIS G 33 22.199 62.106 -23.227 1.00 51.13 C
+ATOM 6863 C HIS G 33 22.095 60.699 -23.786 1.00 48.08 C
+ATOM 6864 O HIS G 33 23.089 60.105 -24.202 1.00 47.17 O
+ATOM 6865 CB HIS G 33 23.025 62.079 -21.938 1.00 49.06 C
+ATOM 6866 CG HIS G 33 22.485 61.151 -20.883 1.00 50.32 C
+ATOM 6867 ND1 HIS G 33 22.765 59.804 -20.888 1.00 44.71 N
+ATOM 6868 CD2 HIS G 33 21.669 61.358 -19.816 1.00 44.50 C
+ATOM 6869 CE1 HIS G 33 22.165 59.224 -19.871 1.00 50.45 C
+ATOM 6870 NE2 HIS G 33 21.491 60.138 -19.208 1.00 48.54 N
+ATOM 6871 H HIS G 33 20.162 62.175 -22.450 1.00 0.00 H
+ATOM 6872 HA HIS G 33 22.729 62.711 -23.962 1.00 0.00 H
+ATOM 6873 1HB HIS G 33 24.042 61.756 -22.175 1.00 0.00 H
+ATOM 6874 2HB HIS G 33 23.091 63.075 -21.531 1.00 0.00 H
+ATOM 6875 HD2 HIS G 33 21.234 62.305 -19.505 1.00 0.00 H
+ATOM 6876 HE1 HIS G 33 22.212 58.162 -19.625 1.00 0.00 H
+ATOM 6877 HE2 HIS G 33 20.936 59.943 -18.385 1.00 0.00 H
+ATOM 6878 N HIS G 34 20.884 60.171 -23.797 1.00 46.28 N
+ATOM 6879 CA HIS G 34 20.642 58.817 -24.261 1.00 44.51 C
+ATOM 6880 C HIS G 34 19.197 58.596 -24.624 1.00 44.88 C
+ATOM 6881 O HIS G 34 18.279 59.054 -23.937 1.00 44.73 O
+ATOM 6882 CB HIS G 34 21.041 57.755 -23.220 1.00 43.39 C
+ATOM 6883 CG HIS G 34 20.877 56.322 -23.737 1.00 39.63 C
+ATOM 6884 ND1 HIS G 34 21.731 55.766 -24.663 1.00 36.03 N
+ATOM 6885 CD2 HIS G 34 19.948 55.362 -23.458 1.00 41.63 C
+ATOM 6886 CE1 HIS G 34 21.339 54.523 -24.937 1.00 37.56 C
+ATOM 6887 NE2 HIS G 34 20.260 54.254 -24.222 1.00 43.47 N
+ATOM 6888 H HIS G 34 20.114 60.725 -23.456 1.00 0.00 H
+ATOM 6889 HA HIS G 34 21.234 58.637 -25.159 1.00 0.00 H
+ATOM 6890 1HB HIS G 34 22.087 57.896 -22.933 1.00 0.00 H
+ATOM 6891 2HB HIS G 34 20.436 57.872 -22.321 1.00 0.00 H
+ATOM 6892 HD2 HIS G 34 19.110 55.453 -22.769 1.00 0.00 H
+ATOM 6893 HE1 HIS G 34 21.826 53.842 -25.638 1.00 0.00 H
+ATOM 6894 HE2 HIS G 34 19.738 53.359 -24.249 1.00 0.00 H
+ATOM 6895 N SER G 35 18.992 57.832 -25.678 1.00 45.20 N
+ATOM 6896 CA SER G 35 17.654 57.427 -26.041 1.00 47.13 C
+ATOM 6897 C SER G 35 17.652 55.935 -26.308 1.00 49.76 C
+ATOM 6898 O SER G 35 18.605 55.399 -26.879 1.00 47.60 O
+ATOM 6899 CB SER G 35 17.190 58.201 -27.254 1.00 43.89 C
+ATOM 6900 OG SER G 35 18.003 57.925 -28.362 1.00 42.03 O
+ATOM 6901 H SER G 35 19.782 57.499 -26.217 1.00 0.00 H
+ATOM 6902 HA SER G 35 16.985 57.628 -25.211 1.00 0.00 H
+ATOM 6903 1HB SER G 35 16.164 57.933 -27.474 1.00 0.00 H
+ATOM 6904 2HB SER G 35 17.206 59.267 -27.041 1.00 0.00 H
+ATOM 6905 HG SER G 35 17.932 56.979 -28.510 1.00 0.00 H
+ATOM 6906 N GLU G 36 16.564 55.279 -25.939 1.00 50.54 N
+ATOM 6907 CA GLU G 36 16.443 53.843 -26.114 1.00 50.55 C
+ATOM 6908 C GLU G 36 15.140 53.502 -26.812 1.00 52.12 C
+ATOM 6909 O GLU G 36 14.063 53.936 -26.388 1.00 51.47 O
+ATOM 6910 CB GLU G 36 16.501 53.168 -24.730 1.00 50.42 C
+ATOM 6911 CG GLU G 36 16.560 51.638 -24.709 1.00 42.61 C
+ATOM 6912 CD GLU G 36 17.880 51.098 -25.170 1.00 45.81 C
+ATOM 6913 OE1 GLU G 36 18.908 51.602 -24.736 1.00 48.61 O
+ATOM 6914 OE2 GLU G 36 17.874 50.149 -25.935 1.00 37.97 O
+ATOM 6915 H GLU G 36 15.824 55.792 -25.464 1.00 0.00 H
+ATOM 6916 HA GLU G 36 17.271 53.489 -26.732 1.00 0.00 H
+ATOM 6917 1HB GLU G 36 17.371 53.536 -24.189 1.00 0.00 H
+ATOM 6918 2HB GLU G 36 15.624 53.463 -24.157 1.00 0.00 H
+ATOM 6919 1HG GLU G 36 16.383 51.286 -23.696 1.00 0.00 H
+ATOM 6920 2HG GLU G 36 15.767 51.243 -25.345 1.00 0.00 H
+ATOM 6921 N LYS G 37 15.233 52.757 -27.902 1.00 51.16 N
+ATOM 6922 CA LYS G 37 14.043 52.374 -28.636 1.00 51.08 C
+ATOM 6923 C LYS G 37 13.544 51.007 -28.231 1.00 52.33 C
+ATOM 6924 O LYS G 37 14.311 50.036 -28.205 1.00 52.66 O
+ATOM 6925 CB LYS G 37 14.283 52.409 -30.143 1.00 48.71 C
+ATOM 6926 CG LYS G 37 14.578 53.784 -30.707 1.00 42.29 C
+ATOM 6927 CD LYS G 37 13.319 54.653 -30.695 1.00 45.36 C
+ATOM 6928 CE LYS G 37 13.554 55.995 -31.381 1.00 52.15 C
+ATOM 6929 NZ LYS G 37 13.871 55.828 -32.839 1.00 59.66 N
+ATOM 6930 H LYS G 37 16.141 52.436 -28.213 1.00 0.00 H
+ATOM 6931 HA LYS G 37 13.262 53.093 -28.407 1.00 0.00 H
+ATOM 6932 1HB LYS G 37 15.120 51.761 -30.394 1.00 0.00 H
+ATOM 6933 2HB LYS G 37 13.397 52.021 -30.653 1.00 0.00 H
+ATOM 6934 1HG LYS G 37 15.345 54.268 -30.097 1.00 0.00 H
+ATOM 6935 2HG LYS G 37 14.945 53.695 -31.730 1.00 0.00 H
+ATOM 6936 1HD LYS G 37 12.507 54.127 -31.204 1.00 0.00 H
+ATOM 6937 2HD LYS G 37 13.010 54.833 -29.663 1.00 0.00 H
+ATOM 6938 1HE LYS G 37 12.654 56.604 -31.286 1.00 0.00 H
+ATOM 6939 2HE LYS G 37 14.383 56.509 -30.895 1.00 0.00 H
+ATOM 6940 1HZ LYS G 37 14.013 56.736 -33.258 1.00 0.00 H
+ATOM 6941 2HZ LYS G 37 14.710 55.272 -32.945 1.00 0.00 H
+ATOM 6942 3HZ LYS G 37 13.101 55.364 -33.300 1.00 0.00 H
+ATOM 6943 N LEU G 38 12.258 50.923 -27.933 1.00 54.47 N
+ATOM 6944 CA LEU G 38 11.653 49.651 -27.599 1.00 56.10 C
+ATOM 6945 C LEU G 38 10.694 49.237 -28.713 1.00 57.30 C
+ATOM 6946 O LEU G 38 9.904 50.056 -29.210 1.00 57.22 O
+ATOM 6947 CB LEU G 38 10.871 49.773 -26.291 1.00 53.21 C
+ATOM 6948 CG LEU G 38 11.600 50.317 -25.058 1.00 52.68 C
+ATOM 6949 CD1 LEU G 38 10.591 50.389 -23.886 1.00 46.80 C
+ATOM 6950 CD2 LEU G 38 12.775 49.449 -24.728 1.00 51.28 C
+ATOM 6951 H LEU G 38 11.693 51.772 -27.940 1.00 0.00 H
+ATOM 6952 HA LEU G 38 12.429 48.890 -27.501 1.00 0.00 H
+ATOM 6953 1HB LEU G 38 10.080 50.433 -26.478 1.00 0.00 H
+ATOM 6954 2HB LEU G 38 10.457 48.800 -26.035 1.00 0.00 H
+ATOM 6955 HG LEU G 38 11.954 51.332 -25.266 1.00 0.00 H
+ATOM 6956 1HD1 LEU G 38 11.080 50.794 -22.999 1.00 0.00 H
+ATOM 6957 2HD1 LEU G 38 9.758 51.036 -24.165 1.00 0.00 H
+ATOM 6958 3HD1 LEU G 38 10.213 49.387 -23.663 1.00 0.00 H
+ATOM 6959 1HD2 LEU G 38 13.288 49.858 -23.870 1.00 0.00 H
+ATOM 6960 2HD2 LEU G 38 12.439 48.433 -24.510 1.00 0.00 H
+ATOM 6961 3HD2 LEU G 38 13.451 49.439 -25.580 1.00 0.00 H
+ATOM 6962 N ASP G 39 10.700 47.964 -29.063 1.00 57.92 N
+ATOM 6963 CA ASP G 39 9.704 47.463 -29.999 1.00 59.02 C
+ATOM 6964 C ASP G 39 8.543 46.933 -29.186 1.00 60.73 C
+ATOM 6965 O ASP G 39 8.706 46.718 -27.984 1.00 61.36 O
+ATOM 6966 CB ASP G 39 10.281 46.416 -30.940 1.00 64.08 C
+ATOM 6967 CG ASP G 39 11.273 47.038 -31.929 1.00 62.89 C
+ATOM 6968 OD1 ASP G 39 11.172 48.229 -32.175 1.00 61.31 O
+ATOM 6969 OD2 ASP G 39 12.111 46.329 -32.430 1.00 54.41 O
+ATOM 6970 H ASP G 39 11.398 47.330 -28.659 1.00 0.00 H
+ATOM 6971 HA ASP G 39 9.350 48.287 -30.609 1.00 0.00 H
+ATOM 6972 1HB ASP G 39 10.781 45.636 -30.358 1.00 0.00 H
+ATOM 6973 2HB ASP G 39 9.469 45.950 -31.505 1.00 0.00 H
+ATOM 6974 N LYS G 40 7.380 46.741 -29.797 1.00 60.09 N
+ATOM 6975 CA LYS G 40 6.245 46.274 -29.023 1.00 58.06 C
+ATOM 6976 C LYS G 40 6.621 45.047 -28.225 1.00 54.94 C
+ATOM 6977 O LYS G 40 7.153 44.079 -28.774 1.00 52.58 O
+ATOM 6978 CB LYS G 40 5.068 45.944 -29.929 1.00 63.59 C
+ATOM 6979 CG LYS G 40 3.820 45.507 -29.201 1.00 67.66 C
+ATOM 6980 CD LYS G 40 2.689 45.292 -30.172 1.00 61.52 C
+ATOM 6981 CE LYS G 40 1.415 44.891 -29.466 1.00 64.33 C
+ATOM 6982 NZ LYS G 40 0.300 44.690 -30.426 1.00 76.63 N
+ATOM 6983 H LYS G 40 7.265 46.917 -30.800 1.00 0.00 H
+ATOM 6984 HA LYS G 40 5.947 47.061 -28.328 1.00 0.00 H
+ATOM 6985 1HB LYS G 40 4.822 46.808 -30.536 1.00 0.00 H
+ATOM 6986 2HB LYS G 40 5.354 45.146 -30.612 1.00 0.00 H
+ATOM 6987 1HG LYS G 40 4.015 44.582 -28.662 1.00 0.00 H
+ATOM 6988 2HG LYS G 40 3.537 46.268 -28.483 1.00 0.00 H
+ATOM 6989 1HD LYS G 40 2.510 46.219 -30.719 1.00 0.00 H
+ATOM 6990 2HD LYS G 40 2.968 44.510 -30.881 1.00 0.00 H
+ATOM 6991 1HE LYS G 40 1.584 43.962 -28.918 1.00 0.00 H
+ATOM 6992 2HE LYS G 40 1.137 45.674 -28.759 1.00 0.00 H
+ATOM 6993 1HZ LYS G 40 -0.532 44.427 -29.922 1.00 0.00 H
+ATOM 6994 2HZ LYS G 40 0.132 45.550 -30.930 1.00 0.00 H
+ATOM 6995 3HZ LYS G 40 0.544 43.962 -31.080 1.00 0.00 H
+ATOM 6996 N GLY G 41 6.339 45.078 -26.930 1.00 52.50 N
+ATOM 6997 CA GLY G 41 6.639 43.946 -26.071 1.00 50.47 C
+ATOM 6998 C GLY G 41 7.959 44.038 -25.305 1.00 49.46 C
+ATOM 6999 O GLY G 41 8.176 43.262 -24.372 1.00 48.78 O
+ATOM 7000 H GLY G 41 5.902 45.903 -26.522 1.00 0.00 H
+ATOM 7001 1HA GLY G 41 5.818 43.804 -25.373 1.00 0.00 H
+ATOM 7002 2HA GLY G 41 6.673 43.060 -26.697 1.00 0.00 H
+ATOM 7003 N GLU G 42 8.856 44.951 -25.673 1.00 49.14 N
+ATOM 7004 CA GLU G 42 10.108 45.026 -24.919 1.00 50.08 C
+ATOM 7005 C GLU G 42 9.907 45.780 -23.611 1.00 50.20 C
+ATOM 7006 O GLU G 42 9.176 46.777 -23.548 1.00 50.83 O
+ATOM 7007 CB GLU G 42 11.259 45.641 -25.745 1.00 45.99 C
+ATOM 7008 CG GLU G 42 11.780 44.737 -26.909 1.00 52.33 C
+ATOM 7009 CD GLU G 42 13.024 45.316 -27.681 1.00 46.52 C
+ATOM 7010 OE1 GLU G 42 12.923 46.413 -28.162 1.00 53.15 O
+ATOM 7011 OE2 GLU G 42 14.055 44.652 -27.775 1.00 52.77 O
+ATOM 7012 H GLU G 42 8.675 45.571 -26.461 1.00 0.00 H
+ATOM 7013 HA GLU G 42 10.412 44.009 -24.659 1.00 0.00 H
+ATOM 7014 1HB GLU G 42 10.921 46.572 -26.185 1.00 0.00 H
+ATOM 7015 2HB GLU G 42 12.096 45.869 -25.086 1.00 0.00 H
+ATOM 7016 1HG GLU G 42 12.024 43.743 -26.499 1.00 0.00 H
+ATOM 7017 2HG GLU G 42 10.959 44.608 -27.610 1.00 0.00 H
+ATOM 7018 N VAL G 43 10.566 45.288 -22.558 1.00 48.22 N
+ATOM 7019 CA VAL G 43 10.462 45.917 -21.242 1.00 46.36 C
+ATOM 7020 C VAL G 43 11.797 46.469 -20.776 1.00 45.74 C
+ATOM 7021 O VAL G 43 12.809 45.770 -20.773 1.00 48.55 O
+ATOM 7022 CB VAL G 43 9.919 44.916 -20.184 1.00 43.43 C
+ATOM 7023 CG1 VAL G 43 9.886 45.578 -18.800 1.00 36.62 C
+ATOM 7024 CG2 VAL G 43 8.506 44.473 -20.569 1.00 37.18 C
+ATOM 7025 H VAL G 43 11.155 44.463 -22.682 1.00 0.00 H
+ATOM 7026 HA VAL G 43 9.761 46.744 -21.311 1.00 0.00 H
+ATOM 7027 HB VAL G 43 10.578 44.051 -20.134 1.00 0.00 H
+ATOM 7028 1HG1 VAL G 43 9.508 44.871 -18.062 1.00 0.00 H
+ATOM 7029 2HG1 VAL G 43 10.891 45.888 -18.519 1.00 0.00 H
+ATOM 7030 3HG1 VAL G 43 9.232 46.452 -18.836 1.00 0.00 H
+ATOM 7031 1HG2 VAL G 43 8.121 43.771 -19.829 1.00 0.00 H
+ATOM 7032 2HG2 VAL G 43 7.874 45.335 -20.604 1.00 0.00 H
+ATOM 7033 3HG2 VAL G 43 8.525 43.999 -21.547 1.00 0.00 H
+ATOM 7034 N LEU G 44 11.798 47.739 -20.399 1.00 43.79 N
+ATOM 7035 CA LEU G 44 12.998 48.395 -19.906 1.00 45.29 C
+ATOM 7036 C LEU G 44 12.840 48.802 -18.453 1.00 45.75 C
+ATOM 7037 O LEU G 44 11.907 49.519 -18.092 1.00 46.43 O
+ATOM 7038 CB LEU G 44 13.309 49.632 -20.751 1.00 43.11 C
+ATOM 7039 CG LEU G 44 14.510 50.485 -20.303 1.00 45.39 C
+ATOM 7040 CD1 LEU G 44 15.813 49.673 -20.450 1.00 39.16 C
+ATOM 7041 CD2 LEU G 44 14.542 51.758 -21.147 1.00 41.81 C
+ATOM 7042 H LEU G 44 10.929 48.264 -20.452 1.00 0.00 H
+ATOM 7043 HA LEU G 44 13.834 47.702 -19.973 1.00 0.00 H
+ATOM 7044 1HB LEU G 44 13.517 49.294 -21.752 1.00 0.00 H
+ATOM 7045 2HB LEU G 44 12.427 50.272 -20.776 1.00 0.00 H
+ATOM 7046 HG LEU G 44 14.399 50.750 -19.249 1.00 0.00 H
+ATOM 7047 1HD1 LEU G 44 16.655 50.278 -20.127 1.00 0.00 H
+ATOM 7048 2HD1 LEU G 44 15.756 48.775 -19.833 1.00 0.00 H
+ATOM 7049 3HD1 LEU G 44 15.949 49.390 -21.493 1.00 0.00 H
+ATOM 7050 1HD2 LEU G 44 15.381 52.383 -20.839 1.00 0.00 H
+ATOM 7051 2HD2 LEU G 44 14.649 51.500 -22.197 1.00 0.00 H
+ATOM 7052 3HD2 LEU G 44 13.612 52.302 -21.005 1.00 0.00 H
+ATOM 7053 N ILE G 45 13.741 48.329 -17.613 1.00 44.80 N
+ATOM 7054 CA ILE G 45 13.702 48.683 -16.212 1.00 41.71 C
+ATOM 7055 C ILE G 45 14.922 49.545 -15.946 1.00 39.54 C
+ATOM 7056 O ILE G 45 16.050 49.102 -16.160 1.00 38.14 O
+ATOM 7057 CB ILE G 45 13.724 47.440 -15.328 1.00 44.31 C
+ATOM 7058 CG1 ILE G 45 12.552 46.537 -15.709 1.00 43.25 C
+ATOM 7059 CG2 ILE G 45 13.571 47.905 -13.906 1.00 33.38 C
+ATOM 7060 CD1 ILE G 45 12.562 45.197 -15.074 1.00 44.42 C
+ATOM 7061 H ILE G 45 14.472 47.715 -17.950 1.00 0.00 H
+ATOM 7062 HA ILE G 45 12.809 49.257 -16.001 1.00 0.00 H
+ATOM 7063 HB ILE G 45 14.654 46.887 -15.460 1.00 0.00 H
+ATOM 7064 1HG1 ILE G 45 11.648 47.031 -15.444 1.00 0.00 H
+ATOM 7065 2HG1 ILE G 45 12.563 46.394 -16.787 1.00 0.00 H
+ATOM 7066 1HG2 ILE G 45 13.561 47.063 -13.229 1.00 0.00 H
+ATOM 7067 2HG2 ILE G 45 14.387 48.572 -13.652 1.00 0.00 H
+ATOM 7068 3HG2 ILE G 45 12.643 48.444 -13.826 1.00 0.00 H
+ATOM 7069 1HD1 ILE G 45 11.694 44.645 -15.411 1.00 0.00 H
+ATOM 7070 2HD1 ILE G 45 13.471 44.660 -15.354 1.00 0.00 H
+ATOM 7071 3HD1 ILE G 45 12.522 45.313 -14.004 1.00 0.00 H
+ATOM 7072 N ALA G 46 14.727 50.783 -15.509 1.00 39.67 N
+ATOM 7073 CA ALA G 46 15.903 51.641 -15.416 1.00 42.15 C
+ATOM 7074 C ALA G 46 15.915 52.557 -14.219 1.00 43.12 C
+ATOM 7075 O ALA G 46 14.901 53.151 -13.846 1.00 43.03 O
+ATOM 7076 CB ALA G 46 15.997 52.485 -16.677 1.00 40.85 C
+ATOM 7077 H ALA G 46 13.786 51.112 -15.297 1.00 0.00 H
+ATOM 7078 HA ALA G 46 16.781 51.006 -15.336 1.00 0.00 H
+ATOM 7079 1HB ALA G 46 16.897 53.100 -16.629 1.00 0.00 H
+ATOM 7080 2HB ALA G 46 16.042 51.836 -17.549 1.00 0.00 H
+ATOM 7081 3HB ALA G 46 15.120 53.127 -16.746 1.00 0.00 H
+ATOM 7082 N GLN G 47 17.108 52.680 -13.639 1.00 43.83 N
+ATOM 7083 CA GLN G 47 17.360 53.526 -12.484 1.00 44.16 C
+ATOM 7084 C GLN G 47 17.695 54.950 -12.830 1.00 43.77 C
+ATOM 7085 O GLN G 47 18.210 55.249 -13.909 1.00 47.50 O
+ATOM 7086 CB GLN G 47 18.514 52.982 -11.642 1.00 38.14 C
+ATOM 7087 CG GLN G 47 18.253 51.682 -10.951 1.00 40.71 C
+ATOM 7088 CD GLN G 47 19.421 51.253 -10.125 1.00 37.22 C
+ATOM 7089 OE1 GLN G 47 20.548 51.127 -10.625 1.00 43.53 O
+ATOM 7090 NE2 GLN G 47 19.175 51.030 -8.837 1.00 37.16 N
+ATOM 7091 H GLN G 47 17.895 52.143 -14.007 1.00 0.00 H
+ATOM 7092 HA GLN G 47 16.472 53.542 -11.869 1.00 0.00 H
+ATOM 7093 1HB GLN G 47 19.388 52.850 -12.280 1.00 0.00 H
+ATOM 7094 2HB GLN G 47 18.777 53.719 -10.879 1.00 0.00 H
+ATOM 7095 1HG GLN G 47 17.423 51.826 -10.267 1.00 0.00 H
+ATOM 7096 2HG GLN G 47 18.024 50.909 -11.686 1.00 0.00 H
+ATOM 7097 1HE2 GLN G 47 19.910 50.738 -8.229 1.00 0.00 H
+ATOM 7098 2HE2 GLN G 47 18.235 51.180 -8.467 1.00 0.00 H
+ATOM 7099 N PHE G 48 17.475 55.816 -11.856 1.00 44.59 N
+ATOM 7100 CA PHE G 48 17.967 57.180 -11.942 1.00 44.85 C
+ATOM 7101 C PHE G 48 19.434 57.098 -11.525 1.00 45.26 C
+ATOM 7102 O PHE G 48 19.789 56.262 -10.694 1.00 44.66 O
+ATOM 7103 CB PHE G 48 17.161 58.091 -11.044 1.00 50.64 C
+ATOM 7104 CG PHE G 48 15.763 58.282 -11.544 1.00 52.84 C
+ATOM 7105 CD1 PHE G 48 15.501 59.145 -12.593 1.00 51.71 C
+ATOM 7106 CD2 PHE G 48 14.709 57.572 -10.977 1.00 44.79 C
+ATOM 7107 CE1 PHE G 48 14.218 59.292 -13.060 1.00 54.37 C
+ATOM 7108 CE2 PHE G 48 13.429 57.723 -11.452 1.00 63.15 C
+ATOM 7109 CZ PHE G 48 13.192 58.579 -12.498 1.00 60.76 C
+ATOM 7110 H PHE G 48 16.976 55.497 -11.024 1.00 0.00 H
+ATOM 7111 HA PHE G 48 17.907 57.539 -12.970 1.00 0.00 H
+ATOM 7112 1HB PHE G 48 17.125 57.691 -10.031 1.00 0.00 H
+ATOM 7113 2HB PHE G 48 17.648 59.056 -11.011 1.00 0.00 H
+ATOM 7114 HD1 PHE G 48 16.329 59.698 -13.051 1.00 0.00 H
+ATOM 7115 HD2 PHE G 48 14.914 56.879 -10.156 1.00 0.00 H
+ATOM 7116 HE1 PHE G 48 14.015 59.956 -13.878 1.00 0.00 H
+ATOM 7117 HE2 PHE G 48 12.610 57.160 -11.009 1.00 0.00 H
+ATOM 7118 HZ PHE G 48 12.203 58.680 -12.889 1.00 0.00 H
+ATOM 7119 N THR G 49 20.300 57.887 -12.152 1.00 44.14 N
+ATOM 7120 CA THR G 49 21.736 57.736 -11.902 1.00 42.15 C
+ATOM 7121 C THR G 49 22.460 59.039 -11.648 1.00 42.70 C
+ATOM 7122 O THR G 49 21.876 60.118 -11.629 1.00 45.30 O
+ATOM 7123 CB THR G 49 22.464 57.069 -13.085 1.00 44.61 C
+ATOM 7124 OG1 THR G 49 22.541 57.996 -14.185 1.00 54.28 O
+ATOM 7125 CG2 THR G 49 21.726 55.806 -13.537 1.00 32.75 C
+ATOM 7126 H THR G 49 19.954 58.604 -12.784 1.00 0.00 H
+ATOM 7127 HA THR G 49 21.867 57.111 -11.019 1.00 0.00 H
+ATOM 7128 HB THR G 49 23.473 56.792 -12.782 1.00 0.00 H
+ATOM 7129 HG1 THR G 49 22.750 58.871 -13.839 1.00 0.00 H
+ATOM 7130 1HG2 THR G 49 22.263 55.355 -14.368 1.00 0.00 H
+ATOM 7131 2HG2 THR G 49 21.668 55.095 -12.712 1.00 0.00 H
+ATOM 7132 3HG2 THR G 49 20.718 56.063 -13.861 1.00 0.00 H
+ATOM 7133 N GLU G 50 23.774 58.921 -11.519 1.00 42.03 N
+ATOM 7134 CA GLU G 50 24.677 60.055 -11.404 1.00 47.33 C
+ATOM 7135 C GLU G 50 24.531 60.997 -12.605 1.00 50.45 C
+ATOM 7136 O GLU G 50 24.818 62.187 -12.494 1.00 51.25 O
+ATOM 7137 CB GLU G 50 26.125 59.563 -11.287 1.00 55.95 C
+ATOM 7138 CG GLU G 50 27.164 60.658 -11.087 1.00 60.46 C
+ATOM 7139 CD GLU G 50 28.566 60.114 -10.878 1.00 71.86 C
+ATOM 7140 OE1 GLU G 50 28.728 58.915 -10.872 1.00 79.12 O
+ATOM 7141 OE2 GLU G 50 29.471 60.903 -10.727 1.00 74.19 O
+ATOM 7142 H GLU G 50 24.177 57.996 -11.515 1.00 0.00 H
+ATOM 7143 HA GLU G 50 24.421 60.612 -10.502 1.00 0.00 H
+ATOM 7144 1HB GLU G 50 26.207 58.877 -10.444 1.00 0.00 H
+ATOM 7145 2HB GLU G 50 26.394 59.007 -12.185 1.00 0.00 H
+ATOM 7146 1HG GLU G 50 27.164 61.300 -11.969 1.00 0.00 H
+ATOM 7147 2HG GLU G 50 26.880 61.264 -10.228 1.00 0.00 H
+ATOM 7148 N HIS G 51 24.144 60.452 -13.771 1.00 48.18 N
+ATOM 7149 CA HIS G 51 24.023 61.259 -14.976 1.00 48.20 C
+ATOM 7150 C HIS G 51 22.566 61.470 -15.417 1.00 51.44 C
+ATOM 7151 O HIS G 51 22.291 62.444 -16.115 1.00 50.87 O
+ATOM 7152 CB HIS G 51 24.837 60.619 -16.112 1.00 31.12 C
+ATOM 7153 CG HIS G 51 26.315 60.550 -15.801 1.00 49.46 C
+ATOM 7154 ND1 HIS G 51 26.865 59.547 -15.032 1.00 48.61 N
+ATOM 7155 CD2 HIS G 51 27.343 61.359 -16.153 1.00 47.60 C
+ATOM 7156 CE1 HIS G 51 28.169 59.750 -14.913 1.00 48.57 C
+ATOM 7157 NE2 HIS G 51 28.484 60.839 -15.587 1.00 47.25 N
+ATOM 7158 H HIS G 51 23.888 59.474 -13.820 1.00 0.00 H
+ATOM 7159 HA HIS G 51 24.445 62.247 -14.788 1.00 0.00 H
+ATOM 7160 1HB HIS G 51 24.471 59.607 -16.307 1.00 0.00 H
+ATOM 7161 2HB HIS G 51 24.705 61.197 -17.028 1.00 0.00 H
+ATOM 7162 HD2 HIS G 51 27.279 62.256 -16.767 1.00 0.00 H
+ATOM 7163 HE1 HIS G 51 28.865 59.121 -14.350 1.00 0.00 H
+ATOM 7164 HE2 HIS G 51 29.411 61.234 -15.670 1.00 0.00 H
+ATOM 7165 N THR G 52 21.631 60.598 -14.986 1.00 51.90 N
+ATOM 7166 CA THR G 52 20.212 60.745 -15.377 1.00 53.05 C
+ATOM 7167 C THR G 52 19.332 61.195 -14.204 1.00 53.75 C
+ATOM 7168 O THR G 52 19.182 60.472 -13.217 1.00 51.71 O
+ATOM 7169 CB THR G 52 19.605 59.420 -15.903 1.00 47.22 C
+ATOM 7170 OG1 THR G 52 20.324 58.968 -17.054 1.00 44.89 O
+ATOM 7171 CG2 THR G 52 18.122 59.631 -16.279 1.00 44.00 C
+ATOM 7172 H THR G 52 21.913 59.804 -14.426 1.00 0.00 H
+ATOM 7173 HA THR G 52 20.142 61.494 -16.163 1.00 0.00 H
+ATOM 7174 HB THR G 52 19.667 58.653 -15.127 1.00 0.00 H
+ATOM 7175 HG1 THR G 52 21.178 58.623 -16.770 1.00 0.00 H
+ATOM 7176 1HG2 THR G 52 17.699 58.697 -16.645 1.00 0.00 H
+ATOM 7177 2HG2 THR G 52 17.558 59.959 -15.404 1.00 0.00 H
+ATOM 7178 3HG2 THR G 52 18.052 60.390 -17.058 1.00 0.00 H
+ATOM 7179 N SER G 53 18.707 62.370 -14.345 1.00 54.96 N
+ATOM 7180 CA SER G 53 17.845 62.909 -13.287 1.00 54.92 C
+ATOM 7181 C SER G 53 16.373 62.786 -13.646 1.00 53.92 C
+ATOM 7182 O SER G 53 15.495 62.903 -12.786 1.00 53.55 O
+ATOM 7183 CB SER G 53 18.162 64.357 -13.017 1.00 57.97 C
+ATOM 7184 OG SER G 53 17.885 65.156 -14.131 1.00 53.93 O
+ATOM 7185 H SER G 53 18.847 62.901 -15.202 1.00 0.00 H
+ATOM 7186 HA SER G 53 18.019 62.337 -12.374 1.00 0.00 H
+ATOM 7187 1HB SER G 53 17.578 64.696 -12.168 1.00 0.00 H
+ATOM 7188 2HB SER G 53 19.201 64.443 -12.753 1.00 0.00 H
+ATOM 7189 HG SER G 53 18.269 64.699 -14.895 1.00 0.00 H
+ATOM 7190 N ALA G 54 16.104 62.561 -14.927 1.00 52.00 N
+ATOM 7191 CA ALA G 54 14.718 62.439 -15.354 1.00 51.39 C
+ATOM 7192 C ALA G 54 14.610 61.507 -16.549 1.00 50.29 C
+ATOM 7193 O ALA G 54 15.536 61.384 -17.351 1.00 51.44 O
+ATOM 7194 CB ALA G 54 14.126 63.807 -15.666 1.00 45.87 C
+ATOM 7195 H ALA G 54 16.866 62.509 -15.596 1.00 0.00 H
+ATOM 7196 HA ALA G 54 14.154 62.002 -14.541 1.00 0.00 H
+ATOM 7197 1HB ALA G 54 13.084 63.686 -15.952 1.00 0.00 H
+ATOM 7198 2HB ALA G 54 14.190 64.432 -14.777 1.00 0.00 H
+ATOM 7199 3HB ALA G 54 14.649 64.285 -16.455 1.00 0.00 H
+ATOM 7200 N ILE G 55 13.452 60.865 -16.662 1.00 50.72 N
+ATOM 7201 CA ILE G 55 13.163 59.974 -17.774 1.00 54.11 C
+ATOM 7202 C ILE G 55 11.901 60.400 -18.522 1.00 55.97 C
+ATOM 7203 O ILE G 55 10.838 60.580 -17.931 1.00 56.54 O
+ATOM 7204 CB ILE G 55 13.009 58.513 -17.276 1.00 57.35 C
+ATOM 7205 CG1 ILE G 55 14.345 58.029 -16.620 1.00 63.27 C
+ATOM 7206 CG2 ILE G 55 12.603 57.600 -18.438 1.00 56.72 C
+ATOM 7207 CD1 ILE G 55 14.244 56.693 -15.887 1.00 55.10 C
+ATOM 7208 H ILE G 55 12.743 61.022 -15.956 1.00 0.00 H
+ATOM 7209 HA ILE G 55 13.996 60.008 -18.469 1.00 0.00 H
+ATOM 7210 HB ILE G 55 12.239 58.474 -16.506 1.00 0.00 H
+ATOM 7211 1HG1 ILE G 55 15.102 57.940 -17.401 1.00 0.00 H
+ATOM 7212 2HG1 ILE G 55 14.677 58.771 -15.907 1.00 0.00 H
+ATOM 7213 1HG2 ILE G 55 12.488 56.580 -18.077 1.00 0.00 H
+ATOM 7214 2HG2 ILE G 55 11.658 57.939 -18.862 1.00 0.00 H
+ATOM 7215 3HG2 ILE G 55 13.375 57.630 -19.208 1.00 0.00 H
+ATOM 7216 1HD1 ILE G 55 15.220 56.435 -15.461 1.00 0.00 H
+ATOM 7217 2HD1 ILE G 55 13.509 56.769 -15.082 1.00 0.00 H
+ATOM 7218 3HD1 ILE G 55 13.939 55.914 -16.585 1.00 0.00 H
+ATOM 7219 N LYS G 56 12.028 60.569 -19.832 1.00 57.78 N
+ATOM 7220 CA LYS G 56 10.875 60.919 -20.655 1.00 56.77 C
+ATOM 7221 C LYS G 56 10.457 59.752 -21.530 1.00 57.25 C
+ATOM 7222 O LYS G 56 11.300 59.082 -22.118 1.00 58.41 O
+ATOM 7223 CB LYS G 56 11.130 62.147 -21.533 1.00 63.59 C
+ATOM 7224 CG LYS G 56 9.924 62.467 -22.419 1.00 65.55 C
+ATOM 7225 CD LYS G 56 10.101 63.667 -23.330 1.00 50.46 C
+ATOM 7226 CE LYS G 56 9.896 64.965 -22.597 1.00 53.76 C
+ATOM 7227 NZ LYS G 56 9.643 66.085 -23.558 1.00 62.36 N
+ATOM 7228 H LYS G 56 12.937 60.428 -20.262 1.00 0.00 H
+ATOM 7229 HA LYS G 56 10.042 61.153 -19.999 1.00 0.00 H
+ATOM 7230 1HB LYS G 56 11.336 63.014 -20.905 1.00 0.00 H
+ATOM 7231 2HB LYS G 56 11.984 61.986 -22.157 1.00 0.00 H
+ATOM 7232 1HG LYS G 56 9.721 61.617 -23.066 1.00 0.00 H
+ATOM 7233 2HG LYS G 56 9.051 62.625 -21.783 1.00 0.00 H
+ATOM 7234 1HD LYS G 56 11.100 63.655 -23.770 1.00 0.00 H
+ATOM 7235 2HD LYS G 56 9.368 63.607 -24.141 1.00 0.00 H
+ATOM 7236 1HE LYS G 56 9.048 64.858 -21.937 1.00 0.00 H
+ATOM 7237 2HE LYS G 56 10.778 65.199 -22.001 1.00 0.00 H
+ATOM 7238 1HZ LYS G 56 9.470 66.966 -23.067 1.00 0.00 H
+ATOM 7239 2HZ LYS G 56 10.430 66.199 -24.172 1.00 0.00 H
+ATOM 7240 3HZ LYS G 56 8.797 65.849 -24.104 1.00 0.00 H
+ATOM 7241 N VAL G 57 9.154 59.489 -21.603 1.00 55.87 N
+ATOM 7242 CA VAL G 57 8.685 58.421 -22.470 1.00 57.02 C
+ATOM 7243 C VAL G 57 7.723 58.946 -23.543 1.00 59.46 C
+ATOM 7244 O VAL G 57 6.735 59.633 -23.247 1.00 60.85 O
+ATOM 7245 CB VAL G 57 8.001 57.320 -21.645 1.00 45.71 C
+ATOM 7246 CG1 VAL G 57 7.533 56.193 -22.575 1.00 40.33 C
+ATOM 7247 CG2 VAL G 57 8.966 56.814 -20.596 1.00 53.49 C
+ATOM 7248 H VAL G 57 8.498 60.040 -21.058 1.00 0.00 H
+ATOM 7249 HA VAL G 57 9.544 57.979 -22.976 1.00 0.00 H
+ATOM 7250 HB VAL G 57 7.116 57.728 -21.158 1.00 0.00 H
+ATOM 7251 1HG1 VAL G 57 7.043 55.418 -21.996 1.00 0.00 H
+ATOM 7252 2HG1 VAL G 57 6.830 56.586 -23.315 1.00 0.00 H
+ATOM 7253 3HG1 VAL G 57 8.395 55.768 -23.090 1.00 0.00 H
+ATOM 7254 1HG2 VAL G 57 8.485 56.035 -20.008 1.00 0.00 H
+ATOM 7255 2HG2 VAL G 57 9.840 56.419 -21.094 1.00 0.00 H
+ATOM 7256 3HG2 VAL G 57 9.261 57.629 -19.937 1.00 0.00 H
+ATOM 7257 N ARG G 58 8.049 58.622 -24.798 1.00 60.02 N
+ATOM 7258 CA ARG G 58 7.280 59.001 -25.983 1.00 60.26 C
+ATOM 7259 C ARG G 58 6.851 57.760 -26.773 1.00 60.73 C
+ATOM 7260 O ARG G 58 7.681 56.930 -27.145 1.00 61.49 O
+ATOM 7261 CB ARG G 58 8.133 59.892 -26.867 1.00 72.15 C
+ATOM 7262 CG ARG G 58 7.511 60.314 -28.175 1.00 73.70 C
+ATOM 7263 CD ARG G 58 8.462 61.131 -28.978 1.00 75.55 C
+ATOM 7264 NE ARG G 58 8.686 62.432 -28.390 1.00 77.27 N
+ATOM 7265 CZ ARG G 58 9.681 63.272 -28.723 1.00 74.15 C
+ATOM 7266 NH1 ARG G 58 10.562 62.947 -29.645 1.00 68.72 N
+ATOM 7267 NH2 ARG G 58 9.751 64.432 -28.108 1.00 72.91 N
+ATOM 7268 H ARG G 58 8.900 58.084 -24.945 1.00 0.00 H
+ATOM 7269 HA ARG G 58 6.392 59.548 -25.670 1.00 0.00 H
+ATOM 7270 1HB ARG G 58 8.389 60.804 -26.314 1.00 0.00 H
+ATOM 7271 2HB ARG G 58 9.061 59.378 -27.095 1.00 0.00 H
+ATOM 7272 1HG ARG G 58 7.228 59.428 -28.751 1.00 0.00 H
+ATOM 7273 2HG ARG G 58 6.629 60.922 -27.969 1.00 0.00 H
+ATOM 7274 1HD ARG G 58 9.422 60.612 -29.031 1.00 0.00 H
+ATOM 7275 2HD ARG G 58 8.066 61.273 -29.984 1.00 0.00 H
+ATOM 7276 HE ARG G 58 8.035 62.760 -27.666 1.00 0.00 H
+ATOM 7277 1HH1 ARG G 58 10.499 62.057 -30.114 1.00 0.00 H
+ATOM 7278 2HH1 ARG G 58 11.301 63.593 -29.882 1.00 0.00 H
+ATOM 7279 1HH2 ARG G 58 9.040 64.647 -27.398 1.00 0.00 H
+ATOM 7280 2HH2 ARG G 58 10.477 65.088 -28.332 1.00 0.00 H
+ATOM 7281 N GLY G 59 5.561 57.636 -27.072 1.00 59.23 N
+ATOM 7282 CA GLY G 59 5.069 56.449 -27.764 1.00 58.53 C
+ATOM 7283 C GLY G 59 4.304 55.631 -26.748 1.00 61.34 C
+ATOM 7284 O GLY G 59 4.656 55.620 -25.570 1.00 61.49 O
+ATOM 7285 H GLY G 59 4.862 58.324 -26.787 1.00 0.00 H
+ATOM 7286 1HA GLY G 59 4.411 56.731 -28.588 1.00 0.00 H
+ATOM 7287 2HA GLY G 59 5.893 55.868 -28.170 1.00 0.00 H
+ATOM 7288 N LYS G 60 3.249 54.966 -27.186 1.00 61.47 N
+ATOM 7289 CA LYS G 60 2.395 54.274 -26.239 1.00 64.17 C
+ATOM 7290 C LYS G 60 3.157 53.223 -25.445 1.00 64.48 C
+ATOM 7291 O LYS G 60 3.772 52.318 -26.028 1.00 63.04 O
+ATOM 7292 CB LYS G 60 1.194 53.670 -26.958 1.00 66.59 C
+ATOM 7293 CG LYS G 60 0.122 53.140 -26.052 1.00 73.32 C
+ATOM 7294 CD LYS G 60 -1.041 52.578 -26.848 1.00 77.40 C
+ATOM 7295 CE LYS G 60 -2.134 52.048 -25.935 1.00 83.03 C
+ATOM 7296 NZ LYS G 60 -3.296 51.521 -26.708 1.00 87.30 N
+ATOM 7297 H LYS G 60 3.024 54.957 -28.180 1.00 0.00 H
+ATOM 7298 HA LYS G 60 2.031 55.010 -25.532 1.00 0.00 H
+ATOM 7299 1HB LYS G 60 0.754 54.418 -27.621 1.00 0.00 H
+ATOM 7300 2HB LYS G 60 1.522 52.840 -27.577 1.00 0.00 H
+ATOM 7301 1HG LYS G 60 0.529 52.387 -25.428 1.00 0.00 H
+ATOM 7302 2HG LYS G 60 -0.238 53.952 -25.412 1.00 0.00 H
+ATOM 7303 1HD LYS G 60 -1.453 53.361 -27.494 1.00 0.00 H
+ATOM 7304 2HD LYS G 60 -0.677 51.762 -27.475 1.00 0.00 H
+ATOM 7305 1HE LYS G 60 -1.724 51.246 -25.325 1.00 0.00 H
+ATOM 7306 2HE LYS G 60 -2.476 52.851 -25.281 1.00 0.00 H
+ATOM 7307 1HZ LYS G 60 -4.001 51.176 -26.070 1.00 0.00 H
+ATOM 7308 2HZ LYS G 60 -3.689 52.261 -27.272 1.00 0.00 H
+ATOM 7309 3HZ LYS G 60 -2.987 50.769 -27.308 1.00 0.00 H
+ATOM 7310 N ALA G 61 3.087 53.324 -24.123 1.00 63.29 N
+ATOM 7311 CA ALA G 61 3.802 52.391 -23.257 1.00 64.03 C
+ATOM 7312 C ALA G 61 3.198 52.322 -21.855 1.00 62.28 C
+ATOM 7313 O ALA G 61 2.703 53.322 -21.318 1.00 60.14 O
+ATOM 7314 CB ALA G 61 5.267 52.770 -23.156 1.00 64.59 C
+ATOM 7315 H ALA G 61 2.529 54.085 -23.736 1.00 0.00 H
+ATOM 7316 HA ALA G 61 3.742 51.409 -23.706 1.00 0.00 H
+ATOM 7317 1HB ALA G 61 5.794 52.043 -22.545 1.00 0.00 H
+ATOM 7318 2HB ALA G 61 5.685 52.781 -24.145 1.00 0.00 H
+ATOM 7319 3HB ALA G 61 5.370 53.751 -22.713 1.00 0.00 H
+ATOM 7320 N TYR G 62 3.291 51.148 -21.245 1.00 62.35 N
+ATOM 7321 CA TYR G 62 2.802 50.958 -19.879 1.00 60.44 C
+ATOM 7322 C TYR G 62 3.941 51.256 -18.926 1.00 58.06 C
+ATOM 7323 O TYR G 62 5.020 50.673 -19.057 1.00 57.14 O
+ATOM 7324 CB TYR G 62 2.296 49.530 -19.680 1.00 63.76 C
+ATOM 7325 CG TYR G 62 1.604 49.283 -18.355 1.00 68.36 C
+ATOM 7326 CD1 TYR G 62 0.329 49.784 -18.159 1.00 70.13 C
+ATOM 7327 CD2 TYR G 62 2.216 48.556 -17.350 1.00 70.16 C
+ATOM 7328 CE1 TYR G 62 -0.336 49.560 -16.978 1.00 72.30 C
+ATOM 7329 CE2 TYR G 62 1.546 48.325 -16.162 1.00 73.30 C
+ATOM 7330 CZ TYR G 62 0.271 48.825 -15.979 1.00 74.56 C
+ATOM 7331 OH TYR G 62 -0.412 48.582 -14.812 1.00 75.88 O
+ATOM 7332 H TYR G 62 3.734 50.376 -21.736 1.00 0.00 H
+ATOM 7333 HA TYR G 62 1.994 51.667 -19.682 1.00 0.00 H
+ATOM 7334 1HB TYR G 62 1.607 49.269 -20.471 1.00 0.00 H
+ATOM 7335 2HB TYR G 62 3.129 48.846 -19.745 1.00 0.00 H
+ATOM 7336 HD1 TYR G 62 -0.154 50.349 -18.950 1.00 0.00 H
+ATOM 7337 HD2 TYR G 62 3.215 48.162 -17.499 1.00 0.00 H
+ATOM 7338 HE1 TYR G 62 -1.345 49.954 -16.840 1.00 0.00 H
+ATOM 7339 HE2 TYR G 62 2.018 47.746 -15.377 1.00 0.00 H
+ATOM 7340 HH TYR G 62 0.073 47.948 -14.282 1.00 0.00 H
+ATOM 7341 N ILE G 63 3.739 52.180 -17.992 1.00 55.00 N
+ATOM 7342 CA ILE G 63 4.827 52.544 -17.105 1.00 54.43 C
+ATOM 7343 C ILE G 63 4.483 52.274 -15.627 1.00 53.75 C
+ATOM 7344 O ILE G 63 3.417 52.669 -15.138 1.00 52.33 O
+ATOM 7345 CB ILE G 63 5.167 54.027 -17.283 1.00 45.68 C
+ATOM 7346 CG1 ILE G 63 5.517 54.334 -18.738 1.00 53.86 C
+ATOM 7347 CG2 ILE G 63 6.352 54.386 -16.407 1.00 44.60 C
+ATOM 7348 CD1 ILE G 63 5.575 55.814 -19.027 1.00 37.52 C
+ATOM 7349 H ILE G 63 2.851 52.668 -17.904 1.00 0.00 H
+ATOM 7350 HA ILE G 63 5.691 51.958 -17.372 1.00 0.00 H
+ATOM 7351 HB ILE G 63 4.328 54.605 -17.025 1.00 0.00 H
+ATOM 7352 1HG1 ILE G 63 6.464 53.891 -18.973 1.00 0.00 H
+ATOM 7353 2HG1 ILE G 63 4.761 53.902 -19.390 1.00 0.00 H
+ATOM 7354 1HG2 ILE G 63 6.578 55.431 -16.538 1.00 0.00 H
+ATOM 7355 2HG2 ILE G 63 6.108 54.193 -15.370 1.00 0.00 H
+ATOM 7356 3HG2 ILE G 63 7.213 53.784 -16.694 1.00 0.00 H
+ATOM 7357 1HD1 ILE G 63 5.818 55.967 -20.070 1.00 0.00 H
+ATOM 7358 2HD1 ILE G 63 4.605 56.267 -18.815 1.00 0.00 H
+ATOM 7359 3HD1 ILE G 63 6.338 56.283 -18.406 1.00 0.00 H
+ATOM 7360 N GLN G 64 5.383 51.591 -14.920 1.00 53.33 N
+ATOM 7361 CA GLN G 64 5.180 51.313 -13.495 1.00 50.73 C
+ATOM 7362 C GLN G 64 6.227 52.081 -12.705 1.00 50.61 C
+ATOM 7363 O GLN G 64 7.427 51.978 -12.980 1.00 52.00 O
+ATOM 7364 CB GLN G 64 5.318 49.810 -13.187 1.00 37.72 C
+ATOM 7365 CG GLN G 64 4.377 48.900 -13.975 1.00 37.28 C
+ATOM 7366 CD GLN G 64 4.651 47.388 -13.790 1.00 43.00 C
+ATOM 7367 OE1 GLN G 64 5.763 46.911 -14.030 1.00 48.84 O
+ATOM 7368 NE2 GLN G 64 3.622 46.646 -13.385 1.00 43.85 N
+ATOM 7369 H GLN G 64 6.228 51.275 -15.384 1.00 0.00 H
+ATOM 7370 HA GLN G 64 4.199 51.671 -13.193 1.00 0.00 H
+ATOM 7371 1HB GLN G 64 6.321 49.487 -13.295 1.00 0.00 H
+ATOM 7372 2HB GLN G 64 5.066 49.663 -12.134 1.00 0.00 H
+ATOM 7373 1HG GLN G 64 3.361 49.088 -13.653 1.00 0.00 H
+ATOM 7374 2HG GLN G 64 4.479 49.133 -15.038 1.00 0.00 H
+ATOM 7375 1HE2 GLN G 64 3.709 45.635 -13.278 1.00 0.00 H
+ATOM 7376 2HE2 GLN G 64 2.742 47.068 -13.194 1.00 0.00 H
+ATOM 7377 N THR G 65 5.784 52.874 -11.729 1.00 51.21 N
+ATOM 7378 CA THR G 65 6.716 53.648 -10.923 1.00 53.30 C
+ATOM 7379 C THR G 65 6.404 53.456 -9.456 1.00 55.87 C
+ATOM 7380 O THR G 65 5.432 52.790 -9.079 1.00 53.60 O
+ATOM 7381 CB THR G 65 6.655 55.166 -11.194 1.00 58.52 C
+ATOM 7382 OG1 THR G 65 5.458 55.697 -10.616 1.00 52.22 O
+ATOM 7383 CG2 THR G 65 6.642 55.439 -12.685 1.00 52.81 C
+ATOM 7384 H THR G 65 4.787 52.941 -11.538 1.00 0.00 H
+ATOM 7385 HA THR G 65 7.732 53.293 -11.096 1.00 0.00 H
+ATOM 7386 HB THR G 65 7.519 55.649 -10.750 1.00 0.00 H
+ATOM 7387 HG1 THR G 65 5.353 55.330 -9.736 1.00 0.00 H
+ATOM 7388 1HG2 THR G 65 6.594 56.509 -12.855 1.00 0.00 H
+ATOM 7389 2HG2 THR G 65 7.548 55.034 -13.136 1.00 0.00 H
+ATOM 7390 3HG2 THR G 65 5.773 54.966 -13.132 1.00 0.00 H
+ATOM 7391 N ARG G 66 7.172 54.116 -8.611 1.00 56.32 N
+ATOM 7392 CA ARG G 66 6.979 54.066 -7.175 1.00 57.07 C
+ATOM 7393 C ARG G 66 5.593 54.577 -6.751 1.00 56.77 C
+ATOM 7394 O ARG G 66 5.122 54.248 -5.667 1.00 56.40 O
+ATOM 7395 CB ARG G 66 8.030 54.894 -6.445 1.00 68.24 C
+ATOM 7396 CG ARG G 66 8.114 54.598 -4.969 1.00 78.86 C
+ATOM 7397 CD ARG G 66 9.204 55.357 -4.291 1.00 86.38 C
+ATOM 7398 NE ARG G 66 8.858 56.745 -4.069 1.00 92.02 N
+ATOM 7399 CZ ARG G 66 9.732 57.704 -3.687 1.00 93.68 C
+ATOM 7400 NH1 ARG G 66 9.292 58.908 -3.442 1.00 95.71 N
+ATOM 7401 NH2 ARG G 66 11.016 57.433 -3.548 1.00 89.36 N
+ATOM 7402 H ARG G 66 7.947 54.643 -8.991 1.00 0.00 H
+ATOM 7403 HA ARG G 66 7.070 53.035 -6.843 1.00 0.00 H
+ATOM 7404 1HB ARG G 66 9.012 54.720 -6.882 1.00 0.00 H
+ATOM 7405 2HB ARG G 66 7.797 55.959 -6.548 1.00 0.00 H
+ATOM 7406 1HG ARG G 66 7.167 54.868 -4.498 1.00 0.00 H
+ATOM 7407 2HG ARG G 66 8.298 53.531 -4.828 1.00 0.00 H
+ATOM 7408 1HD ARG G 66 9.428 54.900 -3.324 1.00 0.00 H
+ATOM 7409 2HD ARG G 66 10.095 55.328 -4.912 1.00 0.00 H
+ATOM 7410 HE ARG G 66 7.884 57.004 -4.155 1.00 0.00 H
+ATOM 7411 1HH1 ARG G 66 8.318 59.107 -3.542 1.00 0.00 H
+ATOM 7412 2HH1 ARG G 66 9.933 59.641 -3.124 1.00 0.00 H
+ATOM 7413 1HH2 ARG G 66 11.387 56.509 -3.787 1.00 0.00 H
+ATOM 7414 2HH2 ARG G 66 11.661 58.149 -3.258 1.00 0.00 H
+ATOM 7415 N HIS G 67 4.977 55.434 -7.579 1.00 55.66 N
+ATOM 7416 CA HIS G 67 3.721 56.054 -7.176 1.00 53.42 C
+ATOM 7417 C HIS G 67 2.495 55.364 -7.775 1.00 53.09 C
+ATOM 7418 O HIS G 67 1.383 55.886 -7.678 1.00 54.67 O
+ATOM 7419 CB HIS G 67 3.685 57.516 -7.649 1.00 51.85 C
+ATOM 7420 CG HIS G 67 4.787 58.341 -7.124 1.00 47.99 C
+ATOM 7421 ND1 HIS G 67 5.228 58.272 -5.827 1.00 45.99 N
+ATOM 7422 CD2 HIS G 67 5.527 59.299 -7.721 1.00 45.78 C
+ATOM 7423 CE1 HIS G 67 6.205 59.137 -5.658 1.00 43.08 C
+ATOM 7424 NE2 HIS G 67 6.397 59.776 -6.789 1.00 52.28 N
+ATOM 7425 H HIS G 67 5.353 55.641 -8.496 1.00 0.00 H
+ATOM 7426 HA HIS G 67 3.629 56.036 -6.093 1.00 0.00 H
+ATOM 7427 1HB HIS G 67 3.720 57.544 -8.742 1.00 0.00 H
+ATOM 7428 2HB HIS G 67 2.747 57.970 -7.337 1.00 0.00 H
+ATOM 7429 HD2 HIS G 67 5.440 59.636 -8.742 1.00 0.00 H
+ATOM 7430 HE1 HIS G 67 6.744 59.310 -4.738 1.00 0.00 H
+ATOM 7431 HE2 HIS G 67 7.077 60.520 -6.956 1.00 0.00 H
+ATOM 7432 N GLY G 68 2.684 54.199 -8.392 1.00 51.80 N
+ATOM 7433 CA GLY G 68 1.566 53.524 -9.041 1.00 52.41 C
+ATOM 7434 C GLY G 68 1.860 53.404 -10.523 1.00 55.54 C
+ATOM 7435 O GLY G 68 3.020 53.274 -10.919 1.00 54.60 O
+ATOM 7436 H GLY G 68 3.611 53.779 -8.440 1.00 0.00 H
+ATOM 7437 1HA GLY G 68 1.429 52.536 -8.604 1.00 0.00 H
+ATOM 7438 2HA GLY G 68 0.645 54.086 -8.885 1.00 0.00 H
+ATOM 7439 N VAL G 69 0.826 53.390 -11.353 1.00 57.40 N
+ATOM 7440 CA VAL G 69 1.085 53.220 -12.775 1.00 59.85 C
+ATOM 7441 C VAL G 69 0.538 54.384 -13.575 1.00 62.05 C
+ATOM 7442 O VAL G 69 -0.359 55.100 -13.128 1.00 62.44 O
+ATOM 7443 CB VAL G 69 0.479 51.907 -13.288 1.00 61.39 C
+ATOM 7444 CG1 VAL G 69 1.103 50.748 -12.541 1.00 60.88 C
+ATOM 7445 CG2 VAL G 69 -1.025 51.924 -13.124 1.00 66.86 C
+ATOM 7446 H VAL G 69 -0.117 53.496 -11.006 1.00 0.00 H
+ATOM 7447 HA VAL G 69 2.160 53.182 -12.937 1.00 0.00 H
+ATOM 7448 HB VAL G 69 0.732 51.789 -14.347 1.00 0.00 H
+ATOM 7449 1HG1 VAL G 69 0.705 49.813 -12.913 1.00 0.00 H
+ATOM 7450 2HG1 VAL G 69 2.170 50.772 -12.685 1.00 0.00 H
+ATOM 7451 3HG1 VAL G 69 0.880 50.834 -11.483 1.00 0.00 H
+ATOM 7452 1HG2 VAL G 69 -1.439 50.988 -13.502 1.00 0.00 H
+ATOM 7453 2HG2 VAL G 69 -1.279 52.033 -12.069 1.00 0.00 H
+ATOM 7454 3HG2 VAL G 69 -1.441 52.760 -13.687 1.00 0.00 H
+ATOM 7455 N ILE G 70 1.120 54.575 -14.745 1.00 62.61 N
+ATOM 7456 CA ILE G 70 0.732 55.630 -15.661 1.00 62.73 C
+ATOM 7457 C ILE G 70 0.914 55.102 -17.081 1.00 61.14 C
+ATOM 7458 O ILE G 70 1.822 54.315 -17.339 1.00 58.48 O
+ATOM 7459 CB ILE G 70 1.602 56.892 -15.408 1.00 63.46 C
+ATOM 7460 CG1 ILE G 70 1.073 58.120 -16.164 1.00 70.83 C
+ATOM 7461 CG2 ILE G 70 3.013 56.617 -15.821 1.00 46.62 C
+ATOM 7462 CD1 ILE G 70 -0.196 58.679 -15.570 1.00 67.92 C
+ATOM 7463 H ILE G 70 1.872 53.943 -15.014 1.00 0.00 H
+ATOM 7464 HA ILE G 70 -0.318 55.874 -15.511 1.00 0.00 H
+ATOM 7465 HB ILE G 70 1.586 57.132 -14.343 1.00 0.00 H
+ATOM 7466 1HG1 ILE G 70 1.833 58.897 -16.145 1.00 0.00 H
+ATOM 7467 2HG1 ILE G 70 0.886 57.856 -17.198 1.00 0.00 H
+ATOM 7468 1HG2 ILE G 70 3.637 57.476 -15.635 1.00 0.00 H
+ATOM 7469 2HG2 ILE G 70 3.390 55.763 -15.253 1.00 0.00 H
+ATOM 7470 3HG2 ILE G 70 3.016 56.394 -16.884 1.00 0.00 H
+ATOM 7471 1HD1 ILE G 70 -0.517 59.547 -16.143 1.00 0.00 H
+ATOM 7472 2HD1 ILE G 70 -0.976 57.916 -15.595 1.00 0.00 H
+ATOM 7473 3HD1 ILE G 70 -0.013 58.976 -14.537 1.00 0.00 H
+ATOM 7474 N GLU G 71 0.058 55.512 -17.999 1.00 61.76 N
+ATOM 7475 CA GLU G 71 0.277 55.101 -19.374 1.00 61.98 C
+ATOM 7476 C GLU G 71 0.647 56.298 -20.221 1.00 62.92 C
+ATOM 7477 O GLU G 71 0.026 57.361 -20.118 1.00 62.69 O
+ATOM 7478 CB GLU G 71 -0.958 54.413 -19.957 1.00 57.10 C
+ATOM 7479 CG GLU G 71 -1.302 53.106 -19.279 1.00 62.22 C
+ATOM 7480 CD GLU G 71 -2.457 52.379 -19.919 1.00 73.41 C
+ATOM 7481 OE1 GLU G 71 -3.018 52.894 -20.855 1.00 81.37 O
+ATOM 7482 OE2 GLU G 71 -2.773 51.302 -19.470 1.00 78.73 O
+ATOM 7483 H GLU G 71 -0.705 56.123 -17.752 1.00 0.00 H
+ATOM 7484 HA GLU G 71 1.110 54.396 -19.413 1.00 0.00 H
+ATOM 7485 1HB GLU G 71 -1.819 55.076 -19.881 1.00 0.00 H
+ATOM 7486 2HB GLU G 71 -0.794 54.208 -21.017 1.00 0.00 H
+ATOM 7487 1HG GLU G 71 -0.422 52.481 -19.313 1.00 0.00 H
+ATOM 7488 2HG GLU G 71 -1.537 53.300 -18.234 1.00 0.00 H
+ATOM 7489 N SER G 72 1.632 56.096 -21.082 1.00 63.74 N
+ATOM 7490 CA SER G 72 2.070 57.113 -22.023 1.00 64.47 C
+ATOM 7491 C SER G 72 1.390 56.859 -23.348 1.00 64.92 C
+ATOM 7492 O SER G 72 0.946 55.732 -23.596 1.00 63.77 O
+ATOM 7493 CB SER G 72 3.577 57.080 -22.126 1.00 56.37 C
+ATOM 7494 OG SER G 72 4.005 55.828 -22.538 1.00 57.24 O
+ATOM 7495 H SER G 72 2.087 55.186 -21.102 1.00 0.00 H
+ATOM 7496 HA SER G 72 1.762 58.093 -21.664 1.00 0.00 H
+ATOM 7497 1HB SER G 72 3.913 57.838 -22.840 1.00 0.00 H
+ATOM 7498 2HB SER G 72 4.018 57.316 -21.169 1.00 0.00 H
+ATOM 7499 HG SER G 72 3.629 55.203 -21.899 1.00 0.00 H
+ATOM 7500 N GLU G 73 1.312 57.889 -24.194 1.00 68.06 N
+ATOM 7501 CA GLU G 73 0.652 57.762 -25.486 1.00 71.21 C
+ATOM 7502 C GLU G 73 1.503 58.367 -26.611 1.00 71.64 C
+ATOM 7503 O GLU G 73 2.704 58.601 -26.449 1.00 71.98 O
+ATOM 7504 OXT GLU G 73 1.014 58.461 -27.735 1.00 0.00 O
+ATOM 7505 CB GLU G 73 -0.729 58.445 -25.423 1.00 73.65 C
+ATOM 7506 CG GLU G 73 -1.657 57.895 -24.314 1.00 74.37 C
+ATOM 7507 CD GLU G 73 -2.990 58.599 -24.215 1.00 87.55 C
+ATOM 7508 OE1 GLU G 73 -3.594 58.536 -23.164 1.00 93.37 O
+ATOM 7509 OE2 GLU G 73 -3.399 59.200 -25.167 1.00 91.64 O
+ATOM 7510 H GLU G 73 1.708 58.786 -23.921 1.00 0.00 H
+ATOM 7511 HA GLU G 73 0.502 56.707 -25.700 1.00 0.00 H
+ATOM 7512 1HB GLU G 73 -0.615 59.499 -25.272 1.00 0.00 H
+ATOM 7513 2HB GLU G 73 -1.246 58.307 -26.374 1.00 0.00 H
+ATOM 7514 1HG GLU G 73 -1.828 56.835 -24.490 1.00 0.00 H
+ATOM 7515 2HG GLU G 73 -1.151 57.997 -23.357 1.00 0.00 H
+TER
+ATOM 7517 N SER I 7 14.332 64.657 1.657 1.00 81.24 N
+ATOM 7518 CA SER I 7 13.762 65.868 2.231 1.00 80.20 C
+ATOM 7519 C SER I 7 12.314 66.045 1.796 1.00 79.65 C
+ATOM 7520 O SER I 7 12.007 66.057 0.605 1.00 80.14 O
+ATOM 7521 CB SER I 7 14.575 67.089 1.835 1.00 76.44 C
+ATOM 7522 OG SER I 7 13.939 68.277 2.253 1.00 83.32 O
+ATOM 7523 1H SER I 7 15.077 64.316 2.246 1.00 0.00 H
+ATOM 7524 2H SER I 7 13.608 63.954 1.593 1.00 0.00 H
+ATOM 7525 3H SER I 7 14.694 64.848 0.736 1.00 0.00 H
+ATOM 7526 HA SER I 7 13.779 65.780 3.318 1.00 0.00 H
+ATOM 7527 1HB SER I 7 15.554 67.030 2.298 1.00 0.00 H
+ATOM 7528 2HB SER I 7 14.716 67.098 0.753 1.00 0.00 H
+ATOM 7529 HG SER I 7 14.415 69.016 1.838 1.00 0.00 H
+ATOM 7530 N ASP I 8 11.431 66.186 2.773 1.00 77.42 N
+ATOM 7531 CA ASP I 8 10.012 66.352 2.480 1.00 75.38 C
+ATOM 7532 C ASP I 8 9.700 67.589 1.654 1.00 73.63 C
+ATOM 7533 O ASP I 8 10.401 68.605 1.714 1.00 72.68 O
+ATOM 7534 CB ASP I 8 9.158 66.314 3.754 1.00 76.79 C
+ATOM 7535 CG ASP I 8 8.965 64.872 4.265 1.00 76.50 C
+ATOM 7536 OD1 ASP I 8 9.368 63.967 3.564 1.00 68.52 O
+ATOM 7537 OD2 ASP I 8 8.394 64.680 5.301 1.00 73.95 O
+ATOM 7538 H ASP I 8 11.742 66.180 3.734 1.00 0.00 H
+ATOM 7539 HA ASP I 8 9.708 65.493 1.883 1.00 0.00 H
+ATOM 7540 1HB ASP I 8 9.641 66.896 4.545 1.00 0.00 H
+ATOM 7541 2HB ASP I 8 8.180 66.769 3.560 1.00 0.00 H
+ATOM 7542 N PHE I 9 8.620 67.459 0.891 1.00 71.39 N
+ATOM 7543 CA PHE I 9 8.111 68.491 0.011 1.00 70.71 C
+ATOM 7544 C PHE I 9 6.612 68.554 0.116 1.00 70.33 C
+ATOM 7545 O PHE I 9 5.988 67.645 0.666 1.00 67.72 O
+ATOM 7546 CB PHE I 9 8.467 68.201 -1.456 1.00 71.53 C
+ATOM 7547 CG PHE I 9 7.850 66.974 -2.043 1.00 74.87 C
+ATOM 7548 CD1 PHE I 9 6.617 67.052 -2.660 1.00 73.13 C
+ATOM 7549 CD2 PHE I 9 8.510 65.755 -2.032 1.00 77.33 C
+ATOM 7550 CE1 PHE I 9 6.041 65.952 -3.245 1.00 78.45 C
+ATOM 7551 CE2 PHE I 9 7.932 64.648 -2.623 1.00 83.10 C
+ATOM 7552 CZ PHE I 9 6.696 64.756 -3.231 1.00 82.37 C
+ATOM 7553 H PHE I 9 8.129 66.580 0.919 1.00 0.00 H
+ATOM 7554 HA PHE I 9 8.513 69.453 0.318 1.00 0.00 H
+ATOM 7555 1HB PHE I 9 8.159 69.030 -2.075 1.00 0.00 H
+ATOM 7556 2HB PHE I 9 9.521 68.109 -1.549 1.00 0.00 H
+ATOM 7557 HD1 PHE I 9 6.099 68.009 -2.674 1.00 0.00 H
+ATOM 7558 HD2 PHE I 9 9.494 65.675 -1.559 1.00 0.00 H
+ATOM 7559 HE1 PHE I 9 5.068 66.039 -3.723 1.00 0.00 H
+ATOM 7560 HE2 PHE I 9 8.451 63.690 -2.615 1.00 0.00 H
+ATOM 7561 HZ PHE I 9 6.248 63.897 -3.697 1.00 0.00 H
+ATOM 7562 N VAL I 10 6.045 69.632 -0.404 1.00 70.85 N
+ATOM 7563 CA VAL I 10 4.604 69.804 -0.398 1.00 71.48 C
+ATOM 7564 C VAL I 10 4.106 70.057 -1.815 1.00 71.94 C
+ATOM 7565 O VAL I 10 4.851 70.553 -2.662 1.00 72.11 O
+ATOM 7566 CB VAL I 10 4.251 70.999 0.505 1.00 67.15 C
+ATOM 7567 CG1 VAL I 10 4.766 70.738 1.925 1.00 70.24 C
+ATOM 7568 CG2 VAL I 10 4.864 72.273 -0.067 1.00 53.40 C
+ATOM 7569 H VAL I 10 6.648 70.346 -0.806 1.00 0.00 H
+ATOM 7570 HA VAL I 10 4.135 68.899 -0.015 1.00 0.00 H
+ATOM 7571 HB VAL I 10 3.162 71.106 0.559 1.00 0.00 H
+ATOM 7572 1HG1 VAL I 10 4.523 71.572 2.552 1.00 0.00 H
+ATOM 7573 2HG1 VAL I 10 4.312 69.829 2.322 1.00 0.00 H
+ATOM 7574 3HG1 VAL I 10 5.846 70.623 1.903 1.00 0.00 H
+ATOM 7575 1HG2 VAL I 10 4.609 73.119 0.571 1.00 0.00 H
+ATOM 7576 2HG2 VAL I 10 5.949 72.167 -0.115 1.00 0.00 H
+ATOM 7577 3HG2 VAL I 10 4.469 72.444 -1.071 1.00 0.00 H
+ATOM 7578 N VAL I 11 2.837 69.731 -2.069 1.00 72.83 N
+ATOM 7579 CA VAL I 11 2.243 69.991 -3.384 1.00 73.44 C
+ATOM 7580 C VAL I 11 1.145 71.023 -3.250 1.00 75.71 C
+ATOM 7581 O VAL I 11 0.196 70.821 -2.501 1.00 76.10 O
+ATOM 7582 CB VAL I 11 1.618 68.723 -3.984 1.00 75.17 C
+ATOM 7583 CG1 VAL I 11 1.006 69.044 -5.330 1.00 68.14 C
+ATOM 7584 CG2 VAL I 11 2.644 67.620 -4.080 1.00 82.23 C
+ATOM 7585 H VAL I 11 2.279 69.307 -1.330 1.00 0.00 H
+ATOM 7586 HA VAL I 11 3.008 70.373 -4.058 1.00 0.00 H
+ATOM 7587 HB VAL I 11 0.820 68.407 -3.362 1.00 0.00 H
+ATOM 7588 1HG1 VAL I 11 0.543 68.145 -5.725 1.00 0.00 H
+ATOM 7589 2HG1 VAL I 11 0.252 69.821 -5.205 1.00 0.00 H
+ATOM 7590 3HG1 VAL I 11 1.761 69.393 -6.014 1.00 0.00 H
+ATOM 7591 1HG2 VAL I 11 2.168 66.728 -4.488 1.00 0.00 H
+ATOM 7592 2HG2 VAL I 11 3.438 67.920 -4.719 1.00 0.00 H
+ATOM 7593 3HG2 VAL I 11 3.038 67.402 -3.100 1.00 0.00 H
+ATOM 7594 N ILE I 12 1.278 72.135 -3.962 1.00 76.75 N
+ATOM 7595 CA ILE I 12 0.303 73.207 -3.846 1.00 75.49 C
+ATOM 7596 C ILE I 12 -0.363 73.558 -5.179 1.00 75.41 C
+ATOM 7597 O ILE I 12 0.308 73.868 -6.161 1.00 73.89 O
+ATOM 7598 CB ILE I 12 1.001 74.454 -3.277 1.00 67.43 C
+ATOM 7599 CG1 ILE I 12 1.598 74.113 -1.891 1.00 65.93 C
+ATOM 7600 CG2 ILE I 12 -0.017 75.599 -3.159 1.00 72.28 C
+ATOM 7601 CD1 ILE I 12 2.544 75.118 -1.380 1.00 64.45 C
+ATOM 7602 H ILE I 12 2.083 72.254 -4.561 1.00 0.00 H
+ATOM 7603 HA ILE I 12 -0.470 72.899 -3.154 1.00 0.00 H
+ATOM 7604 HB ILE I 12 1.820 74.750 -3.931 1.00 0.00 H
+ATOM 7605 1HG1 ILE I 12 0.787 74.028 -1.189 1.00 0.00 H
+ATOM 7606 2HG1 ILE I 12 2.123 73.169 -1.937 1.00 0.00 H
+ATOM 7607 1HG2 ILE I 12 0.464 76.479 -2.752 1.00 0.00 H
+ATOM 7608 2HG2 ILE I 12 -0.421 75.831 -4.144 1.00 0.00 H
+ATOM 7609 3HG2 ILE I 12 -0.826 75.296 -2.504 1.00 0.00 H
+ATOM 7610 1HD1 ILE I 12 2.907 74.818 -0.397 1.00 0.00 H
+ATOM 7611 2HD1 ILE I 12 3.384 75.209 -2.065 1.00 0.00 H
+ATOM 7612 3HD1 ILE I 12 2.037 76.049 -1.310 1.00 0.00 H
+ATOM 7613 N LYS I 13 -1.699 73.525 -5.196 1.00 75.75 N
+ATOM 7614 CA LYS I 13 -2.462 73.885 -6.392 1.00 77.79 C
+ATOM 7615 C LYS I 13 -3.265 75.158 -6.218 1.00 79.60 C
+ATOM 7616 O LYS I 13 -4.046 75.310 -5.277 1.00 79.43 O
+ATOM 7617 CB LYS I 13 -3.407 72.776 -6.806 1.00 68.69 C
+ATOM 7618 CG LYS I 13 -4.261 73.121 -8.020 1.00 66.14 C
+ATOM 7619 CD LYS I 13 -5.173 71.976 -8.409 1.00 61.85 C
+ATOM 7620 CE LYS I 13 -6.129 72.401 -9.517 1.00 67.75 C
+ATOM 7621 NZ LYS I 13 -7.072 71.321 -9.876 1.00 61.78 N
+ATOM 7622 H LYS I 13 -2.192 73.232 -4.358 1.00 0.00 H
+ATOM 7623 HA LYS I 13 -1.764 74.052 -7.208 1.00 0.00 H
+ATOM 7624 1HB LYS I 13 -2.819 71.925 -7.069 1.00 0.00 H
+ATOM 7625 2HB LYS I 13 -4.049 72.505 -5.984 1.00 0.00 H
+ATOM 7626 1HG LYS I 13 -4.877 73.995 -7.798 1.00 0.00 H
+ATOM 7627 2HG LYS I 13 -3.612 73.367 -8.865 1.00 0.00 H
+ATOM 7628 1HD LYS I 13 -4.566 71.139 -8.772 1.00 0.00 H
+ATOM 7629 2HD LYS I 13 -5.745 71.642 -7.544 1.00 0.00 H
+ATOM 7630 1HE LYS I 13 -6.694 73.270 -9.182 1.00 0.00 H
+ATOM 7631 2HE LYS I 13 -5.551 72.673 -10.405 1.00 0.00 H
+ATOM 7632 1HZ LYS I 13 -7.697 71.635 -10.613 1.00 0.00 H
+ATOM 7633 2HZ LYS I 13 -6.534 70.515 -10.203 1.00 0.00 H
+ATOM 7634 3HZ LYS I 13 -7.616 71.063 -9.068 1.00 0.00 H
+ATOM 7635 N ALA I 14 -3.081 76.088 -7.146 1.00 81.05 N
+ATOM 7636 CA ALA I 14 -3.807 77.344 -7.049 1.00 80.94 C
+ATOM 7637 C ALA I 14 -5.280 77.156 -7.371 1.00 80.88 C
+ATOM 7638 O ALA I 14 -5.638 76.718 -8.469 1.00 80.12 O
+ATOM 7639 CB ALA I 14 -3.212 78.357 -8.001 1.00 74.62 C
+ATOM 7640 H ALA I 14 -2.430 75.922 -7.916 1.00 0.00 H
+ATOM 7641 HA ALA I 14 -3.725 77.698 -6.027 1.00 0.00 H
+ATOM 7642 1HB ALA I 14 -3.742 79.304 -7.921 1.00 0.00 H
+ATOM 7643 2HB ALA I 14 -2.176 78.502 -7.761 1.00 0.00 H
+ATOM 7644 3HB ALA I 14 -3.302 77.978 -9.008 1.00 0.00 H
+ATOM 7645 N LEU I 15 -6.155 77.541 -6.442 1.00 82.10 N
+ATOM 7646 CA LEU I 15 -7.581 77.416 -6.713 1.00 82.80 C
+ATOM 7647 C LEU I 15 -8.136 78.724 -7.273 1.00 82.69 C
+ATOM 7648 O LEU I 15 -9.290 78.789 -7.715 1.00 82.35 O
+ATOM 7649 CB LEU I 15 -8.329 76.970 -5.454 1.00 86.72 C
+ATOM 7650 CG LEU I 15 -7.934 75.569 -4.930 1.00 95.01 C
+ATOM 7651 CD1 LEU I 15 -8.677 75.284 -3.617 1.00 91.98 C
+ATOM 7652 CD2 LEU I 15 -8.241 74.535 -5.989 1.00 94.15 C
+ATOM 7653 H LEU I 15 -5.852 77.910 -5.540 1.00 0.00 H
+ATOM 7654 HA LEU I 15 -7.720 76.644 -7.466 1.00 0.00 H
+ATOM 7655 1HB LEU I 15 -8.132 77.686 -4.671 1.00 0.00 H
+ATOM 7656 2HB LEU I 15 -9.395 76.966 -5.659 1.00 0.00 H
+ATOM 7657 HG LEU I 15 -6.886 75.538 -4.740 1.00 0.00 H
+ATOM 7658 1HD1 LEU I 15 -8.393 74.302 -3.238 1.00 0.00 H
+ATOM 7659 2HD1 LEU I 15 -8.418 76.041 -2.875 1.00 0.00 H
+ATOM 7660 3HD1 LEU I 15 -9.751 75.305 -3.792 1.00 0.00 H
+ATOM 7661 1HD2 LEU I 15 -7.951 73.547 -5.632 1.00 0.00 H
+ATOM 7662 2HD2 LEU I 15 -9.309 74.544 -6.207 1.00 0.00 H
+ATOM 7663 3HD2 LEU I 15 -7.681 74.771 -6.896 1.00 0.00 H
+ATOM 7664 N GLU I 16 -7.279 79.746 -7.309 1.00 81.62 N
+ATOM 7665 CA GLU I 16 -7.610 81.068 -7.840 1.00 83.68 C
+ATOM 7666 C GLU I 16 -6.355 81.782 -8.331 1.00 85.25 C
+ATOM 7667 O GLU I 16 -5.243 81.419 -7.964 1.00 85.78 O
+ATOM 7668 CB GLU I 16 -8.325 81.928 -6.791 1.00 84.77 C
+ATOM 7669 CG GLU I 16 -7.511 82.264 -5.544 1.00 92.47 C
+ATOM 7670 CD GLU I 16 -8.318 83.068 -4.536 1.00 96.66 C
+ATOM 7671 OE1 GLU I 16 -9.427 83.445 -4.853 1.00 97.27 O
+ATOM 7672 OE2 GLU I 16 -7.848 83.253 -3.428 1.00 98.07 O
+ATOM 7673 H GLU I 16 -6.354 79.592 -6.934 1.00 0.00 H
+ATOM 7674 HA GLU I 16 -8.275 80.945 -8.691 1.00 0.00 H
+ATOM 7675 1HB GLU I 16 -8.627 82.873 -7.247 1.00 0.00 H
+ATOM 7676 2HB GLU I 16 -9.230 81.420 -6.461 1.00 0.00 H
+ATOM 7677 1HG GLU I 16 -7.157 81.345 -5.081 1.00 0.00 H
+ATOM 7678 2HG GLU I 16 -6.635 82.842 -5.846 1.00 0.00 H
+ATOM 7679 N ASP I 17 -6.518 82.787 -9.180 1.00 84.43 N
+ATOM 7680 CA ASP I 17 -5.359 83.585 -9.567 1.00 84.41 C
+ATOM 7681 C ASP I 17 -4.803 84.318 -8.344 1.00 84.63 C
+ATOM 7682 O ASP I 17 -5.574 84.921 -7.599 1.00 84.91 O
+ATOM 7683 CB ASP I 17 -5.741 84.636 -10.619 1.00 90.85 C
+ATOM 7684 CG ASP I 17 -6.075 84.089 -12.014 1.00 96.00 C
+ATOM 7685 OD1 ASP I 17 -5.774 82.948 -12.307 1.00 95.56 O
+ATOM 7686 OD2 ASP I 17 -6.647 84.832 -12.778 1.00 98.11 O
+ATOM 7687 H ASP I 17 -7.442 83.035 -9.502 1.00 0.00 H
+ATOM 7688 HA ASP I 17 -4.589 82.927 -9.954 1.00 0.00 H
+ATOM 7689 1HB ASP I 17 -6.591 85.217 -10.260 1.00 0.00 H
+ATOM 7690 2HB ASP I 17 -4.905 85.329 -10.729 1.00 0.00 H
+ATOM 7691 N GLY I 18 -3.479 84.369 -8.191 1.00 84.51 N
+ATOM 7692 CA GLY I 18 -2.900 85.160 -7.098 1.00 84.11 C
+ATOM 7693 C GLY I 18 -2.484 84.346 -5.872 1.00 83.93 C
+ATOM 7694 O GLY I 18 -2.312 84.895 -4.781 1.00 84.12 O
+ATOM 7695 H GLY I 18 -2.865 83.822 -8.796 1.00 0.00 H
+ATOM 7696 1HA GLY I 18 -2.026 85.680 -7.479 1.00 0.00 H
+ATOM 7697 2HA GLY I 18 -3.610 85.928 -6.795 1.00 0.00 H
+ATOM 7698 N VAL I 19 -2.347 83.044 -6.047 1.00 82.94 N
+ATOM 7699 CA VAL I 19 -1.907 82.173 -4.964 1.00 82.30 C
+ATOM 7700 C VAL I 19 -0.419 82.360 -4.767 1.00 82.10 C
+ATOM 7701 O VAL I 19 0.327 82.466 -5.735 1.00 81.00 O
+ATOM 7702 CB VAL I 19 -2.316 80.731 -5.248 1.00 87.23 C
+ATOM 7703 CG1 VAL I 19 -1.688 79.761 -4.253 1.00 88.20 C
+ATOM 7704 CG2 VAL I 19 -3.818 80.680 -5.114 1.00 88.21 C
+ATOM 7705 H VAL I 19 -2.484 82.658 -6.976 1.00 0.00 H
+ATOM 7706 HA VAL I 19 -2.418 82.475 -4.049 1.00 0.00 H
+ATOM 7707 HB VAL I 19 -2.024 80.461 -6.245 1.00 0.00 H
+ATOM 7708 1HG1 VAL I 19 -2.018 78.750 -4.474 1.00 0.00 H
+ATOM 7709 2HG1 VAL I 19 -0.602 79.809 -4.333 1.00 0.00 H
+ATOM 7710 3HG1 VAL I 19 -1.992 80.030 -3.243 1.00 0.00 H
+ATOM 7711 1HG2 VAL I 19 -4.179 79.702 -5.317 1.00 0.00 H
+ATOM 7712 2HG2 VAL I 19 -4.092 80.961 -4.099 1.00 0.00 H
+ATOM 7713 3HG2 VAL I 19 -4.266 81.375 -5.803 1.00 0.00 H
+ATOM 7714 N ASN I 20 0.014 82.478 -3.524 1.00 81.56 N
+ATOM 7715 CA ASN I 20 1.419 82.782 -3.287 1.00 81.99 C
+ATOM 7716 C ASN I 20 2.100 81.855 -2.305 1.00 81.61 C
+ATOM 7717 O ASN I 20 1.718 81.775 -1.136 1.00 81.52 O
+ATOM 7718 CB ASN I 20 1.598 84.219 -2.849 1.00 88.83 C
+ATOM 7719 CG ASN I 20 3.032 84.612 -2.776 1.00 97.31 C
+ATOM 7720 OD1 ASN I 20 3.921 83.770 -2.847 1.00 99.53 O
+ATOM 7721 ND2 ASN I 20 3.286 85.882 -2.639 1.00 97.85 N
+ATOM 7722 H ASN I 20 -0.643 82.356 -2.756 1.00 0.00 H
+ATOM 7723 HA ASN I 20 1.946 82.667 -4.228 1.00 0.00 H
+ATOM 7724 1HB ASN I 20 1.081 84.880 -3.545 1.00 0.00 H
+ATOM 7725 2HB ASN I 20 1.166 84.356 -1.875 1.00 0.00 H
+ATOM 7726 1HD2 ASN I 20 4.226 86.185 -2.619 1.00 0.00 H
+ATOM 7727 2HD2 ASN I 20 2.558 86.545 -2.595 1.00 0.00 H
+ATOM 7728 N VAL I 21 3.074 81.107 -2.807 1.00 80.49 N
+ATOM 7729 CA VAL I 21 3.818 80.185 -1.969 1.00 79.52 C
+ATOM 7730 C VAL I 21 5.126 80.872 -1.577 1.00 78.52 C
+ATOM 7731 O VAL I 21 5.923 81.272 -2.429 1.00 78.96 O
+ATOM 7732 CB VAL I 21 4.053 78.872 -2.706 1.00 73.90 C
+ATOM 7733 CG1 VAL I 21 4.834 77.934 -1.834 1.00 70.56 C
+ATOM 7734 CG2 VAL I 21 2.703 78.293 -3.070 1.00 68.12 C
+ATOM 7735 H VAL I 21 3.335 81.235 -3.784 1.00 0.00 H
+ATOM 7736 HA VAL I 21 3.246 79.974 -1.067 1.00 0.00 H
+ATOM 7737 HB VAL I 21 4.636 79.056 -3.607 1.00 0.00 H
+ATOM 7738 1HG1 VAL I 21 5.003 76.997 -2.353 1.00 0.00 H
+ATOM 7739 2HG1 VAL I 21 5.795 78.385 -1.577 1.00 0.00 H
+ATOM 7740 3HG1 VAL I 21 4.262 77.753 -0.932 1.00 0.00 H
+ATOM 7741 1HG2 VAL I 21 2.830 77.354 -3.601 1.00 0.00 H
+ATOM 7742 2HG2 VAL I 21 2.139 78.131 -2.165 1.00 0.00 H
+ATOM 7743 3HG2 VAL I 21 2.169 78.994 -3.697 1.00 0.00 H
+ATOM 7744 N ILE I 22 5.304 81.066 -0.279 1.00 77.27 N
+ATOM 7745 CA ILE I 22 6.388 81.884 0.227 1.00 76.13 C
+ATOM 7746 C ILE I 22 7.430 81.091 1.005 1.00 74.49 C
+ATOM 7747 O ILE I 22 7.109 80.334 1.922 1.00 73.12 O
+ATOM 7748 CB ILE I 22 5.788 82.987 1.117 1.00 74.62 C
+ATOM 7749 CG1 ILE I 22 4.807 83.823 0.293 1.00 74.36 C
+ATOM 7750 CG2 ILE I 22 6.884 83.867 1.682 1.00 68.00 C
+ATOM 7751 CD1 ILE I 22 3.959 84.759 1.110 1.00 79.59 C
+ATOM 7752 H ILE I 22 4.633 80.687 0.372 1.00 0.00 H
+ATOM 7753 HA ILE I 22 6.875 82.354 -0.617 1.00 0.00 H
+ATOM 7754 HB ILE I 22 5.234 82.539 1.904 1.00 0.00 H
+ATOM 7755 1HG1 ILE I 22 5.368 84.399 -0.439 1.00 0.00 H
+ATOM 7756 2HG1 ILE I 22 4.131 83.154 -0.236 1.00 0.00 H
+ATOM 7757 1HG2 ILE I 22 6.445 84.645 2.302 1.00 0.00 H
+ATOM 7758 2HG2 ILE I 22 7.568 83.272 2.278 1.00 0.00 H
+ATOM 7759 3HG2 ILE I 22 7.426 84.322 0.851 1.00 0.00 H
+ATOM 7760 1HD1 ILE I 22 3.289 85.305 0.448 1.00 0.00 H
+ATOM 7761 2HD1 ILE I 22 3.371 84.183 1.829 1.00 0.00 H
+ATOM 7762 3HD1 ILE I 22 4.598 85.459 1.640 1.00 0.00 H
+ATOM 7763 N GLY I 23 8.695 81.254 0.618 1.00 74.37 N
+ATOM 7764 CA GLY I 23 9.786 80.576 1.314 1.00 74.15 C
+ATOM 7765 C GLY I 23 10.333 81.458 2.431 1.00 74.59 C
+ATOM 7766 O GLY I 23 10.710 82.612 2.187 1.00 75.26 O
+ATOM 7767 H GLY I 23 8.890 81.899 -0.143 1.00 0.00 H
+ATOM 7768 1HA GLY I 23 9.431 79.631 1.728 1.00 0.00 H
+ATOM 7769 2HA GLY I 23 10.581 80.344 0.606 1.00 0.00 H
+ATOM 7770 N LEU I 24 10.416 80.880 3.642 1.00 75.01 N
+ATOM 7771 CA LEU I 24 10.918 81.551 4.851 1.00 76.44 C
+ATOM 7772 C LEU I 24 12.317 81.059 5.212 1.00 77.14 C
+ATOM 7773 O LEU I 24 12.555 79.840 5.298 1.00 77.51 O
+ATOM 7774 CB LEU I 24 9.982 81.277 6.024 1.00 76.39 C
+ATOM 7775 CG LEU I 24 8.642 82.045 6.051 1.00 80.06 C
+ATOM 7776 CD1 LEU I 24 7.709 81.540 4.949 1.00 74.99 C
+ATOM 7777 CD2 LEU I 24 7.991 81.845 7.391 1.00 77.73 C
+ATOM 7778 H LEU I 24 10.062 79.931 3.745 1.00 0.00 H
+ATOM 7779 HA LEU I 24 10.964 82.618 4.673 1.00 0.00 H
+ATOM 7780 1HB LEU I 24 9.756 80.233 6.008 1.00 0.00 H
+ATOM 7781 2HB LEU I 24 10.514 81.501 6.946 1.00 0.00 H
+ATOM 7782 HG LEU I 24 8.828 83.107 5.884 1.00 0.00 H
+ATOM 7783 1HD1 LEU I 24 6.778 82.098 4.990 1.00 0.00 H
+ATOM 7784 2HD1 LEU I 24 8.158 81.684 3.989 1.00 0.00 H
+ATOM 7785 3HD1 LEU I 24 7.503 80.479 5.095 1.00 0.00 H
+ATOM 7786 1HD2 LEU I 24 7.056 82.389 7.408 1.00 0.00 H
+ATOM 7787 2HD2 LEU I 24 7.794 80.796 7.553 1.00 0.00 H
+ATOM 7788 3HD2 LEU I 24 8.645 82.220 8.180 1.00 0.00 H
+ATOM 7789 N THR I 25 13.230 82.015 5.456 1.00 77.31 N
+ATOM 7790 CA THR I 25 14.644 81.692 5.636 1.00 77.38 C
+ATOM 7791 C THR I 25 14.959 80.815 6.829 1.00 78.12 C
+ATOM 7792 O THR I 25 14.404 80.973 7.914 1.00 79.29 O
+ATOM 7793 CB THR I 25 15.517 82.976 5.758 1.00 80.81 C
+ATOM 7794 OG1 THR I 25 15.080 83.798 6.852 1.00 86.28 O
+ATOM 7795 CG2 THR I 25 15.439 83.780 4.506 1.00 79.58 C
+ATOM 7796 H THR I 25 12.943 82.986 5.424 1.00 0.00 H
+ATOM 7797 HA THR I 25 14.966 81.176 4.747 1.00 0.00 H
+ATOM 7798 HB THR I 25 16.555 82.691 5.925 1.00 0.00 H
+ATOM 7799 HG1 THR I 25 15.715 83.750 7.616 1.00 0.00 H
+ATOM 7800 1HG2 THR I 25 16.063 84.668 4.604 1.00 0.00 H
+ATOM 7801 2HG2 THR I 25 15.793 83.176 3.679 1.00 0.00 H
+ATOM 7802 3HG2 THR I 25 14.420 84.077 4.327 1.00 0.00 H
+ATOM 7803 N ARG I 26 15.914 79.915 6.603 1.00 79.01 N
+ATOM 7804 CA ARG I 26 16.437 79.029 7.634 1.00 79.81 C
+ATOM 7805 C ARG I 26 17.507 79.725 8.462 1.00 79.81 C
+ATOM 7806 O ARG I 26 18.407 80.363 7.916 1.00 79.92 O
+ATOM 7807 CB ARG I 26 17.019 77.756 7.023 1.00 78.10 C
+ATOM 7808 CG ARG I 26 17.468 76.696 8.051 1.00 78.38 C
+ATOM 7809 CD ARG I 26 18.037 75.472 7.408 1.00 79.15 C
+ATOM 7810 NE ARG I 26 17.080 74.799 6.533 1.00 66.28 N
+ATOM 7811 CZ ARG I 26 16.132 73.939 6.940 1.00 68.22 C
+ATOM 7812 NH1 ARG I 26 16.007 73.643 8.207 1.00 67.31 N
+ATOM 7813 NH2 ARG I 26 15.335 73.398 6.049 1.00 66.49 N
+ATOM 7814 H ARG I 26 16.265 79.837 5.653 1.00 0.00 H
+ATOM 7815 HA ARG I 26 15.620 78.757 8.299 1.00 0.00 H
+ATOM 7816 1HB ARG I 26 16.278 77.295 6.369 1.00 0.00 H
+ATOM 7817 2HB ARG I 26 17.883 78.005 6.405 1.00 0.00 H
+ATOM 7818 1HG ARG I 26 18.253 77.118 8.678 1.00 0.00 H
+ATOM 7819 2HG ARG I 26 16.627 76.405 8.675 1.00 0.00 H
+ATOM 7820 1HD ARG I 26 18.909 75.740 6.823 1.00 0.00 H
+ATOM 7821 2HD ARG I 26 18.333 74.769 8.185 1.00 0.00 H
+ATOM 7822 HE ARG I 26 17.131 74.988 5.527 1.00 0.00 H
+ATOM 7823 1HH1 ARG I 26 16.630 74.055 8.878 1.00 0.00 H
+ATOM 7824 2HH1 ARG I 26 15.292 72.991 8.504 1.00 0.00 H
+ATOM 7825 1HH2 ARG I 26 15.469 73.638 5.061 1.00 0.00 H
+ATOM 7826 2HH2 ARG I 26 14.593 72.751 6.329 1.00 0.00 H
+ATOM 7827 N GLY I 27 17.420 79.591 9.780 1.00 79.84 N
+ATOM 7828 CA GLY I 27 18.410 80.192 10.664 1.00 79.26 C
+ATOM 7829 C GLY I 27 17.760 81.088 11.705 1.00 79.35 C
+ATOM 7830 O GLY I 27 16.541 81.220 11.756 1.00 78.07 O
+ATOM 7831 H GLY I 27 16.652 79.068 10.178 1.00 0.00 H
+ATOM 7832 1HA GLY I 27 18.977 79.407 11.160 1.00 0.00 H
+ATOM 7833 2HA GLY I 27 19.118 80.773 10.075 1.00 0.00 H
+ATOM 7834 N ALA I 28 18.593 81.705 12.542 1.00 80.35 N
+ATOM 7835 CA ALA I 28 18.112 82.576 13.616 1.00 82.12 C
+ATOM 7836 C ALA I 28 17.307 83.757 13.064 1.00 82.31 C
+ATOM 7837 O ALA I 28 16.361 84.224 13.704 1.00 82.05 O
+ATOM 7838 CB ALA I 28 19.296 83.090 14.423 1.00 77.61 C
+ATOM 7839 H ALA I 28 19.583 81.550 12.441 1.00 0.00 H
+ATOM 7840 HA ALA I 28 17.464 81.993 14.266 1.00 0.00 H
+ATOM 7841 1HB ALA I 28 18.931 83.716 15.235 1.00 0.00 H
+ATOM 7842 2HB ALA I 28 19.849 82.247 14.836 1.00 0.00 H
+ATOM 7843 3HB ALA I 28 19.954 83.678 13.779 1.00 0.00 H
+ATOM 7844 N ASP I 29 17.678 84.239 11.881 1.00 81.72 N
+ATOM 7845 CA ASP I 29 17.008 85.376 11.262 1.00 83.46 C
+ATOM 7846 C ASP I 29 16.009 84.908 10.200 1.00 83.70 C
+ATOM 7847 O ASP I 29 16.387 84.571 9.072 1.00 84.40 O
+ATOM 7848 CB ASP I 29 18.033 86.328 10.644 1.00 90.43 C
+ATOM 7849 CG ASP I 29 18.919 87.011 11.703 1.00 92.69 C
+ATOM 7850 OD1 ASP I 29 18.387 87.534 12.652 1.00 90.41 O
+ATOM 7851 OD2 ASP I 29 20.117 86.981 11.553 1.00 94.01 O
+ATOM 7852 H ASP I 29 18.449 83.800 11.400 1.00 0.00 H
+ATOM 7853 HA ASP I 29 16.460 85.917 12.031 1.00 0.00 H
+ATOM 7854 1HB ASP I 29 18.669 85.784 9.950 1.00 0.00 H
+ATOM 7855 2HB ASP I 29 17.509 87.103 10.074 1.00 0.00 H
+ATOM 7856 N THR I 30 14.734 84.878 10.583 1.00 83.60 N
+ATOM 7857 CA THR I 30 13.699 84.364 9.694 1.00 84.01 C
+ATOM 7858 C THR I 30 12.904 85.484 9.013 1.00 85.20 C
+ATOM 7859 O THR I 30 12.349 86.361 9.673 1.00 87.17 O
+ATOM 7860 CB THR I 30 12.721 83.445 10.445 1.00 79.77 C
+ATOM 7861 OG1 THR I 30 13.422 82.318 10.991 1.00 73.25 O
+ATOM 7862 CG2 THR I 30 11.646 82.948 9.479 1.00 73.11 C
+ATOM 7863 H THR I 30 14.487 85.183 11.515 1.00 0.00 H
+ATOM 7864 HA THR I 30 14.169 83.752 8.939 1.00 0.00 H
+ATOM 7865 HB THR I 30 12.268 83.995 11.251 1.00 0.00 H
+ATOM 7866 HG1 THR I 30 14.136 82.616 11.564 1.00 0.00 H
+ATOM 7867 1HG2 THR I 30 10.954 82.299 10.010 1.00 0.00 H
+ATOM 7868 2HG2 THR I 30 11.104 83.796 9.071 1.00 0.00 H
+ATOM 7869 3HG2 THR I 30 12.122 82.391 8.667 1.00 0.00 H
+ATOM 7870 N ARG I 31 12.839 85.428 7.686 1.00 85.73 N
+ATOM 7871 CA ARG I 31 12.058 86.369 6.883 1.00 85.75 C
+ATOM 7872 C ARG I 31 11.745 85.703 5.559 1.00 85.30 C
+ATOM 7873 O ARG I 31 12.294 84.651 5.257 1.00 84.49 O
+ATOM 7874 CB ARG I 31 12.782 87.680 6.608 1.00 45.00 C
+ATOM 7875 CG ARG I 31 13.862 87.626 5.538 1.00 45.00 C
+ATOM 7876 CD ARG I 31 15.239 87.456 6.040 1.00 45.00 C
+ATOM 7877 NE ARG I 31 16.193 87.833 4.985 1.00 45.00 N
+ATOM 7878 CZ ARG I 31 17.526 87.652 5.020 1.00 45.00 C
+ATOM 7879 NH1 ARG I 31 18.089 87.095 6.058 1.00 45.00 N
+ATOM 7880 NH2 ARG I 31 18.265 88.042 3.997 1.00 45.00 N
+ATOM 7881 H ARG I 31 13.384 84.710 7.225 1.00 0.00 H
+ATOM 7882 HA ARG I 31 11.122 86.587 7.395 1.00 0.00 H
+ATOM 7883 1HB ARG I 31 12.050 88.425 6.283 1.00 0.00 H
+ATOM 7884 2HB ARG I 31 13.242 88.048 7.522 1.00 0.00 H
+ATOM 7885 1HG ARG I 31 13.666 86.765 4.906 1.00 0.00 H
+ATOM 7886 2HG ARG I 31 13.825 88.533 4.936 1.00 0.00 H
+ATOM 7887 1HD ARG I 31 15.402 88.100 6.903 1.00 0.00 H
+ATOM 7888 2HD ARG I 31 15.412 86.417 6.316 1.00 0.00 H
+ATOM 7889 HE ARG I 31 15.808 88.267 4.156 1.00 0.00 H
+ATOM 7890 1HH1 ARG I 31 17.518 86.795 6.834 1.00 0.00 H
+ATOM 7891 2HH1 ARG I 31 19.088 86.962 6.080 1.00 0.00 H
+ATOM 7892 1HH2 ARG I 31 17.828 88.473 3.197 1.00 0.00 H
+ATOM 7893 2HH2 ARG I 31 19.264 87.911 4.014 1.00 0.00 H
+ATOM 7894 N PHE I 32 10.845 86.247 4.755 1.00 85.35 N
+ATOM 7895 CA PHE I 32 10.672 85.564 3.484 1.00 86.02 C
+ATOM 7896 C PHE I 32 11.876 85.851 2.598 1.00 86.05 C
+ATOM 7897 O PHE I 32 12.484 86.917 2.705 1.00 85.73 O
+ATOM 7898 CB PHE I 32 9.396 85.975 2.766 1.00 87.44 C
+ATOM 7899 CG PHE I 32 9.412 87.320 2.133 1.00 97.58 C
+ATOM 7900 CD1 PHE I 32 8.993 88.451 2.809 1.00 98.44 C
+ATOM 7901 CD2 PHE I 32 9.829 87.447 0.817 1.00 97.40 C
+ATOM 7902 CE1 PHE I 32 9.001 89.685 2.182 1.00 98.25 C
+ATOM 7903 CE2 PHE I 32 9.839 88.669 0.188 1.00 96.34 C
+ATOM 7904 CZ PHE I 32 9.425 89.795 0.873 1.00 98.78 C
+ATOM 7905 H PHE I 32 10.346 87.096 4.983 1.00 0.00 H
+ATOM 7906 HA PHE I 32 10.619 84.498 3.663 1.00 0.00 H
+ATOM 7907 1HB PHE I 32 9.221 85.254 1.983 1.00 0.00 H
+ATOM 7908 2HB PHE I 32 8.560 85.927 3.456 1.00 0.00 H
+ATOM 7909 HD1 PHE I 32 8.651 88.371 3.844 1.00 0.00 H
+ATOM 7910 HD2 PHE I 32 10.150 86.558 0.278 1.00 0.00 H
+ATOM 7911 HE1 PHE I 32 8.667 90.569 2.730 1.00 0.00 H
+ATOM 7912 HE2 PHE I 32 10.171 88.748 -0.847 1.00 0.00 H
+ATOM 7913 HZ PHE I 32 9.428 90.766 0.381 1.00 0.00 H
+ATOM 7914 N HIS I 33 12.194 84.935 1.695 1.00 84.29 N
+ATOM 7915 CA HIS I 33 13.254 85.199 0.733 1.00 81.02 C
+ATOM 7916 C HIS I 33 12.730 85.018 -0.674 1.00 78.60 C
+ATOM 7917 O HIS I 33 13.332 85.486 -1.639 1.00 78.03 O
+ATOM 7918 CB HIS I 33 14.454 84.279 0.961 1.00 81.95 C
+ATOM 7919 CG HIS I 33 14.182 82.820 0.725 1.00 83.18 C
+ATOM 7920 ND1 HIS I 33 14.208 82.270 -0.536 1.00 80.96 N
+ATOM 7921 CD2 HIS I 33 13.868 81.805 1.567 1.00 83.70 C
+ATOM 7922 CE1 HIS I 33 13.929 80.987 -0.462 1.00 83.03 C
+ATOM 7923 NE2 HIS I 33 13.721 80.678 0.800 1.00 86.76 N
+ATOM 7924 H HIS I 33 11.686 84.060 1.688 1.00 0.00 H
+ATOM 7925 HA HIS I 33 13.593 86.230 0.828 1.00 0.00 H
+ATOM 7926 1HB HIS I 33 15.255 84.577 0.283 1.00 0.00 H
+ATOM 7927 2HB HIS I 33 14.819 84.414 1.956 1.00 0.00 H
+ATOM 7928 HD2 HIS I 33 13.751 81.867 2.644 1.00 0.00 H
+ATOM 7929 HE1 HIS I 33 13.881 80.298 -1.307 1.00 0.00 H
+ATOM 7930 HE2 HIS I 33 13.490 79.752 1.132 1.00 0.00 H
+ATOM 7931 N HIS I 34 11.569 84.383 -0.786 1.00 77.53 N
+ATOM 7932 CA HIS I 34 11.004 84.155 -2.108 1.00 78.43 C
+ATOM 7933 C HIS I 34 9.498 84.066 -2.106 1.00 80.11 C
+ATOM 7934 O HIS I 34 8.885 83.427 -1.255 1.00 81.10 O
+ATOM 7935 CB HIS I 34 11.573 82.901 -2.773 1.00 83.94 C
+ATOM 7936 CG HIS I 34 11.059 82.710 -4.182 1.00 82.24 C
+ATOM 7937 ND1 HIS I 34 11.447 83.523 -5.228 1.00 82.21 N
+ATOM 7938 CD2 HIS I 34 10.196 81.805 -4.711 1.00 82.65 C
+ATOM 7939 CE1 HIS I 34 10.842 83.126 -6.342 1.00 81.26 C
+ATOM 7940 NE2 HIS I 34 10.079 82.085 -6.055 1.00 81.92 N
+ATOM 7941 H HIS I 34 11.127 84.010 0.051 1.00 0.00 H
+ATOM 7942 HA HIS I 34 11.266 84.998 -2.748 1.00 0.00 H
+ATOM 7943 1HB HIS I 34 12.664 82.978 -2.817 1.00 0.00 H
+ATOM 7944 2HB HIS I 34 11.330 82.019 -2.182 1.00 0.00 H
+ATOM 7945 HD2 HIS I 34 9.688 81.006 -4.179 1.00 0.00 H
+ATOM 7946 HE1 HIS I 34 10.959 83.583 -7.328 1.00 0.00 H
+ATOM 7947 HE2 HIS I 34 9.488 81.565 -6.724 1.00 0.00 H
+ATOM 7948 N SER I 35 8.915 84.714 -3.102 1.00 79.71 N
+ATOM 7949 CA SER I 35 7.478 84.766 -3.313 1.00 80.84 C
+ATOM 7950 C SER I 35 7.102 84.193 -4.676 1.00 80.83 C
+ATOM 7951 O SER I 35 7.344 84.830 -5.704 1.00 81.90 O
+ATOM 7952 CB SER I 35 7.060 86.227 -3.234 1.00 87.78 C
+ATOM 7953 OG SER I 35 5.722 86.410 -3.561 1.00 95.90 O
+ATOM 7954 H SER I 35 9.511 85.197 -3.763 1.00 0.00 H
+ATOM 7955 HA SER I 35 6.979 84.181 -2.539 1.00 0.00 H
+ATOM 7956 1HB SER I 35 7.254 86.607 -2.226 1.00 0.00 H
+ATOM 7957 2HB SER I 35 7.675 86.799 -3.925 1.00 0.00 H
+ATOM 7958 HG SER I 35 5.554 85.812 -4.299 1.00 0.00 H
+ATOM 7959 N GLU I 36 6.521 82.992 -4.693 1.00 80.56 N
+ATOM 7960 CA GLU I 36 6.167 82.362 -5.959 1.00 81.21 C
+ATOM 7961 C GLU I 36 4.684 82.555 -6.235 1.00 81.55 C
+ATOM 7962 O GLU I 36 3.835 82.036 -5.512 1.00 82.87 O
+ATOM 7963 CB GLU I 36 6.511 80.869 -5.959 1.00 71.28 C
+ATOM 7964 CG GLU I 36 6.275 80.168 -7.298 1.00 69.13 C
+ATOM 7965 CD GLU I 36 7.230 80.600 -8.383 1.00 76.47 C
+ATOM 7966 OE1 GLU I 36 8.389 80.831 -8.086 1.00 73.12 O
+ATOM 7967 OE2 GLU I 36 6.805 80.699 -9.523 1.00 77.29 O
+ATOM 7968 H GLU I 36 6.331 82.495 -3.822 1.00 0.00 H
+ATOM 7969 HA GLU I 36 6.727 82.847 -6.759 1.00 0.00 H
+ATOM 7970 1HB GLU I 36 7.545 80.731 -5.684 1.00 0.00 H
+ATOM 7971 2HB GLU I 36 5.911 80.363 -5.207 1.00 0.00 H
+ATOM 7972 1HG GLU I 36 6.406 79.109 -7.161 1.00 0.00 H
+ATOM 7973 2HG GLU I 36 5.249 80.347 -7.616 1.00 0.00 H
+ATOM 7974 N LYS I 37 4.371 83.326 -7.269 1.00 80.99 N
+ATOM 7975 CA LYS I 37 2.985 83.611 -7.611 1.00 81.78 C
+ATOM 7976 C LYS I 37 2.425 82.588 -8.592 1.00 81.80 C
+ATOM 7977 O LYS I 37 3.030 82.329 -9.638 1.00 82.05 O
+ATOM 7978 CB LYS I 37 2.850 85.016 -8.198 1.00 83.44 C
+ATOM 7979 CG LYS I 37 1.415 85.419 -8.535 1.00 74.93 C
+ATOM 7980 CD LYS I 37 1.357 86.844 -9.098 1.00 73.03 C
+ATOM 7981 CE LYS I 37 -0.056 87.237 -9.502 1.00 45.00 C
+ATOM 7982 NZ LYS I 37 -0.102 88.601 -10.098 1.00 45.00 N
+ATOM 7983 H LYS I 37 5.117 83.725 -7.822 1.00 0.00 H
+ATOM 7984 HA LYS I 37 2.386 83.559 -6.702 1.00 0.00 H
+ATOM 7985 1HB LYS I 37 3.237 85.742 -7.483 1.00 0.00 H
+ATOM 7986 2HB LYS I 37 3.450 85.095 -9.104 1.00 0.00 H
+ATOM 7987 1HG LYS I 37 1.012 84.725 -9.276 1.00 0.00 H
+ATOM 7988 2HG LYS I 37 0.801 85.354 -7.634 1.00 0.00 H
+ATOM 7989 1HD LYS I 37 1.721 87.547 -8.345 1.00 0.00 H
+ATOM 7990 2HD LYS I 37 2.001 86.913 -9.975 1.00 0.00 H
+ATOM 7991 1HE LYS I 37 -0.434 86.517 -10.229 1.00 0.00 H
+ATOM 7992 2HE LYS I 37 -0.691 87.218 -8.624 1.00 0.00 H
+ATOM 7993 1HZ LYS I 37 -1.058 88.825 -10.352 1.00 0.00 H
+ATOM 7994 2HZ LYS I 37 0.236 89.280 -9.427 1.00 0.00 H
+ATOM 7995 3HZ LYS I 37 0.478 88.624 -10.925 1.00 0.00 H
+ATOM 7996 N LEU I 38 1.281 81.999 -8.246 1.00 83.81 N
+ATOM 7997 CA LEU I 38 0.631 81.015 -9.092 1.00 84.34 C
+ATOM 7998 C LEU I 38 -0.698 81.576 -9.632 1.00 84.81 C
+ATOM 7999 O LEU I 38 -1.442 82.274 -8.918 1.00 84.98 O
+ATOM 8000 CB LEU I 38 0.332 79.721 -8.296 1.00 45.00 C
+ATOM 8001 CG LEU I 38 1.533 78.845 -7.753 1.00 45.00 C
+ATOM 8002 CD1 LEU I 38 2.522 78.582 -8.861 1.00 45.00 C
+ATOM 8003 CD2 LEU I 38 2.199 79.538 -6.573 1.00 45.00 C
+ATOM 8004 H LEU I 38 0.850 82.247 -7.365 1.00 0.00 H
+ATOM 8005 HA LEU I 38 1.279 80.781 -9.938 1.00 0.00 H
+ATOM 8006 1HB LEU I 38 -0.253 79.996 -7.442 1.00 0.00 H
+ATOM 8007 2HB LEU I 38 -0.274 79.075 -8.930 1.00 0.00 H
+ATOM 8008 HG LEU I 38 1.143 77.881 -7.418 1.00 0.00 H
+ATOM 8009 1HD1 LEU I 38 3.334 77.968 -8.492 1.00 0.00 H
+ATOM 8010 2HD1 LEU I 38 2.021 78.069 -9.679 1.00 0.00 H
+ATOM 8011 3HD1 LEU I 38 2.921 79.531 -9.217 1.00 0.00 H
+ATOM 8012 1HD2 LEU I 38 3.014 78.919 -6.194 1.00 0.00 H
+ATOM 8013 2HD2 LEU I 38 2.594 80.478 -6.886 1.00 0.00 H
+ATOM 8014 3HD2 LEU I 38 1.468 79.703 -5.785 1.00 0.00 H
+ATOM 8015 N ASP I 39 -1.019 81.208 -10.867 1.00 84.30 N
+ATOM 8016 CA ASP I 39 -2.303 81.536 -11.481 1.00 85.21 C
+ATOM 8017 C ASP I 39 -3.253 80.354 -11.333 1.00 85.34 C
+ATOM 8018 O ASP I 39 -2.814 79.252 -10.994 1.00 85.72 O
+ATOM 8019 CB ASP I 39 -2.154 81.918 -12.959 1.00 93.95 C
+ATOM 8020 CG ASP I 39 -1.427 83.282 -13.213 1.00 96.64 C
+ATOM 8021 OD1 ASP I 39 -1.412 84.126 -12.341 1.00 98.87 O
+ATOM 8022 OD2 ASP I 39 -0.918 83.452 -14.291 1.00100.09 O
+ATOM 8023 H ASP I 39 -0.341 80.659 -11.401 1.00 0.00 H
+ATOM 8024 HA ASP I 39 -2.727 82.389 -10.960 1.00 0.00 H
+ATOM 8025 1HB ASP I 39 -1.598 81.132 -13.470 1.00 0.00 H
+ATOM 8026 2HB ASP I 39 -3.149 81.964 -13.415 1.00 0.00 H
+ATOM 8027 N LYS I 40 -4.540 80.569 -11.589 1.00 85.18 N
+ATOM 8028 CA LYS I 40 -5.524 79.497 -11.478 1.00 85.08 C
+ATOM 8029 C LYS I 40 -5.045 78.234 -12.176 1.00 86.09 C
+ATOM 8030 O LYS I 40 -4.735 78.257 -13.368 1.00 84.94 O
+ATOM 8031 CB LYS I 40 -6.827 79.941 -12.166 1.00 48.00 C
+ATOM 8032 CG LYS I 40 -7.999 78.932 -12.186 1.00 45.00 C
+ATOM 8033 CD LYS I 40 -8.739 78.880 -10.877 1.00 45.00 C
+ATOM 8034 CE LYS I 40 -9.944 77.936 -10.942 1.00 45.00 C
+ATOM 8035 NZ LYS I 40 -10.832 78.099 -9.752 1.00 45.00 N
+ATOM 8036 H LYS I 40 -4.866 81.501 -11.855 1.00 0.00 H
+ATOM 8037 HA LYS I 40 -5.695 79.276 -10.422 1.00 0.00 H
+ATOM 8038 1HB LYS I 40 -7.190 80.846 -11.674 1.00 0.00 H
+ATOM 8039 2HB LYS I 40 -6.608 80.214 -13.200 1.00 0.00 H
+ATOM 8040 1HG LYS I 40 -8.699 79.212 -12.972 1.00 0.00 H
+ATOM 8041 2HG LYS I 40 -7.615 77.935 -12.407 1.00 0.00 H
+ATOM 8042 1HD LYS I 40 -8.059 78.522 -10.107 1.00 0.00 H
+ATOM 8043 2HD LYS I 40 -9.083 79.874 -10.608 1.00 0.00 H
+ATOM 8044 1HE LYS I 40 -10.519 78.126 -11.849 1.00 0.00 H
+ATOM 8045 2HE LYS I 40 -9.576 76.908 -10.965 1.00 0.00 H
+ATOM 8046 1HZ LYS I 40 -11.607 77.457 -9.804 1.00 0.00 H
+ATOM 8047 2HZ LYS I 40 -10.298 77.933 -8.894 1.00 0.00 H
+ATOM 8048 3HZ LYS I 40 -11.179 79.045 -9.726 1.00 0.00 H
+ATOM 8049 N GLY I 41 -5.020 77.120 -11.445 1.00 86.07 N
+ATOM 8050 CA GLY I 41 -4.661 75.836 -12.031 1.00 86.60 C
+ATOM 8051 C GLY I 41 -3.179 75.458 -11.988 1.00 86.28 C
+ATOM 8052 O GLY I 41 -2.829 74.312 -12.281 1.00 86.58 O
+ATOM 8053 H GLY I 41 -5.254 77.148 -10.454 1.00 0.00 H
+ATOM 8054 1HA GLY I 41 -5.241 75.057 -11.538 1.00 0.00 H
+ATOM 8055 2HA GLY I 41 -4.980 75.845 -13.070 1.00 0.00 H
+ATOM 8056 N GLU I 42 -2.290 76.379 -11.636 1.00 85.94 N
+ATOM 8057 CA GLU I 42 -0.883 75.980 -11.627 1.00 85.86 C
+ATOM 8058 C GLU I 42 -0.571 75.125 -10.407 1.00 86.20 C
+ATOM 8059 O GLU I 42 -1.132 75.325 -9.322 1.00 85.91 O
+ATOM 8060 CB GLU I 42 0.065 77.190 -11.703 1.00 88.73 C
+ATOM 8061 CG GLU I 42 0.025 77.951 -13.042 1.00 93.71 C
+ATOM 8062 CD GLU I 42 1.055 79.073 -13.159 1.00 93.89 C
+ATOM 8063 OE1 GLU I 42 1.016 79.985 -12.375 1.00 96.49 O
+ATOM 8064 OE2 GLU I 42 1.882 79.009 -14.043 1.00 96.44 O
+ATOM 8065 H GLU I 42 -2.578 77.329 -11.403 1.00 0.00 H
+ATOM 8066 HA GLU I 42 -0.697 75.369 -12.513 1.00 0.00 H
+ATOM 8067 1HB GLU I 42 -0.180 77.894 -10.913 1.00 0.00 H
+ATOM 8068 2HB GLU I 42 1.091 76.853 -11.544 1.00 0.00 H
+ATOM 8069 1HG GLU I 42 0.197 77.236 -13.849 1.00 0.00 H
+ATOM 8070 2HG GLU I 42 -0.978 78.366 -13.174 1.00 0.00 H
+ATOM 8071 N VAL I 43 0.340 74.162 -10.585 1.00 85.08 N
+ATOM 8072 CA VAL I 43 0.758 73.305 -9.474 1.00 82.35 C
+ATOM 8073 C VAL I 43 2.240 73.471 -9.170 1.00 81.11 C
+ATOM 8074 O VAL I 43 3.083 73.420 -10.062 1.00 82.59 O
+ATOM 8075 CB VAL I 43 0.436 71.810 -9.763 1.00 86.06 C
+ATOM 8076 CG1 VAL I 43 0.961 70.916 -8.626 1.00 93.03 C
+ATOM 8077 CG2 VAL I 43 -1.082 71.627 -9.874 1.00 81.83 C
+ATOM 8078 H VAL I 43 0.756 74.031 -11.509 1.00 0.00 H
+ATOM 8079 HA VAL I 43 0.199 73.597 -8.591 1.00 0.00 H
+ATOM 8080 HB VAL I 43 0.918 71.510 -10.690 1.00 0.00 H
+ATOM 8081 1HG1 VAL I 43 0.727 69.873 -8.841 1.00 0.00 H
+ATOM 8082 2HG1 VAL I 43 2.041 71.030 -8.535 1.00 0.00 H
+ATOM 8083 3HG1 VAL I 43 0.485 71.210 -7.687 1.00 0.00 H
+ATOM 8084 1HG2 VAL I 43 -1.318 70.582 -10.078 1.00 0.00 H
+ATOM 8085 2HG2 VAL I 43 -1.535 71.921 -8.943 1.00 0.00 H
+ATOM 8086 3HG2 VAL I 43 -1.469 72.250 -10.676 1.00 0.00 H
+ATOM 8087 N LEU I 44 2.549 73.703 -7.900 1.00 79.07 N
+ATOM 8088 CA LEU I 44 3.929 73.866 -7.461 1.00 76.65 C
+ATOM 8089 C LEU I 44 4.299 72.797 -6.452 1.00 76.09 C
+ATOM 8090 O LEU I 44 3.625 72.622 -5.437 1.00 76.63 O
+ATOM 8091 CB LEU I 44 4.133 75.243 -6.823 1.00 63.77 C
+ATOM 8092 CG LEU I 44 5.551 75.533 -6.276 1.00 62.07 C
+ATOM 8093 CD1 LEU I 44 6.557 75.603 -7.439 1.00 59.04 C
+ATOM 8094 CD2 LEU I 44 5.510 76.823 -5.494 1.00 62.92 C
+ATOM 8095 H LEU I 44 1.799 73.756 -7.217 1.00 0.00 H
+ATOM 8096 HA LEU I 44 4.589 73.768 -8.319 1.00 0.00 H
+ATOM 8097 1HB LEU I 44 3.914 75.991 -7.570 1.00 0.00 H
+ATOM 8098 2HB LEU I 44 3.423 75.358 -6.001 1.00 0.00 H
+ATOM 8099 HG LEU I 44 5.866 74.721 -5.617 1.00 0.00 H
+ATOM 8100 1HD1 LEU I 44 7.551 75.800 -7.046 1.00 0.00 H
+ATOM 8101 2HD1 LEU I 44 6.563 74.655 -7.973 1.00 0.00 H
+ATOM 8102 3HD1 LEU I 44 6.272 76.404 -8.119 1.00 0.00 H
+ATOM 8103 1HD2 LEU I 44 6.498 77.047 -5.090 1.00 0.00 H
+ATOM 8104 2HD2 LEU I 44 5.190 77.629 -6.138 1.00 0.00 H
+ATOM 8105 3HD2 LEU I 44 4.805 76.715 -4.686 1.00 0.00 H
+ATOM 8106 N ILE I 45 5.360 72.068 -6.736 1.00 73.11 N
+ATOM 8107 CA ILE I 45 5.813 71.037 -5.830 1.00 68.81 C
+ATOM 8108 C ILE I 45 7.150 71.501 -5.273 1.00 67.41 C
+ATOM 8109 O ILE I 45 8.075 71.760 -6.039 1.00 66.88 O
+ATOM 8110 CB ILE I 45 5.953 69.705 -6.565 1.00 63.00 C
+ATOM 8111 CG1 ILE I 45 4.618 69.369 -7.214 1.00 55.67 C
+ATOM 8112 CG2 ILE I 45 6.305 68.645 -5.558 1.00 68.69 C
+ATOM 8113 CD1 ILE I 45 4.634 68.183 -8.102 1.00 52.58 C
+ATOM 8114 H ILE I 45 5.862 72.229 -7.599 1.00 0.00 H
+ATOM 8115 HA ILE I 45 5.107 70.927 -5.017 1.00 0.00 H
+ATOM 8116 HB ILE I 45 6.713 69.774 -7.339 1.00 0.00 H
+ATOM 8117 1HG1 ILE I 45 3.901 69.219 -6.445 1.00 0.00 H
+ATOM 8118 2HG1 ILE I 45 4.305 70.222 -7.815 1.00 0.00 H
+ATOM 8119 1HG2 ILE I 45 6.390 67.674 -6.045 1.00 0.00 H
+ATOM 8120 2HG2 ILE I 45 7.241 68.896 -5.071 1.00 0.00 H
+ATOM 8121 3HG2 ILE I 45 5.526 68.613 -4.816 1.00 0.00 H
+ATOM 8122 1HD1 ILE I 45 3.639 68.042 -8.512 1.00 0.00 H
+ATOM 8123 2HD1 ILE I 45 5.348 68.333 -8.913 1.00 0.00 H
+ATOM 8124 3HD1 ILE I 45 4.914 67.313 -7.521 1.00 0.00 H
+ATOM 8125 N ALA I 46 7.265 71.647 -3.955 1.00 66.79 N
+ATOM 8126 CA ALA I 46 8.506 72.242 -3.456 1.00 66.73 C
+ATOM 8127 C ALA I 46 9.024 71.633 -2.172 1.00 66.02 C
+ATOM 8128 O ALA I 46 8.271 71.344 -1.240 1.00 65.37 O
+ATOM 8129 CB ALA I 46 8.282 73.730 -3.233 1.00 73.33 C
+ATOM 8130 H ALA I 46 6.495 71.383 -3.343 1.00 0.00 H
+ATOM 8131 HA ALA I 46 9.277 72.100 -4.208 1.00 0.00 H
+ATOM 8132 1HB ALA I 46 9.217 74.184 -2.900 1.00 0.00 H
+ATOM 8133 2HB ALA I 46 7.961 74.196 -4.163 1.00 0.00 H
+ATOM 8134 3HB ALA I 46 7.514 73.870 -2.472 1.00 0.00 H
+ATOM 8135 N GLN I 47 10.349 71.468 -2.142 1.00 66.32 N
+ATOM 8136 CA GLN I 47 11.080 70.900 -1.014 1.00 67.06 C
+ATOM 8137 C GLN I 47 11.505 71.918 0.014 1.00 66.88 C
+ATOM 8138 O GLN I 47 11.717 73.092 -0.297 1.00 67.22 O
+ATOM 8139 CB GLN I 47 12.358 70.205 -1.493 1.00 77.05 C
+ATOM 8140 CG GLN I 47 12.172 68.984 -2.354 1.00 76.63 C
+ATOM 8141 CD GLN I 47 13.487 68.396 -2.741 1.00 80.34 C
+ATOM 8142 OE1 GLN I 47 14.386 69.113 -3.194 1.00 82.11 O
+ATOM 8143 NE2 GLN I 47 13.624 67.089 -2.567 1.00 76.69 N
+ATOM 8144 H GLN I 47 10.891 71.731 -2.966 1.00 0.00 H
+ATOM 8145 HA GLN I 47 10.452 70.173 -0.515 1.00 0.00 H
+ATOM 8146 1HB GLN I 47 12.965 70.921 -2.052 1.00 0.00 H
+ATOM 8147 2HB GLN I 47 12.941 69.901 -0.620 1.00 0.00 H
+ATOM 8148 1HG GLN I 47 11.659 68.231 -1.773 1.00 0.00 H
+ATOM 8149 2HG GLN I 47 11.606 69.237 -3.254 1.00 0.00 H
+ATOM 8150 1HE2 GLN I 47 14.479 66.629 -2.811 1.00 0.00 H
+ATOM 8151 2HE2 GLN I 47 12.860 66.555 -2.188 1.00 0.00 H
+ATOM 8152 N PHE I 48 11.727 71.436 1.226 1.00 67.24 N
+ATOM 8153 CA PHE I 48 12.382 72.257 2.231 1.00 68.11 C
+ATOM 8154 C PHE I 48 13.876 72.116 1.960 1.00 68.84 C
+ATOM 8155 O PHE I 48 14.337 71.037 1.567 1.00 70.67 O
+ATOM 8156 CB PHE I 48 12.002 71.811 3.621 1.00 73.02 C
+ATOM 8157 CG PHE I 48 10.561 72.086 3.921 1.00 76.77 C
+ATOM 8158 CD1 PHE I 48 10.155 73.324 4.362 1.00 76.55 C
+ATOM 8159 CD2 PHE I 48 9.605 71.094 3.748 1.00 78.97 C
+ATOM 8160 CE1 PHE I 48 8.826 73.559 4.606 1.00 74.65 C
+ATOM 8161 CE2 PHE I 48 8.281 71.338 3.995 1.00 78.64 C
+ATOM 8162 CZ PHE I 48 7.898 72.581 4.417 1.00 79.42 C
+ATOM 8163 H PHE I 48 11.453 70.475 1.439 1.00 0.00 H
+ATOM 8164 HA PHE I 48 12.097 73.302 2.102 1.00 0.00 H
+ATOM 8165 1HB PHE I 48 12.188 70.743 3.723 1.00 0.00 H
+ATOM 8166 2HB PHE I 48 12.617 72.340 4.345 1.00 0.00 H
+ATOM 8167 HD1 PHE I 48 10.897 74.116 4.500 1.00 0.00 H
+ATOM 8168 HD2 PHE I 48 9.921 70.117 3.406 1.00 0.00 H
+ATOM 8169 HE1 PHE I 48 8.505 74.517 4.932 1.00 0.00 H
+ATOM 8170 HE2 PHE I 48 7.540 70.553 3.845 1.00 0.00 H
+ATOM 8171 HZ PHE I 48 6.865 72.798 4.589 1.00 0.00 H
+ATOM 8172 N THR I 49 14.622 73.211 2.085 1.00 69.23 N
+ATOM 8173 CA THR I 49 16.029 73.190 1.675 1.00 69.46 C
+ATOM 8174 C THR I 49 16.956 73.800 2.707 1.00 71.39 C
+ATOM 8175 O THR I 49 16.540 74.241 3.776 1.00 71.30 O
+ATOM 8176 CB THR I 49 16.268 73.980 0.373 1.00 60.70 C
+ATOM 8177 OG1 THR I 49 16.194 75.377 0.663 1.00 63.11 O
+ATOM 8178 CG2 THR I 49 15.217 73.631 -0.678 1.00 53.78 C
+ATOM 8179 H THR I 49 14.206 74.050 2.485 1.00 0.00 H
+ATOM 8180 HA THR I 49 16.332 72.155 1.522 1.00 0.00 H
+ATOM 8181 HB THR I 49 17.253 73.743 -0.025 1.00 0.00 H
+ATOM 8182 HG1 THR I 49 16.855 75.559 1.322 1.00 0.00 H
+ATOM 8183 1HG2 THR I 49 15.412 74.207 -1.578 1.00 0.00 H
+ATOM 8184 2HG2 THR I 49 15.257 72.567 -0.909 1.00 0.00 H
+ATOM 8185 3HG2 THR I 49 14.226 73.878 -0.301 1.00 0.00 H
+ATOM 8186 N GLU I 50 18.222 73.897 2.334 1.00 74.51 N
+ATOM 8187 CA GLU I 50 19.251 74.545 3.138 1.00 78.21 C
+ATOM 8188 C GLU I 50 18.881 75.988 3.508 1.00 79.93 C
+ATOM 8189 O GLU I 50 19.337 76.496 4.530 1.00 82.27 O
+ATOM 8190 CB GLU I 50 20.584 74.528 2.386 1.00 84.50 C
+ATOM 8191 CG GLU I 50 21.755 75.131 3.147 1.00 87.26 C
+ATOM 8192 CD GLU I 50 23.074 74.992 2.409 1.00 84.80 C
+ATOM 8193 OE1 GLU I 50 23.078 74.455 1.326 1.00 89.36 O
+ATOM 8194 OE2 GLU I 50 24.075 75.422 2.936 1.00 87.54 O
+ATOM 8195 H GLU I 50 18.496 73.500 1.448 1.00 0.00 H
+ATOM 8196 HA GLU I 50 19.367 73.979 4.062 1.00 0.00 H
+ATOM 8197 1HB GLU I 50 20.846 73.500 2.136 1.00 0.00 H
+ATOM 8198 2HB GLU I 50 20.479 75.075 1.449 1.00 0.00 H
+ATOM 8199 1HG GLU I 50 21.550 76.192 3.303 1.00 0.00 H
+ATOM 8200 2HG GLU I 50 21.832 74.656 4.123 1.00 0.00 H
+ATOM 8201 N HIS I 51 18.115 76.671 2.646 1.00 79.98 N
+ATOM 8202 CA HIS I 51 17.768 78.067 2.891 1.00 82.09 C
+ATOM 8203 C HIS I 51 16.301 78.294 3.282 1.00 81.98 C
+ATOM 8204 O HIS I 51 15.965 79.389 3.731 1.00 81.71 O
+ATOM 8205 CB HIS I 51 18.092 78.910 1.649 1.00 85.88 C
+ATOM 8206 CG HIS I 51 19.552 78.935 1.318 1.00 87.16 C
+ATOM 8207 ND1 HIS I 51 20.170 77.930 0.609 1.00 87.69 N
+ATOM 8208 CD2 HIS I 51 20.512 79.843 1.599 1.00 85.67 C
+ATOM 8209 CE1 HIS I 51 21.456 78.213 0.479 1.00 85.83 C
+ATOM 8210 NE2 HIS I 51 21.687 79.371 1.066 1.00 85.59 N
+ATOM 8211 H HIS I 51 17.738 76.212 1.829 1.00 0.00 H
+ATOM 8212 HA HIS I 51 18.381 78.440 3.711 1.00 0.00 H
+ATOM 8213 1HB HIS I 51 17.550 78.514 0.788 1.00 0.00 H
+ATOM 8214 2HB HIS I 51 17.755 79.937 1.803 1.00 0.00 H
+ATOM 8215 HD2 HIS I 51 20.379 80.775 2.148 1.00 0.00 H
+ATOM 8216 HE1 HIS I 51 22.197 77.592 -0.029 1.00 0.00 H
+ATOM 8217 HE2 HIS I 51 22.582 79.837 1.123 1.00 0.00 H
+ATOM 8218 N THR I 52 15.437 77.277 3.131 1.00 81.48 N
+ATOM 8219 CA THR I 52 14.002 77.411 3.442 1.00 79.42 C
+ATOM 8220 C THR I 52 13.570 76.459 4.556 1.00 78.44 C
+ATOM 8221 O THR I 52 13.569 75.235 4.374 1.00 77.99 O
+ATOM 8222 CB THR I 52 13.102 77.107 2.216 1.00 76.29 C
+ATOM 8223 OG1 THR I 52 13.405 78.000 1.133 1.00 75.85 O
+ATOM 8224 CG2 THR I 52 11.612 77.249 2.605 1.00 77.92 C
+ATOM 8225 H THR I 52 15.781 76.394 2.792 1.00 0.00 H
+ATOM 8226 HA THR I 52 13.813 78.432 3.771 1.00 0.00 H
+ATOM 8227 HB THR I 52 13.282 76.083 1.880 1.00 0.00 H
+ATOM 8228 HG1 THR I 52 14.225 77.718 0.711 1.00 0.00 H
+ATOM 8229 1HG2 THR I 52 10.982 77.027 1.744 1.00 0.00 H
+ATOM 8230 2HG2 THR I 52 11.375 76.554 3.411 1.00 0.00 H
+ATOM 8231 3HG2 THR I 52 11.419 78.267 2.941 1.00 0.00 H
+ATOM 8232 N SER I 53 13.144 77.028 5.688 1.00 76.95 N
+ATOM 8233 CA SER I 53 12.722 76.233 6.843 1.00 74.91 C
+ATOM 8234 C SER I 53 11.212 76.141 6.942 1.00 74.00 C
+ATOM 8235 O SER I 53 10.669 75.283 7.646 1.00 73.18 O
+ATOM 8236 CB SER I 53 13.269 76.810 8.122 1.00 72.53 C
+ATOM 8237 OG SER I 53 12.756 78.085 8.367 1.00 64.07 O
+ATOM 8238 H SER I 53 13.126 78.047 5.736 1.00 0.00 H
+ATOM 8239 HA SER I 53 13.112 75.222 6.727 1.00 0.00 H
+ATOM 8240 1HB SER I 53 13.015 76.153 8.946 1.00 0.00 H
+ATOM 8241 2HB SER I 53 14.341 76.851 8.059 1.00 0.00 H
+ATOM 8242 HG SER I 53 12.812 78.567 7.528 1.00 0.00 H
+ATOM 8243 N ALA I 54 10.529 77.035 6.239 1.00 73.43 N
+ATOM 8244 CA ALA I 54 9.076 77.004 6.278 1.00 72.36 C
+ATOM 8245 C ALA I 54 8.480 77.515 4.978 1.00 71.86 C
+ATOM 8246 O ALA I 54 9.059 78.374 4.301 1.00 71.16 O
+ATOM 8247 CB ALA I 54 8.555 77.800 7.457 1.00 71.31 C
+ATOM 8248 H ALA I 54 11.028 77.747 5.708 1.00 0.00 H
+ATOM 8249 HA ALA I 54 8.764 75.975 6.412 1.00 0.00 H
+ATOM 8250 1HB ALA I 54 7.472 77.726 7.481 1.00 0.00 H
+ATOM 8251 2HB ALA I 54 8.967 77.393 8.377 1.00 0.00 H
+ATOM 8252 3HB ALA I 54 8.842 78.819 7.368 1.00 0.00 H
+ATOM 8253 N ILE I 55 7.302 76.991 4.652 1.00 72.65 N
+ATOM 8254 CA ILE I 55 6.543 77.412 3.485 1.00 74.54 C
+ATOM 8255 C ILE I 55 5.184 77.965 3.874 1.00 76.50 C
+ATOM 8256 O ILE I 55 4.385 77.300 4.538 1.00 77.41 O
+ATOM 8257 CB ILE I 55 6.374 76.258 2.473 1.00 75.78 C
+ATOM 8258 CG1 ILE I 55 7.759 75.803 1.956 1.00 75.84 C
+ATOM 8259 CG2 ILE I 55 5.489 76.703 1.330 1.00 74.50 C
+ATOM 8260 CD1 ILE I 55 7.735 74.521 1.129 1.00 72.88 C
+ATOM 8261 H ILE I 55 6.906 76.284 5.267 1.00 0.00 H
+ATOM 8262 HA ILE I 55 7.097 78.204 2.989 1.00 0.00 H
+ATOM 8263 HB ILE I 55 5.913 75.403 2.973 1.00 0.00 H
+ATOM 8264 1HG1 ILE I 55 8.174 76.604 1.343 1.00 0.00 H
+ATOM 8265 2HG1 ILE I 55 8.414 75.651 2.798 1.00 0.00 H
+ATOM 8266 1HG2 ILE I 55 5.367 75.885 0.622 1.00 0.00 H
+ATOM 8267 2HG2 ILE I 55 4.511 77.000 1.710 1.00 0.00 H
+ATOM 8268 3HG2 ILE I 55 5.959 77.554 0.836 1.00 0.00 H
+ATOM 8269 1HD1 ILE I 55 8.751 74.279 0.805 1.00 0.00 H
+ATOM 8270 2HD1 ILE I 55 7.343 73.701 1.729 1.00 0.00 H
+ATOM 8271 3HD1 ILE I 55 7.101 74.660 0.254 1.00 0.00 H
+ATOM 8272 N LYS I 56 4.926 79.194 3.470 1.00 77.25 N
+ATOM 8273 CA LYS I 56 3.669 79.852 3.791 1.00 77.73 C
+ATOM 8274 C LYS I 56 2.828 79.974 2.536 1.00 78.33 C
+ATOM 8275 O LYS I 56 3.343 80.331 1.483 1.00 78.59 O
+ATOM 8276 CB LYS I 56 3.952 81.200 4.429 1.00 77.12 C
+ATOM 8277 CG LYS I 56 2.765 81.982 4.870 1.00 45.00 C
+ATOM 8278 CD LYS I 56 3.239 83.237 5.549 1.00 45.00 C
+ATOM 8279 CE LYS I 56 2.104 84.027 6.134 1.00 45.00 C
+ATOM 8280 NZ LYS I 56 2.602 85.238 6.805 1.00 45.00 N
+ATOM 8281 H LYS I 56 5.634 79.684 2.926 1.00 0.00 H
+ATOM 8282 HA LYS I 56 3.120 79.239 4.503 1.00 0.00 H
+ATOM 8283 1HB LYS I 56 4.578 81.048 5.298 1.00 0.00 H
+ATOM 8284 2HB LYS I 56 4.506 81.811 3.754 1.00 0.00 H
+ATOM 8285 1HG LYS I 56 2.155 82.255 4.003 1.00 0.00 H
+ATOM 8286 2HG LYS I 56 2.158 81.391 5.560 1.00 0.00 H
+ATOM 8287 1HD LYS I 56 3.922 82.968 6.361 1.00 0.00 H
+ATOM 8288 2HD LYS I 56 3.784 83.855 4.831 1.00 0.00 H
+ATOM 8289 1HE LYS I 56 1.389 84.303 5.356 1.00 0.00 H
+ATOM 8290 2HE LYS I 56 1.594 83.417 6.863 1.00 0.00 H
+ATOM 8291 1HZ LYS I 56 1.814 85.732 7.221 1.00 0.00 H
+ATOM 8292 2HZ LYS I 56 3.280 84.967 7.544 1.00 0.00 H
+ATOM 8293 3HZ LYS I 56 3.067 85.837 6.140 1.00 0.00 H
+ATOM 8294 N VAL I 57 1.550 79.627 2.618 1.00 78.18 N
+ATOM 8295 CA VAL I 57 0.721 79.686 1.429 1.00 79.59 C
+ATOM 8296 C VAL I 57 -0.442 80.668 1.579 1.00 81.15 C
+ATOM 8297 O VAL I 57 -1.253 80.567 2.511 1.00 81.93 O
+ATOM 8298 CB VAL I 57 0.178 78.280 1.114 1.00 80.01 C
+ATOM 8299 CG1 VAL I 57 -0.673 78.316 -0.165 1.00 63.38 C
+ATOM 8300 CG2 VAL I 57 1.343 77.330 1.011 1.00 77.49 C
+ATOM 8301 H VAL I 57 1.165 79.308 3.498 1.00 0.00 H
+ATOM 8302 HA VAL I 57 1.336 80.011 0.592 1.00 0.00 H
+ATOM 8303 HB VAL I 57 -0.476 77.952 1.920 1.00 0.00 H
+ATOM 8304 1HG1 VAL I 57 -1.061 77.321 -0.377 1.00 0.00 H
+ATOM 8305 2HG1 VAL I 57 -1.509 79.008 -0.034 1.00 0.00 H
+ATOM 8306 3HG1 VAL I 57 -0.058 78.650 -1.001 1.00 0.00 H
+ATOM 8307 1HG2 VAL I 57 0.978 76.331 0.800 1.00 0.00 H
+ATOM 8308 2HG2 VAL I 57 1.997 77.669 0.215 1.00 0.00 H
+ATOM 8309 3HG2 VAL I 57 1.892 77.322 1.952 1.00 0.00 H
+ATOM 8310 N ARG I 58 -0.524 81.616 0.635 1.00 81.48 N
+ATOM 8311 CA ARG I 58 -1.597 82.611 0.627 1.00 81.20 C
+ATOM 8312 C ARG I 58 -2.566 82.346 -0.522 1.00 81.64 C
+ATOM 8313 O ARG I 58 -2.159 81.878 -1.586 1.00 81.05 O
+ATOM 8314 CB ARG I 58 -1.114 84.033 0.379 1.00 83.56 C
+ATOM 8315 CG ARG I 58 -0.156 84.657 1.343 1.00 88.04 C
+ATOM 8316 CD ARG I 58 -0.150 86.127 1.099 1.00 90.07 C
+ATOM 8317 NE ARG I 58 0.311 86.499 -0.225 1.00 98.20 N
+ATOM 8318 CZ ARG I 58 -0.544 86.822 -1.233 1.00 98.07 C
+ATOM 8319 NH1 ARG I 58 -1.835 86.721 -1.027 1.00 99.19 N
+ATOM 8320 NH2 ARG I 58 -0.106 87.235 -2.413 1.00 93.25 N
+ATOM 8321 H ARG I 58 0.195 81.648 -0.083 1.00 0.00 H
+ATOM 8322 HA ARG I 58 -2.139 82.561 1.573 1.00 0.00 H
+ATOM 8323 1HB ARG I 58 -0.657 84.073 -0.599 1.00 0.00 H
+ATOM 8324 2HB ARG I 58 -1.985 84.687 0.354 1.00 0.00 H
+ATOM 8325 1HG ARG I 58 -0.461 84.452 2.370 1.00 0.00 H
+ATOM 8326 2HG ARG I 58 0.852 84.250 1.153 1.00 0.00 H
+ATOM 8327 1HD ARG I 58 -1.176 86.504 1.224 1.00 0.00 H
+ATOM 8328 2HD ARG I 58 0.495 86.608 1.824 1.00 0.00 H
+ATOM 8329 HE ARG I 58 1.314 86.582 -0.389 1.00 0.00 H
+ATOM 8330 1HH1 ARG I 58 -2.165 86.394 -0.133 1.00 0.00 H
+ATOM 8331 2HH1 ARG I 58 -2.484 86.956 -1.763 1.00 0.00 H
+ATOM 8332 1HH2 ARG I 58 0.879 87.338 -2.595 1.00 0.00 H
+ATOM 8333 2HH2 ARG I 58 -0.774 87.457 -3.142 1.00 0.00 H
+ATOM 8334 N GLY I 59 -3.825 82.736 -0.342 1.00 81.62 N
+ATOM 8335 CA GLY I 59 -4.821 82.637 -1.414 1.00 81.62 C
+ATOM 8336 C GLY I 59 -5.471 81.273 -1.362 1.00 82.24 C
+ATOM 8337 O GLY I 59 -4.954 80.376 -0.703 1.00 83.94 O
+ATOM 8338 H GLY I 59 -4.111 83.101 0.558 1.00 0.00 H
+ATOM 8339 1HA GLY I 59 -5.580 83.414 -1.296 1.00 0.00 H
+ATOM 8340 2HA GLY I 59 -4.348 82.790 -2.385 1.00 0.00 H
+ATOM 8341 N LYS I 60 -6.607 81.104 -2.026 1.00 82.80 N
+ATOM 8342 CA LYS I 60 -7.261 79.800 -1.981 1.00 85.10 C
+ATOM 8343 C LYS I 60 -6.379 78.777 -2.676 1.00 86.39 C
+ATOM 8344 O LYS I 60 -5.928 78.998 -3.802 1.00 86.47 O
+ATOM 8345 CB LYS I 60 -8.640 79.872 -2.631 1.00 47.18 C
+ATOM 8346 CG LYS I 60 -9.619 80.721 -1.850 1.00 45.00 C
+ATOM 8347 CD LYS I 60 -10.961 80.827 -2.536 1.00 45.00 C
+ATOM 8348 CE LYS I 60 -11.892 81.722 -1.727 1.00 45.00 C
+ATOM 8349 NZ LYS I 60 -13.224 81.870 -2.361 1.00 45.00 N
+ATOM 8350 H LYS I 60 -7.008 81.875 -2.561 1.00 0.00 H
+ATOM 8351 HA LYS I 60 -7.379 79.492 -0.942 1.00 0.00 H
+ATOM 8352 1HB LYS I 60 -8.565 80.270 -3.631 1.00 0.00 H
+ATOM 8353 2HB LYS I 60 -9.055 78.869 -2.703 1.00 0.00 H
+ATOM 8354 1HG LYS I 60 -9.765 80.276 -0.867 1.00 0.00 H
+ATOM 8355 2HG LYS I 60 -9.208 81.723 -1.712 1.00 0.00 H
+ATOM 8356 1HD LYS I 60 -10.815 81.264 -3.532 1.00 0.00 H
+ATOM 8357 2HD LYS I 60 -11.404 79.841 -2.648 1.00 0.00 H
+ATOM 8358 1HE LYS I 60 -12.017 81.295 -0.735 1.00 0.00 H
+ATOM 8359 2HE LYS I 60 -11.435 82.708 -1.631 1.00 0.00 H
+ATOM 8360 1HZ LYS I 60 -13.800 82.470 -1.788 1.00 0.00 H
+ATOM 8361 2HZ LYS I 60 -13.116 82.278 -3.280 1.00 0.00 H
+ATOM 8362 3HZ LYS I 60 -13.655 80.963 -2.441 1.00 0.00 H
+ATOM 8363 N ALA I 61 -6.139 77.661 -2.010 1.00 85.10 N
+ATOM 8364 CA ALA I 61 -5.241 76.654 -2.572 1.00 83.16 C
+ATOM 8365 C ALA I 61 -5.469 75.282 -1.950 1.00 82.07 C
+ATOM 8366 O ALA I 61 -5.879 75.156 -0.793 1.00 80.89 O
+ATOM 8367 CB ALA I 61 -3.791 77.077 -2.378 1.00 78.99 C
+ATOM 8368 H ALA I 61 -6.577 77.538 -1.098 1.00 0.00 H
+ATOM 8369 HA ALA I 61 -5.428 76.591 -3.634 1.00 0.00 H
+ATOM 8370 1HB ALA I 61 -3.132 76.342 -2.834 1.00 0.00 H
+ATOM 8371 2HB ALA I 61 -3.634 78.041 -2.848 1.00 0.00 H
+ATOM 8372 3HB ALA I 61 -3.568 77.160 -1.322 1.00 0.00 H
+ATOM 8373 N TYR I 62 -5.134 74.253 -2.716 1.00 79.90 N
+ATOM 8374 CA TYR I 62 -5.173 72.872 -2.241 1.00 78.44 C
+ATOM 8375 C TYR I 62 -3.749 72.416 -1.956 1.00 76.90 C
+ATOM 8376 O TYR I 62 -2.893 72.482 -2.829 1.00 75.69 O
+ATOM 8377 CB TYR I 62 -5.847 71.987 -3.295 1.00 80.13 C
+ATOM 8378 CG TYR I 62 -5.871 70.486 -3.006 1.00 82.73 C
+ATOM 8379 CD1 TYR I 62 -6.762 69.947 -2.093 1.00 84.02 C
+ATOM 8380 CD2 TYR I 62 -5.008 69.649 -3.695 1.00 83.85 C
+ATOM 8381 CE1 TYR I 62 -6.790 68.586 -1.866 1.00 86.20 C
+ATOM 8382 CE2 TYR I 62 -5.041 68.286 -3.477 1.00 85.40 C
+ATOM 8383 CZ TYR I 62 -5.929 67.755 -2.567 1.00 87.50 C
+ATOM 8384 OH TYR I 62 -5.981 66.398 -2.361 1.00 89.49 O
+ATOM 8385 H TYR I 62 -4.813 74.450 -3.662 1.00 0.00 H
+ATOM 8386 HA TYR I 62 -5.739 72.823 -1.313 1.00 0.00 H
+ATOM 8387 1HB TYR I 62 -6.884 72.313 -3.409 1.00 0.00 H
+ATOM 8388 2HB TYR I 62 -5.368 72.137 -4.244 1.00 0.00 H
+ATOM 8389 HD1 TYR I 62 -7.443 70.589 -1.562 1.00 0.00 H
+ATOM 8390 HD2 TYR I 62 -4.312 70.069 -4.416 1.00 0.00 H
+ATOM 8391 HE1 TYR I 62 -7.500 68.169 -1.151 1.00 0.00 H
+ATOM 8392 HE2 TYR I 62 -4.369 67.632 -4.030 1.00 0.00 H
+ATOM 8393 HH TYR I 62 -5.534 65.948 -3.081 1.00 0.00 H
+ATOM 8394 N ILE I 63 -3.496 72.007 -0.711 1.00 74.43 N
+ATOM 8395 CA ILE I 63 -2.135 71.633 -0.331 1.00 75.27 C
+ATOM 8396 C ILE I 63 -2.019 70.172 0.137 1.00 75.08 C
+ATOM 8397 O ILE I 63 -2.770 69.717 1.004 1.00 75.78 O
+ATOM 8398 CB ILE I 63 -1.619 72.580 0.775 1.00 80.77 C
+ATOM 8399 CG1 ILE I 63 -1.703 74.056 0.324 1.00 79.24 C
+ATOM 8400 CG2 ILE I 63 -0.187 72.220 1.127 1.00 81.47 C
+ATOM 8401 CD1 ILE I 63 -2.941 74.776 0.855 1.00 76.00 C
+ATOM 8402 H ILE I 63 -4.223 71.964 -0.009 1.00 0.00 H
+ATOM 8403 HA ILE I 63 -1.498 71.765 -1.192 1.00 0.00 H
+ATOM 8404 HB ILE I 63 -2.237 72.487 1.639 1.00 0.00 H
+ATOM 8405 1HG1 ILE I 63 -0.822 74.589 0.675 1.00 0.00 H
+ATOM 8406 2HG1 ILE I 63 -1.724 74.097 -0.759 1.00 0.00 H
+ATOM 8407 1HG2 ILE I 63 0.153 72.890 1.900 1.00 0.00 H
+ATOM 8408 2HG2 ILE I 63 -0.148 71.199 1.481 1.00 0.00 H
+ATOM 8409 3HG2 ILE I 63 0.449 72.320 0.256 1.00 0.00 H
+ATOM 8410 1HD1 ILE I 63 -2.946 75.805 0.508 1.00 0.00 H
+ATOM 8411 2HD1 ILE I 63 -3.839 74.270 0.503 1.00 0.00 H
+ATOM 8412 3HD1 ILE I 63 -2.931 74.764 1.938 1.00 0.00 H
+ATOM 8413 N GLN I 64 -1.071 69.430 -0.445 1.00 75.05 N
+ATOM 8414 CA GLN I 64 -0.854 68.041 -0.028 1.00 73.48 C
+ATOM 8415 C GLN I 64 0.477 67.963 0.707 1.00 72.48 C
+ATOM 8416 O GLN I 64 1.488 68.488 0.231 1.00 72.99 O
+ATOM 8417 CB GLN I 64 -0.787 67.105 -1.237 1.00 65.09 C
+ATOM 8418 CG GLN I 64 -1.985 67.172 -2.162 1.00 60.52 C
+ATOM 8419 CD GLN I 64 -1.860 66.236 -3.353 1.00 58.32 C
+ATOM 8420 OE1 GLN I 64 -0.986 66.381 -4.210 1.00 55.54 O
+ATOM 8421 NE2 GLN I 64 -2.755 65.261 -3.411 1.00 54.92 N
+ATOM 8422 H GLN I 64 -0.504 69.837 -1.175 1.00 0.00 H
+ATOM 8423 HA GLN I 64 -1.645 67.731 0.649 1.00 0.00 H
+ATOM 8424 1HB GLN I 64 0.114 67.253 -1.780 1.00 0.00 H
+ATOM 8425 2HB GLN I 64 -0.762 66.082 -0.868 1.00 0.00 H
+ATOM 8426 1HG GLN I 64 -2.883 66.917 -1.624 1.00 0.00 H
+ATOM 8427 2HG GLN I 64 -2.054 68.191 -2.546 1.00 0.00 H
+ATOM 8428 1HE2 GLN I 64 -2.747 64.610 -4.180 1.00 0.00 H
+ATOM 8429 2HE2 GLN I 64 -3.444 65.165 -2.691 1.00 0.00 H
+ATOM 8430 N THR I 65 0.483 67.320 1.876 1.00 71.71 N
+ATOM 8431 CA THR I 65 1.703 67.175 2.661 1.00 71.12 C
+ATOM 8432 C THR I 65 1.821 65.744 3.163 1.00 71.02 C
+ATOM 8433 O THR I 65 0.910 64.928 3.002 1.00 70.55 O
+ATOM 8434 CB THR I 65 1.737 68.101 3.895 1.00 69.35 C
+ATOM 8435 OG1 THR I 65 0.864 67.578 4.895 1.00 61.94 O
+ATOM 8436 CG2 THR I 65 1.267 69.497 3.525 1.00 71.42 C
+ATOM 8437 H THR I 65 -0.381 66.911 2.237 1.00 0.00 H
+ATOM 8438 HA THR I 65 2.567 67.389 2.026 1.00 0.00 H
+ATOM 8439 HB THR I 65 2.748 68.155 4.287 1.00 0.00 H
+ATOM 8440 HG1 THR I 65 1.092 66.665 5.035 1.00 0.00 H
+ATOM 8441 1HG2 THR I 65 1.289 70.125 4.406 1.00 0.00 H
+ATOM 8442 2HG2 THR I 65 1.926 69.913 2.763 1.00 0.00 H
+ATOM 8443 3HG2 THR I 65 0.248 69.454 3.145 1.00 0.00 H
+ATOM 8444 N ARG I 66 2.907 65.447 3.865 1.00 71.22 N
+ATOM 8445 CA ARG I 66 3.088 64.129 4.462 1.00 71.27 C
+ATOM 8446 C ARG I 66 1.993 63.757 5.468 1.00 71.49 C
+ATOM 8447 O ARG I 66 1.805 62.575 5.755 1.00 70.34 O
+ATOM 8448 CB ARG I 66 4.436 63.984 5.169 1.00 71.08 C
+ATOM 8449 CG ARG I 66 4.677 62.575 5.700 1.00 76.83 C
+ATOM 8450 CD ARG I 66 6.083 62.312 6.155 1.00 78.25 C
+ATOM 8451 NE ARG I 66 6.483 63.065 7.342 1.00 87.19 N
+ATOM 8452 CZ ARG I 66 7.692 62.914 7.930 1.00 45.00 C
+ATOM 8453 NH1 ARG I 66 8.544 62.046 7.428 1.00 45.00 N
+ATOM 8454 NH2 ARG I 66 8.044 63.608 8.993 1.00 45.00 N
+ATOM 8455 H ARG I 66 3.631 66.144 3.961 1.00 0.00 H
+ATOM 8456 HA ARG I 66 3.059 63.395 3.661 1.00 0.00 H
+ATOM 8457 1HB ARG I 66 5.256 64.248 4.495 1.00 0.00 H
+ATOM 8458 2HB ARG I 66 4.475 64.645 6.027 1.00 0.00 H
+ATOM 8459 1HG ARG I 66 4.015 62.410 6.553 1.00 0.00 H
+ATOM 8460 2HG ARG I 66 4.440 61.856 4.916 1.00 0.00 H
+ATOM 8461 1HD ARG I 66 6.179 61.252 6.382 1.00 0.00 H
+ATOM 8462 2HD ARG I 66 6.774 62.567 5.349 1.00 0.00 H
+ATOM 8463 HE ARG I 66 5.836 63.734 7.733 1.00 0.00 H
+ATOM 8464 1HH1 ARG I 66 8.294 61.514 6.611 1.00 0.00 H
+ATOM 8465 2HH1 ARG I 66 9.451 61.926 7.851 1.00 0.00 H
+ATOM 8466 1HH2 ARG I 66 7.424 64.305 9.427 1.00 0.00 H
+ATOM 8467 2HH2 ARG I 66 8.949 63.462 9.404 1.00 0.00 H
+ATOM 8468 N HIS I 67 1.305 64.749 6.044 1.00 72.63 N
+ATOM 8469 CA HIS I 67 0.335 64.436 7.084 1.00 73.73 C
+ATOM 8470 C HIS I 67 -1.102 64.383 6.550 1.00 74.97 C
+ATOM 8471 O HIS I 67 -2.051 64.332 7.331 1.00 76.99 O
+ATOM 8472 CB HIS I 67 0.406 65.479 8.209 1.00 65.78 C
+ATOM 8473 CG HIS I 67 1.765 65.584 8.841 1.00 66.08 C
+ATOM 8474 ND1 HIS I 67 2.529 64.484 9.168 1.00 66.88 N
+ATOM 8475 CD2 HIS I 67 2.477 66.667 9.225 1.00 60.13 C
+ATOM 8476 CE1 HIS I 67 3.668 64.896 9.707 1.00 62.77 C
+ATOM 8477 NE2 HIS I 67 3.651 66.212 9.756 1.00 64.15 N
+ATOM 8478 H HIS I 67 1.423 65.716 5.756 1.00 0.00 H
+ATOM 8479 HA HIS I 67 0.564 63.460 7.512 1.00 0.00 H
+ATOM 8480 1HB HIS I 67 0.125 66.462 7.818 1.00 0.00 H
+ATOM 8481 2HB HIS I 67 -0.312 65.220 8.991 1.00 0.00 H
+ATOM 8482 HD2 HIS I 67 2.182 67.700 9.135 1.00 0.00 H
+ATOM 8483 HE1 HIS I 67 4.477 64.257 10.063 1.00 0.00 H
+ATOM 8484 HE2 HIS I 67 4.390 66.820 10.134 1.00 0.00 H
+ATOM 8485 N GLY I 68 -1.265 64.395 5.220 1.00 75.33 N
+ATOM 8486 CA GLY I 68 -2.609 64.378 4.641 1.00 76.50 C
+ATOM 8487 C GLY I 68 -2.797 65.594 3.750 1.00 76.93 C
+ATOM 8488 O GLY I 68 -1.840 66.104 3.172 1.00 74.63 O
+ATOM 8489 H GLY I 68 -0.461 64.431 4.601 1.00 0.00 H
+ATOM 8490 1HA GLY I 68 -2.743 63.466 4.060 1.00 0.00 H
+ATOM 8491 2HA GLY I 68 -3.354 64.377 5.432 1.00 0.00 H
+ATOM 8492 N VAL I 69 -4.039 66.043 3.591 1.00 78.39 N
+ATOM 8493 CA VAL I 69 -4.258 67.201 2.732 1.00 81.69 C
+ATOM 8494 C VAL I 69 -4.922 68.297 3.542 1.00 83.09 C
+ATOM 8495 O VAL I 69 -5.537 68.031 4.576 1.00 83.44 O
+ATOM 8496 CB VAL I 69 -5.129 66.847 1.509 1.00 80.97 C
+ATOM 8497 CG1 VAL I 69 -4.439 65.775 0.685 1.00 77.43 C
+ATOM 8498 CG2 VAL I 69 -6.492 66.389 1.960 1.00 77.06 C
+ATOM 8499 H VAL I 69 -4.810 65.597 4.067 1.00 0.00 H
+ATOM 8500 HA VAL I 69 -3.302 67.577 2.379 1.00 0.00 H
+ATOM 8501 HB VAL I 69 -5.230 67.734 0.879 1.00 0.00 H
+ATOM 8502 1HG1 VAL I 69 -5.043 65.545 -0.187 1.00 0.00 H
+ATOM 8503 2HG1 VAL I 69 -3.471 66.133 0.376 1.00 0.00 H
+ATOM 8504 3HG1 VAL I 69 -4.315 64.876 1.279 1.00 0.00 H
+ATOM 8505 1HG2 VAL I 69 -7.101 66.154 1.085 1.00 0.00 H
+ATOM 8506 2HG2 VAL I 69 -6.390 65.501 2.583 1.00 0.00 H
+ATOM 8507 3HG2 VAL I 69 -6.970 67.185 2.533 1.00 0.00 H
+ATOM 8508 N ILE I 70 -4.768 69.533 3.078 1.00 84.21 N
+ATOM 8509 CA ILE I 70 -5.387 70.652 3.764 1.00 85.32 C
+ATOM 8510 C ILE I 70 -5.756 71.721 2.731 1.00 86.92 C
+ATOM 8511 O ILE I 70 -5.084 71.873 1.711 1.00 87.00 O
+ATOM 8512 CB ILE I 70 -4.404 71.197 4.821 1.00 85.89 C
+ATOM 8513 CG1 ILE I 70 -5.109 72.126 5.761 1.00 84.78 C
+ATOM 8514 CG2 ILE I 70 -3.257 71.910 4.126 1.00 83.84 C
+ATOM 8515 CD1 ILE I 70 -4.331 72.363 7.015 1.00 79.57 C
+ATOM 8516 H ILE I 70 -4.213 69.687 2.247 1.00 0.00 H
+ATOM 8517 HA ILE I 70 -6.293 70.324 4.260 1.00 0.00 H
+ATOM 8518 HB ILE I 70 -4.005 70.371 5.409 1.00 0.00 H
+ATOM 8519 1HG1 ILE I 70 -5.296 73.082 5.274 1.00 0.00 H
+ATOM 8520 2HG1 ILE I 70 -6.059 71.676 6.036 1.00 0.00 H
+ATOM 8521 1HG2 ILE I 70 -2.554 72.286 4.859 1.00 0.00 H
+ATOM 8522 2HG2 ILE I 70 -2.754 71.202 3.468 1.00 0.00 H
+ATOM 8523 3HG2 ILE I 70 -3.652 72.746 3.541 1.00 0.00 H
+ATOM 8524 1HD1 ILE I 70 -4.903 72.992 7.656 1.00 0.00 H
+ATOM 8525 2HD1 ILE I 70 -4.148 71.418 7.518 1.00 0.00 H
+ATOM 8526 3HD1 ILE I 70 -3.385 72.838 6.776 1.00 0.00 H
+ATOM 8527 N GLU I 71 -6.828 72.453 2.987 1.00 87.83 N
+ATOM 8528 CA GLU I 71 -7.189 73.505 2.051 1.00 88.54 C
+ATOM 8529 C GLU I 71 -7.183 74.873 2.677 1.00 88.59 C
+ATOM 8530 O GLU I 71 -7.637 75.065 3.811 1.00 89.84 O
+ATOM 8531 CB GLU I 71 -8.561 73.250 1.435 1.00 90.92 C
+ATOM 8532 CG GLU I 71 -8.624 72.019 0.575 1.00 93.57 C
+ATOM 8533 CD GLU I 71 -9.966 71.805 -0.067 1.00 97.01 C
+ATOM 8534 OE1 GLU I 71 -10.848 72.590 0.176 1.00 98.79 O
+ATOM 8535 OE2 GLU I 71 -10.110 70.856 -0.802 1.00 97.14 O
+ATOM 8536 H GLU I 71 -7.379 72.294 3.814 1.00 0.00 H
+ATOM 8537 HA GLU I 71 -6.451 73.517 1.252 1.00 0.00 H
+ATOM 8538 1HB GLU I 71 -9.306 73.158 2.226 1.00 0.00 H
+ATOM 8539 2HB GLU I 71 -8.850 74.109 0.811 1.00 0.00 H
+ATOM 8540 1HG GLU I 71 -7.881 72.146 -0.198 1.00 0.00 H
+ATOM 8541 2HG GLU I 71 -8.359 71.148 1.169 1.00 0.00 H
+ATOM 8542 N SER I 72 -6.703 75.829 1.901 1.00 88.23 N
+ATOM 8543 CA SER I 72 -6.732 77.236 2.270 1.00 88.88 C
+ATOM 8544 C SER I 72 -8.014 77.820 1.690 1.00 90.65 C
+ATOM 8545 O SER I 72 -8.324 77.560 0.522 1.00 88.92 O
+ATOM 8546 CB SER I 72 -5.524 77.902 1.690 1.00 86.16 C
+ATOM 8547 OG SER I 72 -5.499 77.704 0.329 1.00 88.94 O
+ATOM 8548 H SER I 72 -6.329 75.566 0.989 1.00 0.00 H
+ATOM 8549 HA SER I 72 -6.746 77.343 3.361 1.00 0.00 H
+ATOM 8550 1HB SER I 72 -5.553 78.955 1.896 1.00 0.00 H
+ATOM 8551 2HB SER I 72 -4.627 77.497 2.138 1.00 0.00 H
+ATOM 8552 HG SER I 72 -5.361 76.748 0.207 1.00 0.00 H
+ATOM 8553 N GLU I 73 -8.719 78.627 2.471 1.00 92.35 N
+ATOM 8554 CA GLU I 73 -10.008 79.157 2.049 1.00 94.17 C
+ATOM 8555 C GLU I 73 -10.065 80.675 1.997 1.00 94.92 C
+ATOM 8556 O GLU I 73 -9.179 81.348 2.535 1.00 96.37 O
+ATOM 8557 OXT GLU I 73 -11.094 81.208 1.625 1.00 0.00 O
+ATOM 8558 CB GLU I 73 -11.104 78.651 2.975 1.00 94.79 C
+ATOM 8559 CG GLU I 73 -11.250 77.115 3.013 1.00 95.00 C
+ATOM 8560 CD GLU I 73 -12.308 76.647 3.976 1.00 97.43 C
+ATOM 8561 OE1 GLU I 73 -13.462 76.706 3.637 1.00 98.60 O
+ATOM 8562 OE2 GLU I 73 -11.952 76.221 5.062 1.00 98.19 O
+ATOM 8563 H GLU I 73 -8.378 78.837 3.401 1.00 0.00 H
+ATOM 8564 HA GLU I 73 -10.224 78.778 1.043 1.00 0.00 H
+ATOM 8565 1HB GLU I 73 -10.913 78.992 3.983 1.00 0.00 H
+ATOM 8566 2HB GLU I 73 -12.070 79.071 2.650 1.00 0.00 H
+ATOM 8567 1HG GLU I 73 -11.508 76.782 2.015 1.00 0.00 H
+ATOM 8568 2HG GLU I 73 -10.298 76.642 3.279 1.00 0.00 H
+TER
+ATOM 8570 N SER J 7 14.387 65.915 9.745 1.00 78.91 N
+ATOM 8571 CA SER J 7 13.733 67.167 10.105 1.00 80.17 C
+ATOM 8572 C SER J 7 12.238 67.070 9.851 1.00 79.74 C
+ATOM 8573 O SER J 7 11.796 67.090 8.700 1.00 80.73 O
+ATOM 8574 CB SER J 7 14.333 68.303 9.303 1.00 82.70 C
+ATOM 8575 OG SER J 7 13.707 69.518 9.592 1.00 89.88 O
+ATOM 8576 1H SER J 7 15.136 65.722 10.391 1.00 0.00 H
+ATOM 8577 2H SER J 7 13.709 65.169 9.780 1.00 0.00 H
+ATOM 8578 3H SER J 7 14.755 65.985 8.808 1.00 0.00 H
+ATOM 8579 HA SER J 7 13.894 67.358 11.167 1.00 0.00 H
+ATOM 8580 1HB SER J 7 15.396 68.386 9.524 1.00 0.00 H
+ATOM 8581 2HB SER J 7 14.230 68.082 8.241 1.00 0.00 H
+ATOM 8582 HG SER J 7 13.963 69.754 10.499 1.00 0.00 H
+ATOM 8583 N ASP J 8 11.460 66.925 10.923 1.00 77.85 N
+ATOM 8584 CA ASP J 8 10.010 66.798 10.813 1.00 75.99 C
+ATOM 8585 C ASP J 8 9.377 68.179 10.703 1.00 75.14 C
+ATOM 8586 O ASP J 8 10.056 69.193 10.883 1.00 73.78 O
+ATOM 8587 CB ASP J 8 9.439 66.033 12.023 1.00 78.53 C
+ATOM 8588 CG ASP J 8 8.132 65.255 11.715 1.00 74.89 C
+ATOM 8589 OD1 ASP J 8 7.451 65.597 10.763 1.00 69.81 O
+ATOM 8590 OD2 ASP J 8 7.846 64.310 12.413 1.00 68.83 O
+ATOM 8591 H ASP J 8 11.883 66.920 11.843 1.00 0.00 H
+ATOM 8592 HA ASP J 8 9.769 66.246 9.902 1.00 0.00 H
+ATOM 8593 1HB ASP J 8 10.185 65.327 12.394 1.00 0.00 H
+ATOM 8594 2HB ASP J 8 9.231 66.737 12.829 1.00 0.00 H
+ATOM 8595 N PHE J 9 8.073 68.206 10.449 1.00 73.35 N
+ATOM 8596 CA PHE J 9 7.345 69.461 10.301 1.00 73.03 C
+ATOM 8597 C PHE J 9 5.906 69.390 10.777 1.00 72.11 C
+ATOM 8598 O PHE J 9 5.333 68.309 10.953 1.00 72.58 O
+ATOM 8599 CB PHE J 9 7.328 69.911 8.830 1.00 63.13 C
+ATOM 8600 CG PHE J 9 6.561 69.026 7.896 1.00 62.28 C
+ATOM 8601 CD1 PHE J 9 5.238 69.301 7.621 1.00 64.36 C
+ATOM 8602 CD2 PHE J 9 7.147 67.937 7.276 1.00 65.30 C
+ATOM 8603 CE1 PHE J 9 4.514 68.527 6.749 1.00 68.73 C
+ATOM 8604 CE2 PHE J 9 6.414 67.158 6.407 1.00 60.99 C
+ATOM 8605 CZ PHE J 9 5.100 67.464 6.144 1.00 62.14 C
+ATOM 8606 H PHE J 9 7.595 67.315 10.341 1.00 0.00 H
+ATOM 8607 HA PHE J 9 7.849 70.214 10.904 1.00 0.00 H
+ATOM 8608 1HB PHE J 9 6.891 70.903 8.759 1.00 0.00 H
+ATOM 8609 2HB PHE J 9 8.331 69.979 8.464 1.00 0.00 H
+ATOM 8610 HD1 PHE J 9 4.771 70.151 8.109 1.00 0.00 H
+ATOM 8611 HD2 PHE J 9 8.193 67.693 7.477 1.00 0.00 H
+ATOM 8612 HE1 PHE J 9 3.479 68.765 6.542 1.00 0.00 H
+ATOM 8613 HE2 PHE J 9 6.875 66.302 5.924 1.00 0.00 H
+ATOM 8614 HZ PHE J 9 4.537 66.864 5.464 1.00 0.00 H
+ATOM 8615 N VAL J 10 5.311 70.563 10.944 1.00 71.97 N
+ATOM 8616 CA VAL J 10 3.905 70.659 11.308 1.00 70.64 C
+ATOM 8617 C VAL J 10 3.175 71.480 10.249 1.00 69.90 C
+ATOM 8618 O VAL J 10 3.766 72.351 9.616 1.00 69.94 O
+ATOM 8619 CB VAL J 10 3.759 71.368 12.674 1.00 61.36 C
+ATOM 8620 CG1 VAL J 10 4.505 70.589 13.771 1.00 60.40 C
+ATOM 8621 CG2 VAL J 10 4.283 72.783 12.560 1.00 61.69 C
+ATOM 8622 H VAL J 10 5.868 71.403 10.811 1.00 0.00 H
+ATOM 8623 HA VAL J 10 3.471 69.662 11.356 1.00 0.00 H
+ATOM 8624 HB VAL J 10 2.702 71.396 12.950 1.00 0.00 H
+ATOM 8625 1HG1 VAL J 10 4.386 71.098 14.718 1.00 0.00 H
+ATOM 8626 2HG1 VAL J 10 4.103 69.581 13.843 1.00 0.00 H
+ATOM 8627 3HG1 VAL J 10 5.567 70.542 13.527 1.00 0.00 H
+ATOM 8628 1HG2 VAL J 10 4.164 73.291 13.516 1.00 0.00 H
+ATOM 8629 2HG2 VAL J 10 5.339 72.759 12.287 1.00 0.00 H
+ATOM 8630 3HG2 VAL J 10 3.720 73.314 11.794 1.00 0.00 H
+ATOM 8631 N VAL J 11 1.879 71.214 10.076 1.00 69.57 N
+ATOM 8632 CA VAL J 11 1.069 72.000 9.138 1.00 69.19 C
+ATOM 8633 C VAL J 11 0.024 72.765 9.909 1.00 70.39 C
+ATOM 8634 O VAL J 11 -0.817 72.165 10.584 1.00 68.56 O
+ATOM 8635 CB VAL J 11 0.330 71.106 8.136 1.00 68.45 C
+ATOM 8636 CG1 VAL J 11 -0.506 71.959 7.179 1.00 68.99 C
+ATOM 8637 CG2 VAL J 11 1.300 70.225 7.422 1.00 66.41 C
+ATOM 8638 H VAL J 11 1.443 70.460 10.604 1.00 0.00 H
+ATOM 8639 HA VAL J 11 1.708 72.705 8.605 1.00 0.00 H
+ATOM 8640 HB VAL J 11 -0.352 70.508 8.667 1.00 0.00 H
+ATOM 8641 1HG1 VAL J 11 -1.053 71.303 6.499 1.00 0.00 H
+ATOM 8642 2HG1 VAL J 11 -1.214 72.555 7.753 1.00 0.00 H
+ATOM 8643 3HG1 VAL J 11 0.125 72.618 6.608 1.00 0.00 H
+ATOM 8644 1HG2 VAL J 11 0.754 69.571 6.742 1.00 0.00 H
+ATOM 8645 2HG2 VAL J 11 1.993 70.820 6.872 1.00 0.00 H
+ATOM 8646 3HG2 VAL J 11 1.829 69.632 8.147 1.00 0.00 H
+ATOM 8647 N ILE J 12 0.061 74.087 9.827 1.00 71.43 N
+ATOM 8648 CA ILE J 12 -0.880 74.866 10.604 1.00 72.12 C
+ATOM 8649 C ILE J 12 -1.752 75.779 9.733 1.00 73.68 C
+ATOM 8650 O ILE J 12 -1.258 76.617 8.986 1.00 72.26 O
+ATOM 8651 CB ILE J 12 -0.109 75.724 11.629 1.00 68.42 C
+ATOM 8652 CG1 ILE J 12 0.732 74.803 12.535 1.00 64.63 C
+ATOM 8653 CG2 ILE J 12 -1.100 76.509 12.490 1.00 70.66 C
+ATOM 8654 CD1 ILE J 12 1.678 75.540 13.413 1.00 53.36 C
+ATOM 8655 H ILE J 12 0.770 74.536 9.260 1.00 0.00 H
+ATOM 8656 HA ILE J 12 -1.536 74.192 11.143 1.00 0.00 H
+ATOM 8657 HB ILE J 12 0.565 76.411 11.113 1.00 0.00 H
+ATOM 8658 1HG1 ILE J 12 0.072 74.227 13.146 1.00 0.00 H
+ATOM 8659 2HG1 ILE J 12 1.319 74.120 11.921 1.00 0.00 H
+ATOM 8660 1HG2 ILE J 12 -0.548 77.093 13.220 1.00 0.00 H
+ATOM 8661 2HG2 ILE J 12 -1.701 77.173 11.858 1.00 0.00 H
+ATOM 8662 3HG2 ILE J 12 -1.757 75.816 13.006 1.00 0.00 H
+ATOM 8663 1HD1 ILE J 12 2.237 74.829 14.030 1.00 0.00 H
+ATOM 8664 2HD1 ILE J 12 2.369 76.110 12.798 1.00 0.00 H
+ATOM 8665 3HD1 ILE J 12 1.118 76.214 14.045 1.00 0.00 H
+ATOM 8666 N LYS J 13 -3.062 75.609 9.869 1.00 75.11 N
+ATOM 8667 CA LYS J 13 -4.040 76.440 9.167 1.00 75.96 C
+ATOM 8668 C LYS J 13 -4.752 77.372 10.105 1.00 77.08 C
+ATOM 8669 O LYS J 13 -5.363 76.963 11.095 1.00 77.11 O
+ATOM 8670 CB LYS J 13 -5.066 75.602 8.444 1.00 67.66 C
+ATOM 8671 CG LYS J 13 -6.182 76.384 7.787 1.00 71.11 C
+ATOM 8672 CD LYS J 13 -7.147 75.445 7.105 1.00 71.71 C
+ATOM 8673 CE LYS J 13 -8.422 76.173 6.623 1.00 72.95 C
+ATOM 8674 NZ LYS J 13 -9.347 75.234 5.938 1.00 67.34 N
+ATOM 8675 H LYS J 13 -3.406 74.876 10.482 1.00 0.00 H
+ATOM 8676 HA LYS J 13 -3.516 77.048 8.432 1.00 0.00 H
+ATOM 8677 1HB LYS J 13 -4.571 75.081 7.658 1.00 0.00 H
+ATOM 8678 2HB LYS J 13 -5.488 74.883 9.108 1.00 0.00 H
+ATOM 8679 1HG LYS J 13 -6.722 76.953 8.549 1.00 0.00 H
+ATOM 8680 2HG LYS J 13 -5.761 77.088 7.063 1.00 0.00 H
+ATOM 8681 1HD LYS J 13 -6.649 74.990 6.244 1.00 0.00 H
+ATOM 8682 2HD LYS J 13 -7.427 74.652 7.798 1.00 0.00 H
+ATOM 8683 1HE LYS J 13 -8.926 76.603 7.477 1.00 0.00 H
+ATOM 8684 2HE LYS J 13 -8.164 76.967 5.928 1.00 0.00 H
+ATOM 8685 1HZ LYS J 13 -10.203 75.702 5.622 1.00 0.00 H
+ATOM 8686 2HZ LYS J 13 -8.855 74.876 5.136 1.00 0.00 H
+ATOM 8687 3HZ LYS J 13 -9.600 74.487 6.545 1.00 0.00 H
+ATOM 8688 N ALA J 14 -4.697 78.649 9.802 1.00 77.83 N
+ATOM 8689 CA ALA J 14 -5.360 79.590 10.659 1.00 79.34 C
+ATOM 8690 C ALA J 14 -6.869 79.528 10.413 1.00 79.20 C
+ATOM 8691 O ALA J 14 -7.326 79.592 9.272 1.00 76.05 O
+ATOM 8692 CB ALA J 14 -4.849 80.981 10.372 1.00 77.96 C
+ATOM 8693 H ALA J 14 -4.188 78.955 8.964 1.00 0.00 H
+ATOM 8694 HA ALA J 14 -5.164 79.317 11.690 1.00 0.00 H
+ATOM 8695 1HB ALA J 14 -5.336 81.710 11.016 1.00 0.00 H
+ATOM 8696 2HB ALA J 14 -3.782 81.040 10.525 1.00 0.00 H
+ATOM 8697 3HB ALA J 14 -5.070 81.186 9.354 1.00 0.00 H
+ATOM 8698 N LEU J 15 -7.646 79.441 11.473 1.00 81.81 N
+ATOM 8699 CA LEU J 15 -9.093 79.469 11.335 1.00 84.89 C
+ATOM 8700 C LEU J 15 -9.591 80.853 11.743 1.00 86.74 C
+ATOM 8701 O LEU J 15 -10.584 81.383 11.264 1.00 87.11 O
+ATOM 8702 CB LEU J 15 -9.708 78.348 12.163 1.00 83.27 C
+ATOM 8703 CG LEU J 15 -9.270 76.920 11.747 1.00 85.46 C
+ATOM 8704 CD1 LEU J 15 -9.848 75.895 12.727 1.00 88.95 C
+ATOM 8705 CD2 LEU J 15 -9.747 76.665 10.330 1.00 92.06 C
+ATOM 8706 H LEU J 15 -7.240 79.372 12.415 1.00 0.00 H
+ATOM 8707 HA LEU J 15 -9.344 79.282 10.291 1.00 0.00 H
+ATOM 8708 1HB LEU J 15 -9.383 78.477 13.177 1.00 0.00 H
+ATOM 8709 2HB LEU J 15 -10.787 78.419 12.120 1.00 0.00 H
+ATOM 8710 HG LEU J 15 -8.202 76.834 11.753 1.00 0.00 H
+ATOM 8711 1HD1 LEU J 15 -9.562 74.888 12.437 1.00 0.00 H
+ATOM 8712 2HD1 LEU J 15 -9.464 76.084 13.722 1.00 0.00 H
+ATOM 8713 3HD1 LEU J 15 -10.936 75.957 12.735 1.00 0.00 H
+ATOM 8714 1HD2 LEU J 15 -9.437 75.674 10.006 1.00 0.00 H
+ATOM 8715 2HD2 LEU J 15 -10.839 76.745 10.285 1.00 0.00 H
+ATOM 8716 3HD2 LEU J 15 -9.302 77.422 9.675 1.00 0.00 H
+ATOM 8717 N GLU J 16 -8.823 81.462 12.653 1.00 86.85 N
+ATOM 8718 CA GLU J 16 -8.976 82.788 13.284 1.00 88.10 C
+ATOM 8719 C GLU J 16 -7.577 83.448 13.157 1.00 89.13 C
+ATOM 8720 O GLU J 16 -6.598 82.748 13.023 1.00 88.90 O
+ATOM 8721 CB GLU J 16 -9.415 82.627 14.720 1.00 90.33 C
+ATOM 8722 CG GLU J 16 -9.563 83.858 15.520 1.00 91.71 C
+ATOM 8723 CD GLU J 16 -10.132 83.527 16.879 1.00 96.82 C
+ATOM 8724 OE1 GLU J 16 -9.432 83.572 17.853 1.00 97.96 O
+ATOM 8725 OE2 GLU J 16 -11.274 83.199 16.932 1.00100.04 O
+ATOM 8726 H GLU J 16 -8.061 80.897 12.997 1.00 0.00 H
+ATOM 8727 HA GLU J 16 -9.697 83.406 12.719 1.00 0.00 H
+ATOM 8728 1HB GLU J 16 -10.408 82.186 14.694 1.00 0.00 H
+ATOM 8729 2HB GLU J 16 -8.741 81.967 15.276 1.00 0.00 H
+ATOM 8730 1HG GLU J 16 -10.253 84.535 15.011 1.00 0.00 H
+ATOM 8731 2HG GLU J 16 -8.596 84.317 15.626 1.00 0.00 H
+ATOM 8732 N ASP J 17 -7.548 84.761 13.009 1.00 88.88 N
+ATOM 8733 CA ASP J 17 -6.263 85.468 12.848 1.00 88.57 C
+ATOM 8734 C ASP J 17 -5.252 85.453 14.013 1.00 88.81 C
+ATOM 8735 O ASP J 17 -6.029 84.707 14.596 1.00 90.09 O
+ATOM 8736 CB ASP J 17 -6.481 86.962 12.557 1.00 95.80 C
+ATOM 8737 CG ASP J 17 -6.975 87.272 11.205 1.00 97.64 C
+ATOM 8738 OD1 ASP J 17 -7.063 88.439 10.879 1.00 97.04 O
+ATOM 8739 OD2 ASP J 17 -7.204 86.350 10.468 1.00 98.30 O
+ATOM 8740 H ASP J 17 -8.399 85.296 13.057 1.00 0.00 H
+ATOM 8741 HA ASP J 17 -5.733 84.982 12.014 1.00 0.00 H
+ATOM 8742 1HB ASP J 17 -5.536 87.456 12.770 1.00 0.00 H
+ATOM 8743 2HB ASP J 17 -7.239 87.359 13.263 1.00 0.00 H
+ATOM 8744 N GLY J 18 -4.255 85.120 13.226 1.00 88.03 N
+ATOM 8745 CA GLY J 18 -3.391 85.561 14.288 1.00 86.81 C
+ATOM 8746 C GLY J 18 -2.906 84.392 15.140 1.00 87.19 C
+ATOM 8747 O GLY J 18 -2.739 84.487 16.321 1.00 87.10 O
+ATOM 8748 H GLY J 18 -3.361 85.250 12.766 1.00 0.00 H
+ATOM 8749 1HA GLY J 18 -2.538 86.115 13.869 1.00 0.00 H
+ATOM 8750 2HA GLY J 18 -3.944 86.243 14.924 1.00 0.00 H
+ATOM 8751 N VAL J 19 -2.618 83.334 14.393 1.00 86.93 N
+ATOM 8752 CA VAL J 19 -2.122 82.084 14.970 1.00 84.43 C
+ATOM 8753 C VAL J 19 -0.793 82.301 15.662 1.00 82.61 C
+ATOM 8754 O VAL J 19 -0.496 81.715 16.701 1.00 82.88 O
+ATOM 8755 CB VAL J 19 -1.943 81.058 13.862 1.00 90.24 C
+ATOM 8756 CG1 VAL J 19 -1.253 79.912 14.423 1.00 89.22 C
+ATOM 8757 CG2 VAL J 19 -3.262 80.713 13.362 1.00 89.04 C
+ATOM 8758 H VAL J 19 -2.798 83.426 13.421 1.00 0.00 H
+ATOM 8759 HA VAL J 19 -2.824 81.690 15.645 1.00 0.00 H
+ATOM 8760 HB VAL J 19 -1.326 81.468 13.061 1.00 0.00 H
+ATOM 8761 1HG1 VAL J 19 -1.159 79.195 13.660 1.00 0.00 H
+ATOM 8762 2HG1 VAL J 19 -0.293 80.241 14.787 1.00 0.00 H
+ATOM 8763 3HG1 VAL J 19 -1.878 79.515 15.243 1.00 0.00 H
+ATOM 8764 1HG2 VAL J 19 -3.152 79.974 12.587 1.00 0.00 H
+ATOM 8765 2HG2 VAL J 19 -3.897 80.315 14.142 1.00 0.00 H
+ATOM 8766 3HG2 VAL J 19 -3.757 81.602 12.960 1.00 0.00 H
+ATOM 8767 N ASN J 20 0.022 83.119 15.030 1.00 81.88 N
+ATOM 8768 CA ASN J 20 1.321 83.513 15.577 1.00 82.66 C
+ATOM 8769 C ASN J 20 2.170 82.322 15.913 1.00 82.47 C
+ATOM 8770 O ASN J 20 2.431 82.027 17.089 1.00 81.87 O
+ATOM 8771 CB ASN J 20 1.112 84.389 16.786 1.00 91.72 C
+ATOM 8772 CG ASN J 20 2.363 85.027 17.120 1.00 96.16 C
+ATOM 8773 OD1 ASN J 20 3.406 84.500 16.730 1.00 98.54 O
+ATOM 8774 ND2 ASN J 20 2.306 86.133 17.794 1.00100.55 N
+ATOM 8775 H ASN J 20 -0.259 83.529 14.165 1.00 0.00 H
+ATOM 8776 HA ASN J 20 1.845 84.103 14.851 1.00 0.00 H
+ATOM 8777 1HB ASN J 20 0.347 85.144 16.578 1.00 0.00 H
+ATOM 8778 2HB ASN J 20 0.773 83.788 17.635 1.00 0.00 H
+ATOM 8779 1HD2 ASN J 20 3.119 86.618 18.036 1.00 0.00 H
+ATOM 8780 2HD2 ASN J 20 1.409 86.459 18.107 1.00 0.00 H
+ATOM 8781 N VAL J 21 2.625 81.609 14.894 1.00 81.19 N
+ATOM 8782 CA VAL J 21 3.360 80.419 15.207 1.00 78.96 C
+ATOM 8783 C VAL J 21 4.731 80.843 15.719 1.00 77.44 C
+ATOM 8784 O VAL J 21 5.427 81.610 15.046 1.00 76.23 O
+ATOM 8785 CB VAL J 21 3.483 79.524 13.955 1.00 81.72 C
+ATOM 8786 CG1 VAL J 21 4.318 78.307 14.266 1.00 78.85 C
+ATOM 8787 CG2 VAL J 21 2.109 79.136 13.475 1.00 77.76 C
+ATOM 8788 H VAL J 21 2.446 81.909 13.922 1.00 0.00 H
+ATOM 8789 HA VAL J 21 2.856 79.863 15.997 1.00 0.00 H
+ATOM 8790 HB VAL J 21 4.007 80.076 13.171 1.00 0.00 H
+ATOM 8791 1HG1 VAL J 21 4.411 77.685 13.384 1.00 0.00 H
+ATOM 8792 2HG1 VAL J 21 5.326 78.608 14.618 1.00 0.00 H
+ATOM 8793 3HG1 VAL J 21 3.811 77.769 15.058 1.00 0.00 H
+ATOM 8794 1HG2 VAL J 21 2.168 78.519 12.564 1.00 0.00 H
+ATOM 8795 2HG2 VAL J 21 1.589 78.567 14.263 1.00 0.00 H
+ATOM 8796 3HG2 VAL J 21 1.537 80.039 13.250 1.00 0.00 H
+ATOM 8797 N ILE J 22 5.132 80.380 16.904 1.00 75.66 N
+ATOM 8798 CA ILE J 22 6.412 80.767 17.478 1.00 76.71 C
+ATOM 8799 C ILE J 22 7.436 79.667 17.631 1.00 76.44 C
+ATOM 8800 O ILE J 22 7.137 78.565 18.095 1.00 74.73 O
+ATOM 8801 CB ILE J 22 6.260 81.519 18.824 1.00 83.25 C
+ATOM 8802 CG1 ILE J 22 5.626 82.880 18.627 1.00 84.12 C
+ATOM 8803 CG2 ILE J 22 7.592 81.612 19.508 1.00 80.60 C
+ATOM 8804 CD1 ILE J 22 5.317 83.597 19.945 1.00 84.25 C
+ATOM 8805 H ILE J 22 4.508 79.758 17.421 1.00 0.00 H
+ATOM 8806 HA ILE J 22 6.848 81.473 16.779 1.00 0.00 H
+ATOM 8807 HB ILE J 22 5.578 80.970 19.466 1.00 0.00 H
+ATOM 8808 1HG1 ILE J 22 6.272 83.484 18.041 1.00 0.00 H
+ATOM 8809 2HG1 ILE J 22 4.713 82.745 18.106 1.00 0.00 H
+ATOM 8810 1HG2 ILE J 22 7.468 82.138 20.459 1.00 0.00 H
+ATOM 8811 2HG2 ILE J 22 7.982 80.599 19.696 1.00 0.00 H
+ATOM 8812 3HG2 ILE J 22 8.287 82.164 18.860 1.00 0.00 H
+ATOM 8813 1HD1 ILE J 22 4.838 84.546 19.710 1.00 0.00 H
+ATOM 8814 2HD1 ILE J 22 4.666 83.015 20.519 1.00 0.00 H
+ATOM 8815 3HD1 ILE J 22 6.248 83.763 20.479 1.00 0.00 H
+ATOM 8816 N GLY J 23 8.673 79.971 17.222 1.00 76.11 N
+ATOM 8817 CA GLY J 23 9.758 79.038 17.411 1.00 77.40 C
+ATOM 8818 C GLY J 23 10.440 79.308 18.758 1.00 78.57 C
+ATOM 8819 O GLY J 23 10.728 80.458 19.111 1.00 79.17 O
+ATOM 8820 H GLY J 23 8.853 80.897 16.826 1.00 0.00 H
+ATOM 8821 1HA GLY J 23 9.376 78.013 17.383 1.00 0.00 H
+ATOM 8822 2HA GLY J 23 10.488 79.137 16.606 1.00 0.00 H
+ATOM 8823 N LEU J 24 10.734 78.218 19.471 1.00 77.55 N
+ATOM 8824 CA LEU J 24 11.424 78.244 20.771 1.00 77.69 C
+ATOM 8825 C LEU J 24 12.846 77.724 20.579 1.00 76.63 C
+ATOM 8826 O LEU J 24 13.043 76.656 19.976 1.00 76.75 O
+ATOM 8827 CB LEU J 24 10.686 77.368 21.791 1.00 81.29 C
+ATOM 8828 CG LEU J 24 9.361 77.935 22.378 1.00 78.46 C
+ATOM 8829 CD1 LEU J 24 8.254 77.831 21.332 1.00 78.18 C
+ATOM 8830 CD2 LEU J 24 8.966 77.161 23.652 1.00 81.80 C
+ATOM 8831 H LEU J 24 10.442 77.318 19.109 1.00 0.00 H
+ATOM 8832 HA LEU J 24 11.451 79.264 21.137 1.00 0.00 H
+ATOM 8833 1HB LEU J 24 10.434 76.466 21.280 1.00 0.00 H
+ATOM 8834 2HB LEU J 24 11.356 77.126 22.607 1.00 0.00 H
+ATOM 8835 HG LEU J 24 9.494 78.988 22.622 1.00 0.00 H
+ATOM 8836 1HD1 LEU J 24 7.338 78.241 21.759 1.00 0.00 H
+ATOM 8837 2HD1 LEU J 24 8.496 78.372 20.441 1.00 0.00 H
+ATOM 8838 3HD1 LEU J 24 8.103 76.797 21.067 1.00 0.00 H
+ATOM 8839 1HD2 LEU J 24 8.038 77.568 24.061 1.00 0.00 H
+ATOM 8840 2HD2 LEU J 24 8.824 76.106 23.439 1.00 0.00 H
+ATOM 8841 3HD2 LEU J 24 9.758 77.271 24.395 1.00 0.00 H
+ATOM 8842 N THR J 25 13.832 78.471 21.107 1.00 75.34 N
+ATOM 8843 CA THR J 25 15.238 78.148 20.849 1.00 74.06 C
+ATOM 8844 C THR J 25 15.708 76.808 21.377 1.00 72.75 C
+ATOM 8845 O THR J 25 15.303 76.356 22.447 1.00 71.03 O
+ATOM 8846 CB THR J 25 16.199 79.204 21.442 1.00 74.97 C
+ATOM 8847 OG1 THR J 25 15.976 79.333 22.863 1.00 77.77 O
+ATOM 8848 CG2 THR J 25 16.021 80.547 20.754 1.00 69.86 C
+ATOM 8849 H THR J 25 13.583 79.311 21.617 1.00 0.00 H
+ATOM 8850 HA THR J 25 15.368 78.151 19.778 1.00 0.00 H
+ATOM 8851 HB THR J 25 17.230 78.873 21.285 1.00 0.00 H
+ATOM 8852 HG1 THR J 25 16.627 78.808 23.383 1.00 0.00 H
+ATOM 8853 1HG2 THR J 25 16.725 81.266 21.178 1.00 0.00 H
+ATOM 8854 2HG2 THR J 25 16.219 80.421 19.684 1.00 0.00 H
+ATOM 8855 3HG2 THR J 25 15.009 80.911 20.893 1.00 0.00 H
+ATOM 8856 N ARG J 26 16.620 76.215 20.601 1.00 72.48 N
+ATOM 8857 CA ARG J 26 17.299 74.966 20.919 1.00 72.17 C
+ATOM 8858 C ARG J 26 18.553 75.232 21.737 1.00 70.17 C
+ATOM 8859 O ARG J 26 19.386 76.059 21.363 1.00 68.60 O
+ATOM 8860 CB ARG J 26 17.690 74.229 19.638 1.00 70.03 C
+ATOM 8861 CG ARG J 26 18.265 72.839 19.857 1.00 61.68 C
+ATOM 8862 CD ARG J 26 18.650 72.139 18.574 1.00 60.44 C
+ATOM 8863 NE ARG J 26 17.524 71.945 17.647 1.00 55.89 N
+ATOM 8864 CZ ARG J 26 16.586 70.983 17.744 1.00 52.03 C
+ATOM 8865 NH1 ARG J 26 16.598 70.127 18.737 1.00 55.42 N
+ATOM 8866 NH2 ARG J 26 15.657 70.922 16.816 1.00 58.66 N
+ATOM 8867 H ARG J 26 16.831 76.657 19.714 1.00 0.00 H
+ATOM 8868 HA ARG J 26 16.628 74.339 21.508 1.00 0.00 H
+ATOM 8869 1HB ARG J 26 16.827 74.144 18.976 1.00 0.00 H
+ATOM 8870 2HB ARG J 26 18.445 74.812 19.104 1.00 0.00 H
+ATOM 8871 1HG ARG J 26 19.173 72.938 20.452 1.00 0.00 H
+ATOM 8872 2HG ARG J 26 17.546 72.223 20.398 1.00 0.00 H
+ATOM 8873 1HD ARG J 26 19.411 72.727 18.063 1.00 0.00 H
+ATOM 8874 2HD ARG J 26 19.060 71.159 18.815 1.00 0.00 H
+ATOM 8875 HE ARG J 26 17.444 72.565 16.829 1.00 0.00 H
+ATOM 8876 1HH1 ARG J 26 17.320 70.183 19.433 1.00 0.00 H
+ATOM 8877 2HH1 ARG J 26 15.884 69.411 18.791 1.00 0.00 H
+ATOM 8878 1HH2 ARG J 26 15.700 71.603 16.050 1.00 0.00 H
+ATOM 8879 2HH2 ARG J 26 14.916 70.220 16.854 1.00 0.00 H
+ATOM 8880 N GLY J 27 18.701 74.524 22.848 1.00 69.70 N
+ATOM 8881 CA GLY J 27 19.867 74.691 23.702 1.00 68.97 C
+ATOM 8882 C GLY J 27 19.452 74.831 25.152 1.00 69.46 C
+ATOM 8883 O GLY J 27 18.274 74.727 25.488 1.00 68.44 O
+ATOM 8884 H GLY J 27 17.986 73.864 23.117 1.00 0.00 H
+ATOM 8885 1HA GLY J 27 20.526 73.833 23.590 1.00 0.00 H
+ATOM 8886 2HA GLY J 27 20.434 75.571 23.396 1.00 0.00 H
+ATOM 8887 N ALA J 28 20.429 75.074 26.022 1.00 71.16 N
+ATOM 8888 CA ALA J 28 20.168 75.197 27.449 1.00 72.17 C
+ATOM 8889 C ALA J 28 19.184 76.332 27.737 1.00 72.59 C
+ATOM 8890 O ALA J 28 18.363 76.234 28.645 1.00 71.94 O
+ATOM 8891 CB ALA J 28 21.472 75.442 28.188 1.00 67.63 C
+ATOM 8892 H ALA J 28 21.377 75.149 25.683 1.00 0.00 H
+ATOM 8893 HA ALA J 28 19.727 74.264 27.801 1.00 0.00 H
+ATOM 8894 1HB ALA J 28 21.280 75.509 29.256 1.00 0.00 H
+ATOM 8895 2HB ALA J 28 22.157 74.617 27.992 1.00 0.00 H
+ATOM 8896 3HB ALA J 28 21.913 76.373 27.835 1.00 0.00 H
+ATOM 8897 N ASP J 29 19.280 77.416 26.968 1.00 72.43 N
+ATOM 8898 CA ASP J 29 18.396 78.556 27.149 1.00 74.01 C
+ATOM 8899 C ASP J 29 17.225 78.494 26.173 1.00 75.78 C
+ATOM 8900 O ASP J 29 17.422 78.585 24.957 1.00 76.70 O
+ATOM 8901 CB ASP J 29 19.167 79.860 26.952 1.00 78.92 C
+ATOM 8902 CG ASP J 29 20.210 80.077 28.034 1.00 80.44 C
+ATOM 8903 OD1 ASP J 29 20.044 79.545 29.104 1.00 73.23 O
+ATOM 8904 OD2 ASP J 29 21.184 80.738 27.771 1.00 86.15 O
+ATOM 8905 H ASP J 29 19.974 77.440 26.234 1.00 0.00 H
+ATOM 8906 HA ASP J 29 17.987 78.533 28.166 1.00 0.00 H
+ATOM 8907 1HB ASP J 29 19.650 79.868 25.973 1.00 0.00 H
+ATOM 8908 2HB ASP J 29 18.472 80.697 26.980 1.00 0.00 H
+ATOM 8909 N THR J 30 16.019 78.361 26.713 1.00 77.68 N
+ATOM 8910 CA THR J 30 14.826 78.276 25.874 1.00 79.29 C
+ATOM 8911 C THR J 30 14.150 79.636 25.819 1.00 81.57 C
+ATOM 8912 O THR J 30 13.735 80.165 26.847 1.00 80.45 O
+ATOM 8913 CB THR J 30 13.830 77.238 26.418 1.00 75.24 C
+ATOM 8914 OG1 THR J 30 14.444 75.944 26.430 1.00 71.74 O
+ATOM 8915 CG2 THR J 30 12.573 77.201 25.555 1.00 58.84 C
+ATOM 8916 H THR J 30 15.927 78.294 27.717 1.00 0.00 H
+ATOM 8917 HA THR J 30 15.111 77.996 24.857 1.00 0.00 H
+ATOM 8918 HB THR J 30 13.553 77.505 27.438 1.00 0.00 H
+ATOM 8919 HG1 THR J 30 15.171 75.946 27.065 1.00 0.00 H
+ATOM 8920 1HG2 THR J 30 11.872 76.466 25.961 1.00 0.00 H
+ATOM 8921 2HG2 THR J 30 12.109 78.184 25.569 1.00 0.00 H
+ATOM 8922 3HG2 THR J 30 12.838 76.930 24.532 1.00 0.00 H
+ATOM 8923 N ARG J 31 14.026 80.188 24.628 1.00 84.29 N
+ATOM 8924 CA ARG J 31 13.437 81.516 24.502 1.00 85.97 C
+ATOM 8925 C ARG J 31 12.809 81.771 23.149 1.00 86.57 C
+ATOM 8926 O ARG J 31 12.893 80.956 22.225 1.00 85.99 O
+ATOM 8927 CB ARG J 31 14.485 82.597 24.767 1.00 85.93 C
+ATOM 8928 CG ARG J 31 15.638 82.654 23.772 1.00 92.32 C
+ATOM 8929 CD ARG J 31 16.580 83.750 24.087 1.00 94.27 C
+ATOM 8930 NE ARG J 31 17.711 83.770 23.176 1.00 96.40 N
+ATOM 8931 CZ ARG J 31 17.714 84.394 21.980 1.00 95.42 C
+ATOM 8932 NH1 ARG J 31 16.646 85.036 21.584 1.00 94.69 N
+ATOM 8933 NH2 ARG J 31 18.792 84.358 21.214 1.00 92.99 N
+ATOM 8934 H ARG J 31 14.426 79.728 23.820 1.00 0.00 H
+ATOM 8935 HA ARG J 31 12.663 81.612 25.253 1.00 0.00 H
+ATOM 8936 1HB ARG J 31 14.015 83.583 24.754 1.00 0.00 H
+ATOM 8937 2HB ARG J 31 14.928 82.456 25.760 1.00 0.00 H
+ATOM 8938 1HG ARG J 31 16.184 81.713 23.798 1.00 0.00 H
+ATOM 8939 2HG ARG J 31 15.237 82.819 22.763 1.00 0.00 H
+ATOM 8940 1HD ARG J 31 16.064 84.712 24.019 1.00 0.00 H
+ATOM 8941 2HD ARG J 31 16.959 83.610 25.097 1.00 0.00 H
+ATOM 8942 HE ARG J 31 18.552 83.281 23.455 1.00 0.00 H
+ATOM 8943 1HH1 ARG J 31 15.821 85.058 22.180 1.00 0.00 H
+ATOM 8944 2HH1 ARG J 31 16.637 85.503 20.694 1.00 0.00 H
+ATOM 8945 1HH2 ARG J 31 19.614 83.858 21.525 1.00 0.00 H
+ATOM 8946 2HH2 ARG J 31 18.790 84.825 20.323 1.00 0.00 H
+ATOM 8947 N PHE J 32 12.128 82.900 23.045 1.00 86.18 N
+ATOM 8948 CA PHE J 32 11.510 83.368 21.814 1.00 85.28 C
+ATOM 8949 C PHE J 32 12.510 83.821 20.760 1.00 84.26 C
+ATOM 8950 O PHE J 32 13.329 84.694 21.029 1.00 84.78 O
+ATOM 8951 CB PHE J 32 10.616 84.568 22.172 1.00 90.82 C
+ATOM 8952 CG PHE J 32 10.049 85.301 21.103 1.00 45.00 C
+ATOM 8953 CD1 PHE J 32 9.461 84.686 20.057 1.00 45.00 C
+ATOM 8954 CD2 PHE J 32 10.113 86.674 21.114 1.00 45.00 C
+ATOM 8955 CE1 PHE J 32 8.925 85.398 19.018 1.00 45.00 C
+ATOM 8956 CE2 PHE J 32 9.540 87.386 20.092 1.00 45.00 C
+ATOM 8957 CZ PHE J 32 8.946 86.759 19.037 1.00 45.00 C
+ATOM 8958 H PHE J 32 12.065 83.495 23.862 1.00 0.00 H
+ATOM 8959 HA PHE J 32 10.930 82.544 21.408 1.00 0.00 H
+ATOM 8960 1HB PHE J 32 9.789 84.233 22.798 1.00 0.00 H
+ATOM 8961 2HB PHE J 32 11.233 85.289 22.725 1.00 0.00 H
+ATOM 8962 HD1 PHE J 32 9.475 83.597 20.083 1.00 0.00 H
+ATOM 8963 HD2 PHE J 32 10.590 87.204 21.936 1.00 0.00 H
+ATOM 8964 HE1 PHE J 32 8.543 84.846 18.186 1.00 0.00 H
+ATOM 8965 HE2 PHE J 32 9.578 88.478 20.078 1.00 0.00 H
+ATOM 8966 HZ PHE J 32 8.503 87.348 18.235 1.00 0.00 H
+ATOM 8967 N HIS J 33 12.430 83.257 19.555 1.00 83.55 N
+ATOM 8968 CA HIS J 33 13.317 83.790 18.515 1.00 81.73 C
+ATOM 8969 C HIS J 33 12.560 84.262 17.264 1.00 79.64 C
+ATOM 8970 O HIS J 33 13.049 85.125 16.538 1.00 78.91 O
+ATOM 8971 CB HIS J 33 14.385 82.779 18.094 1.00 87.54 C
+ATOM 8972 CG HIS J 33 13.943 81.594 17.265 1.00 91.83 C
+ATOM 8973 ND1 HIS J 33 13.738 81.696 15.907 1.00 90.43 N
+ATOM 8974 CD2 HIS J 33 13.698 80.295 17.571 1.00 89.04 C
+ATOM 8975 CE1 HIS J 33 13.390 80.533 15.421 1.00 93.17 C
+ATOM 8976 NE2 HIS J 33 13.347 79.666 16.399 1.00 90.86 N
+ATOM 8977 H HIS J 33 11.786 82.483 19.383 1.00 0.00 H
+ATOM 8978 HA HIS J 33 13.838 84.666 18.911 1.00 0.00 H
+ATOM 8979 1HB HIS J 33 15.119 83.309 17.492 1.00 0.00 H
+ATOM 8980 2HB HIS J 33 14.892 82.410 18.972 1.00 0.00 H
+ATOM 8981 HD2 HIS J 33 13.767 79.842 18.559 1.00 0.00 H
+ATOM 8982 HE1 HIS J 33 13.162 80.317 14.375 1.00 0.00 H
+ATOM 8983 HE2 HIS J 33 13.103 78.696 16.262 1.00 0.00 H
+ATOM 8984 N HIS J 34 11.372 83.710 17.005 1.00 78.67 N
+ATOM 8985 CA HIS J 34 10.617 84.109 15.824 1.00 79.07 C
+ATOM 8986 C HIS J 34 9.132 83.825 15.941 1.00 79.85 C
+ATOM 8987 O HIS J 34 8.710 82.789 16.438 1.00 80.24 O
+ATOM 8988 CB HIS J 34 11.127 83.492 14.517 1.00 79.95 C
+ATOM 8989 CG HIS J 34 10.360 84.019 13.320 1.00 68.68 C
+ATOM 8990 ND1 HIS J 34 10.525 85.308 12.839 1.00 74.08 N
+ATOM 8991 CD2 HIS J 34 9.418 83.435 12.529 1.00 65.01 C
+ATOM 8992 CE1 HIS J 34 9.720 85.493 11.794 1.00 72.04 C
+ATOM 8993 NE2 HIS J 34 9.035 84.373 11.584 1.00 74.14 N
+ATOM 8994 H HIS J 34 10.992 83.017 17.620 1.00 0.00 H
+ATOM 8995 HA HIS J 34 10.712 85.181 15.717 1.00 0.00 H
+ATOM 8996 1HB HIS J 34 12.167 83.762 14.380 1.00 0.00 H
+ATOM 8997 2HB HIS J 34 11.049 82.401 14.523 1.00 0.00 H
+ATOM 8998 HD2 HIS J 34 9.033 82.417 12.630 1.00 0.00 H
+ATOM 8999 HE1 HIS J 34 9.643 86.404 11.218 1.00 0.00 H
+ATOM 9000 HE2 HIS J 34 8.325 84.222 10.841 1.00 0.00 H
+ATOM 9001 N SER J 35 8.356 84.786 15.452 1.00 81.62 N
+ATOM 9002 CA SER J 35 6.897 84.805 15.467 1.00 84.14 C
+ATOM 9003 C SER J 35 6.356 84.973 14.066 1.00 84.20 C
+ATOM 9004 O SER J 35 6.656 85.973 13.420 1.00 84.18 O
+ATOM 9005 CB SER J 35 6.476 85.974 16.342 1.00 88.53 C
+ATOM 9006 OG SER J 35 5.111 86.206 16.321 1.00 88.56 O
+ATOM 9007 H SER J 35 8.810 85.579 15.041 1.00 0.00 H
+ATOM 9008 HA SER J 35 6.514 83.874 15.869 1.00 0.00 H
+ATOM 9009 1HB SER J 35 6.768 85.779 17.350 1.00 0.00 H
+ATOM 9010 2HB SER J 35 6.987 86.862 16.043 1.00 0.00 H
+ATOM 9011 HG SER J 35 4.685 85.361 16.467 1.00 0.00 H
+ATOM 9012 N GLU J 36 5.588 83.995 13.569 1.00 85.17 N
+ATOM 9013 CA GLU J 36 5.036 84.096 12.214 1.00 85.93 C
+ATOM 9014 C GLU J 36 3.512 84.236 12.225 1.00 87.02 C
+ATOM 9015 O GLU J 36 2.760 83.268 12.408 1.00 84.97 O
+ATOM 9016 CB GLU J 36 5.433 82.886 11.357 1.00 85.39 C
+ATOM 9017 CG GLU J 36 4.999 82.963 9.874 1.00 86.34 C
+ATOM 9018 CD GLU J 36 5.696 84.068 9.115 1.00 88.63 C
+ATOM 9019 OE1 GLU J 36 6.887 84.265 9.340 1.00 90.12 O
+ATOM 9020 OE2 GLU J 36 5.058 84.704 8.274 1.00 83.38 O
+ATOM 9021 H GLU J 36 5.390 83.174 14.136 1.00 0.00 H
+ATOM 9022 HA GLU J 36 5.440 84.991 11.746 1.00 0.00 H
+ATOM 9023 1HB GLU J 36 6.513 82.758 11.401 1.00 0.00 H
+ATOM 9024 2HB GLU J 36 4.988 81.980 11.773 1.00 0.00 H
+ATOM 9025 1HG GLU J 36 5.190 82.010 9.374 1.00 0.00 H
+ATOM 9026 2HG GLU J 36 3.927 83.149 9.833 1.00 0.00 H
+ATOM 9027 N LYS J 37 3.052 85.468 12.081 1.00 88.30 N
+ATOM 9028 CA LYS J 37 1.628 85.743 12.051 1.00 89.32 C
+ATOM 9029 C LYS J 37 0.941 85.090 10.859 1.00 89.79 C
+ATOM 9030 O LYS J 37 1.385 85.234 9.712 1.00 90.39 O
+ATOM 9031 CB LYS J 37 1.439 87.262 12.050 1.00 88.36 C
+ATOM 9032 CG LYS J 37 2.086 87.936 10.826 1.00 45.00 C
+ATOM 9033 CD LYS J 37 2.062 89.484 10.957 1.00 45.00 C
+ATOM 9034 CE LYS J 37 3.000 90.155 9.926 1.00 45.00 C
+ATOM 9035 NZ LYS J 37 3.158 91.688 10.145 1.00 45.00 N
+ATOM 9036 H LYS J 37 3.728 86.222 11.972 1.00 0.00 H
+ATOM 9037 HA LYS J 37 1.173 85.338 12.959 1.00 0.00 H
+ATOM 9038 1HB LYS J 37 0.377 87.505 12.035 1.00 0.00 H
+ATOM 9039 2HB LYS J 37 1.861 87.688 12.967 1.00 0.00 H
+ATOM 9040 1HG LYS J 37 3.107 87.577 10.693 1.00 0.00 H
+ATOM 9041 2HG LYS J 37 1.520 87.648 9.925 1.00 0.00 H
+ATOM 9042 1HD LYS J 37 1.054 89.817 10.746 1.00 0.00 H
+ATOM 9043 2HD LYS J 37 2.322 89.788 11.974 1.00 0.00 H
+ATOM 9044 1HE LYS J 37 4.008 89.686 10.000 1.00 0.00 H
+ATOM 9045 2HE LYS J 37 2.608 89.954 8.932 1.00 0.00 H
+ATOM 9046 1HZ LYS J 37 3.819 92.100 9.440 1.00 0.00 H
+ATOM 9047 2HZ LYS J 37 2.273 92.162 10.068 1.00 0.00 H
+ATOM 9048 3HZ LYS J 37 3.531 91.832 11.069 1.00 0.00 H
+ATOM 9049 N LEU J 38 -0.179 84.420 11.105 1.00 89.77 N
+ATOM 9050 CA LEU J 38 -0.975 83.849 10.021 1.00 89.14 C
+ATOM 9051 C LEU J 38 -2.383 84.448 10.099 1.00 89.54 C
+ATOM 9052 O LEU J 38 -2.914 84.603 11.206 1.00 88.56 O
+ATOM 9053 CB LEU J 38 -1.089 82.309 10.137 1.00 90.09 C
+ATOM 9054 CG LEU J 38 0.220 81.505 10.269 1.00 84.99 C
+ATOM 9055 CD1 LEU J 38 -0.123 80.017 10.416 1.00 85.13 C
+ATOM 9056 CD2 LEU J 38 1.124 81.770 9.083 1.00 82.45 C
+ATOM 9057 H LEU J 38 -0.500 84.321 12.051 1.00 0.00 H
+ATOM 9058 HA LEU J 38 -0.543 84.126 9.061 1.00 0.00 H
+ATOM 9059 1HB LEU J 38 -1.733 82.065 10.970 1.00 0.00 H
+ATOM 9060 2HB LEU J 38 -1.586 81.954 9.238 1.00 0.00 H
+ATOM 9061 HG LEU J 38 0.747 81.830 11.184 1.00 0.00 H
+ATOM 9062 1HD1 LEU J 38 0.789 79.452 10.541 1.00 0.00 H
+ATOM 9063 2HD1 LEU J 38 -0.755 79.873 11.279 1.00 0.00 H
+ATOM 9064 3HD1 LEU J 38 -0.651 79.679 9.525 1.00 0.00 H
+ATOM 9065 1HD2 LEU J 38 2.042 81.230 9.212 1.00 0.00 H
+ATOM 9066 2HD2 LEU J 38 0.632 81.458 8.161 1.00 0.00 H
+ATOM 9067 3HD2 LEU J 38 1.353 82.830 9.028 1.00 0.00 H
+ATOM 9068 N ASP J 39 -3.000 84.741 8.949 1.00 89.21 N
+ATOM 9069 CA ASP J 39 -4.387 85.222 8.928 1.00 89.80 C
+ATOM 9070 C ASP J 39 -5.310 84.036 8.640 1.00 89.42 C
+ATOM 9071 O ASP J 39 -4.878 83.062 8.031 1.00 90.82 O
+ATOM 9072 CB ASP J 39 -4.578 86.300 7.874 1.00 93.52 C
+ATOM 9073 CG ASP J 39 -3.766 87.541 8.136 1.00 93.67 C
+ATOM 9074 OD1 ASP J 39 -3.216 87.701 9.200 1.00 85.27 O
+ATOM 9075 OD2 ASP J 39 -3.729 88.358 7.269 1.00 95.84 O
+ATOM 9076 H ASP J 39 -2.511 84.615 8.066 1.00 0.00 H
+ATOM 9077 HA ASP J 39 -4.662 85.646 9.906 1.00 0.00 H
+ATOM 9078 1HB ASP J 39 -4.268 85.887 6.933 1.00 0.00 H
+ATOM 9079 2HB ASP J 39 -5.617 86.598 7.809 1.00 0.00 H
+ATOM 9080 N LYS J 40 -6.573 84.153 8.988 1.00 88.31 N
+ATOM 9081 CA LYS J 40 -7.479 83.054 8.741 1.00 86.73 C
+ATOM 9082 C LYS J 40 -7.434 82.651 7.286 1.00 84.84 C
+ATOM 9083 O LYS J 40 -7.517 83.490 6.392 1.00 84.38 O
+ATOM 9084 CB LYS J 40 -8.892 83.445 9.115 1.00 49.39 C
+ATOM 9085 CG LYS J 40 -9.500 84.512 8.235 1.00 45.00 C
+ATOM 9086 CD LYS J 40 -10.910 84.800 8.694 1.00 45.00 C
+ATOM 9087 CE LYS J 40 -11.580 85.817 7.805 1.00 45.00 C
+ATOM 9088 NZ LYS J 40 -12.979 86.056 8.218 1.00 45.00 N
+ATOM 9089 H LYS J 40 -6.888 84.988 9.471 1.00 0.00 H
+ATOM 9090 HA LYS J 40 -7.171 82.213 9.349 1.00 0.00 H
+ATOM 9091 1HB LYS J 40 -9.524 82.568 9.081 1.00 0.00 H
+ATOM 9092 2HB LYS J 40 -8.910 83.833 10.140 1.00 0.00 H
+ATOM 9093 1HG LYS J 40 -8.905 85.434 8.301 1.00 0.00 H
+ATOM 9094 2HG LYS J 40 -9.501 84.168 7.206 1.00 0.00 H
+ATOM 9095 1HD LYS J 40 -11.496 83.879 8.689 1.00 0.00 H
+ATOM 9096 2HD LYS J 40 -10.881 85.192 9.711 1.00 0.00 H
+ATOM 9097 1HE LYS J 40 -11.027 86.746 7.850 1.00 0.00 H
+ATOM 9098 2HE LYS J 40 -11.571 85.466 6.767 1.00 0.00 H
+ATOM 9099 1HZ LYS J 40 -13.402 86.746 7.611 1.00 0.00 H
+ATOM 9100 2HZ LYS J 40 -13.500 85.194 8.155 1.00 0.00 H
+ATOM 9101 3HZ LYS J 40 -12.994 86.397 9.172 1.00 0.00 H
+ATOM 9102 N GLY J 41 -7.367 81.348 7.055 1.00 84.90 N
+ATOM 9103 CA GLY J 41 -7.342 80.752 5.732 1.00 85.45 C
+ATOM 9104 C GLY J 41 -5.912 80.484 5.234 1.00 86.13 C
+ATOM 9105 O GLY J 41 -5.724 79.696 4.309 1.00 85.75 O
+ATOM 9106 H GLY J 41 -7.305 80.722 7.852 1.00 0.00 H
+ATOM 9107 1HA GLY J 41 -7.899 79.819 5.751 1.00 0.00 H
+ATOM 9108 2HA GLY J 41 -7.862 81.404 5.029 1.00 0.00 H
+ATOM 9109 N GLU J 42 -4.902 81.097 5.866 1.00 86.37 N
+ATOM 9110 CA GLU J 42 -3.511 80.884 5.454 1.00 86.80 C
+ATOM 9111 C GLU J 42 -2.943 79.604 6.051 1.00 87.29 C
+ATOM 9112 O GLU J 42 -3.302 79.198 7.162 1.00 87.53 O
+ATOM 9113 CB GLU J 42 -2.612 82.083 5.813 1.00 89.84 C
+ATOM 9114 CG GLU J 42 -2.905 83.331 4.987 1.00 94.30 C
+ATOM 9115 CD GLU J 42 -1.984 84.489 5.252 1.00 99.12 C
+ATOM 9116 OE1 GLU J 42 -1.600 84.720 6.376 1.00 96.63 O
+ATOM 9117 OE2 GLU J 42 -1.653 85.146 4.303 1.00 98.11 O
+ATOM 9118 H GLU J 42 -5.093 81.738 6.634 1.00 0.00 H
+ATOM 9119 HA GLU J 42 -3.487 80.780 4.367 1.00 0.00 H
+ATOM 9120 1HB GLU J 42 -2.747 82.339 6.867 1.00 0.00 H
+ATOM 9121 2HB GLU J 42 -1.564 81.815 5.669 1.00 0.00 H
+ATOM 9122 1HG GLU J 42 -2.816 83.049 3.913 1.00 0.00 H
+ATOM 9123 2HG GLU J 42 -3.937 83.641 5.175 1.00 0.00 H
+ATOM 9124 N VAL J 43 -2.042 78.969 5.303 1.00 86.52 N
+ATOM 9125 CA VAL J 43 -1.408 77.733 5.765 1.00 84.15 C
+ATOM 9126 C VAL J 43 0.109 77.864 5.883 1.00 82.49 C
+ATOM 9127 O VAL J 43 0.775 78.366 4.981 1.00 81.61 O
+ATOM 9128 CB VAL J 43 -1.766 76.548 4.812 1.00 85.05 C
+ATOM 9129 CG1 VAL J 43 -1.019 75.276 5.233 1.00 87.66 C
+ATOM 9130 CG2 VAL J 43 -3.292 76.281 4.859 1.00 80.87 C
+ATOM 9131 H VAL J 43 -1.793 79.361 4.392 1.00 0.00 H
+ATOM 9132 HA VAL J 43 -1.803 77.498 6.751 1.00 0.00 H
+ATOM 9133 HB VAL J 43 -1.465 76.797 3.797 1.00 0.00 H
+ATOM 9134 1HG1 VAL J 43 -1.274 74.462 4.555 1.00 0.00 H
+ATOM 9135 2HG1 VAL J 43 0.057 75.451 5.190 1.00 0.00 H
+ATOM 9136 3HG1 VAL J 43 -1.301 75.006 6.251 1.00 0.00 H
+ATOM 9137 1HG2 VAL J 43 -3.546 75.456 4.199 1.00 0.00 H
+ATOM 9138 2HG2 VAL J 43 -3.572 76.027 5.869 1.00 0.00 H
+ATOM 9139 3HG2 VAL J 43 -3.838 77.171 4.548 1.00 0.00 H
+ATOM 9140 N LEU J 44 0.655 77.434 7.020 1.00 80.62 N
+ATOM 9141 CA LEU J 44 2.104 77.454 7.220 1.00 79.26 C
+ATOM 9142 C LEU J 44 2.620 76.059 7.482 1.00 78.79 C
+ATOM 9143 O LEU J 44 2.141 75.364 8.378 1.00 78.83 O
+ATOM 9144 CB LEU J 44 2.494 78.308 8.424 1.00 71.77 C
+ATOM 9145 CG LEU J 44 4.027 78.410 8.734 1.00 72.26 C
+ATOM 9146 CD1 LEU J 44 4.719 79.199 7.617 1.00 67.61 C
+ATOM 9147 CD2 LEU J 44 4.230 79.067 10.091 1.00 65.21 C
+ATOM 9148 H LEU J 44 0.050 77.072 7.750 1.00 0.00 H
+ATOM 9149 HA LEU J 44 2.585 77.839 6.327 1.00 0.00 H
+ATOM 9150 1HB LEU J 44 2.130 79.294 8.241 1.00 0.00 H
+ATOM 9151 2HB LEU J 44 2.007 77.902 9.308 1.00 0.00 H
+ATOM 9152 HG LEU J 44 4.466 77.406 8.753 1.00 0.00 H
+ATOM 9153 1HD1 LEU J 44 5.782 79.272 7.819 1.00 0.00 H
+ATOM 9154 2HD1 LEU J 44 4.567 78.694 6.672 1.00 0.00 H
+ATOM 9155 3HD1 LEU J 44 4.292 80.199 7.571 1.00 0.00 H
+ATOM 9156 1HD2 LEU J 44 5.293 79.132 10.310 1.00 0.00 H
+ATOM 9157 2HD2 LEU J 44 3.805 80.064 10.086 1.00 0.00 H
+ATOM 9158 3HD2 LEU J 44 3.741 78.469 10.851 1.00 0.00 H
+ATOM 9159 N ILE J 45 3.595 75.645 6.701 1.00 77.96 N
+ATOM 9160 CA ILE J 45 4.195 74.348 6.914 1.00 76.09 C
+ATOM 9161 C ILE J 45 5.618 74.606 7.389 1.00 75.26 C
+ATOM 9162 O ILE J 45 6.393 75.270 6.703 1.00 74.67 O
+ATOM 9163 CB ILE J 45 4.129 73.519 5.633 1.00 76.04 C
+ATOM 9164 CG1 ILE J 45 2.671 73.417 5.232 1.00 74.06 C
+ATOM 9165 CG2 ILE J 45 4.648 72.135 5.921 1.00 77.13 C
+ATOM 9166 CD1 ILE J 45 2.416 72.836 3.919 1.00 69.95 C
+ATOM 9167 H ILE J 45 3.929 76.242 5.953 1.00 0.00 H
+ATOM 9168 HA ILE J 45 3.657 73.821 7.694 1.00 0.00 H
+ATOM 9169 HB ILE J 45 4.695 73.998 4.834 1.00 0.00 H
+ATOM 9170 1HG1 ILE J 45 2.184 72.822 5.963 1.00 0.00 H
+ATOM 9171 2HG1 ILE J 45 2.230 74.406 5.246 1.00 0.00 H
+ATOM 9172 1HG2 ILE J 45 4.575 71.516 5.035 1.00 0.00 H
+ATOM 9173 2HG2 ILE J 45 5.678 72.176 6.255 1.00 0.00 H
+ATOM 9174 3HG2 ILE J 45 4.045 71.717 6.705 1.00 0.00 H
+ATOM 9175 1HD1 ILE J 45 1.344 72.798 3.762 1.00 0.00 H
+ATOM 9176 2HD1 ILE J 45 2.883 73.444 3.142 1.00 0.00 H
+ATOM 9177 3HD1 ILE J 45 2.818 71.841 3.900 1.00 0.00 H
+ATOM 9178 N ALA J 46 5.957 74.135 8.589 1.00 74.74 N
+ATOM 9179 CA ALA J 46 7.259 74.526 9.136 1.00 74.83 C
+ATOM 9180 C ALA J 46 7.987 73.402 9.838 1.00 73.55 C
+ATOM 9181 O ALA J 46 7.397 72.580 10.540 1.00 72.20 O
+ATOM 9182 CB ALA J 46 7.066 75.677 10.114 1.00 71.96 C
+ATOM 9183 H ALA J 46 5.303 73.553 9.108 1.00 0.00 H
+ATOM 9184 HA ALA J 46 7.889 74.855 8.315 1.00 0.00 H
+ATOM 9185 1HB ALA J 46 8.040 75.991 10.491 1.00 0.00 H
+ATOM 9186 2HB ALA J 46 6.589 76.509 9.602 1.00 0.00 H
+ATOM 9187 3HB ALA J 46 6.440 75.351 10.942 1.00 0.00 H
+ATOM 9188 N GLN J 47 9.305 73.400 9.645 1.00 72.40 N
+ATOM 9189 CA GLN J 47 10.191 72.385 10.192 1.00 70.67 C
+ATOM 9190 C GLN J 47 10.817 72.710 11.533 1.00 69.35 C
+ATOM 9191 O GLN J 47 10.965 73.875 11.908 1.00 70.84 O
+ATOM 9192 CB GLN J 47 11.324 72.107 9.207 1.00 61.95 C
+ATOM 9193 CG GLN J 47 10.888 71.492 7.905 1.00 61.34 C
+ATOM 9194 CD GLN J 47 12.049 71.194 7.006 1.00 63.01 C
+ATOM 9195 OE1 GLN J 47 12.960 72.022 6.835 1.00 65.83 O
+ATOM 9196 NE2 GLN J 47 12.035 70.004 6.412 1.00 53.94 N
+ATOM 9197 H GLN J 47 9.718 74.120 9.052 1.00 0.00 H
+ATOM 9198 HA GLN J 47 9.617 71.478 10.313 1.00 0.00 H
+ATOM 9199 1HB GLN J 47 11.852 73.038 8.986 1.00 0.00 H
+ATOM 9200 2HB GLN J 47 12.039 71.432 9.670 1.00 0.00 H
+ATOM 9201 1HG GLN J 47 10.418 70.546 8.130 1.00 0.00 H
+ATOM 9202 2HG GLN J 47 10.191 72.159 7.390 1.00 0.00 H
+ATOM 9203 1HE2 GLN J 47 12.776 69.738 5.795 1.00 0.00 H
+ATOM 9204 2HE2 GLN J 47 11.276 69.371 6.580 1.00 0.00 H
+ATOM 9205 N PHE J 48 11.253 71.659 12.219 1.00 67.44 N
+ATOM 9206 CA PHE J 48 12.067 71.817 13.421 1.00 66.71 C
+ATOM 9207 C PHE J 48 13.496 71.936 12.906 1.00 66.91 C
+ATOM 9208 O PHE J 48 13.860 71.246 11.947 1.00 66.97 O
+ATOM 9209 CB PHE J 48 11.912 70.629 14.346 1.00 71.61 C
+ATOM 9210 CG PHE J 48 10.536 70.504 14.919 1.00 74.10 C
+ATOM 9211 CD1 PHE J 48 10.156 71.175 16.078 1.00 76.27 C
+ATOM 9212 CD2 PHE J 48 9.607 69.701 14.277 1.00 80.42 C
+ATOM 9213 CE1 PHE J 48 8.864 71.026 16.573 1.00 78.32 C
+ATOM 9214 CE2 PHE J 48 8.333 69.556 14.764 1.00 82.81 C
+ATOM 9215 CZ PHE J 48 7.961 70.216 15.908 1.00 80.93 C
+ATOM 9216 H PHE J 48 11.025 70.729 11.865 1.00 0.00 H
+ATOM 9217 HA PHE J 48 11.794 72.735 13.943 1.00 0.00 H
+ATOM 9218 1HB PHE J 48 12.157 69.712 13.820 1.00 0.00 H
+ATOM 9219 2HB PHE J 48 12.614 70.737 15.173 1.00 0.00 H
+ATOM 9220 HD1 PHE J 48 10.882 71.814 16.596 1.00 0.00 H
+ATOM 9221 HD2 PHE J 48 9.906 69.183 13.368 1.00 0.00 H
+ATOM 9222 HE1 PHE J 48 8.564 71.547 17.476 1.00 0.00 H
+ATOM 9223 HE2 PHE J 48 7.620 68.919 14.237 1.00 0.00 H
+ATOM 9224 HZ PHE J 48 6.962 70.102 16.276 1.00 0.00 H
+ATOM 9225 N THR J 49 14.278 72.852 13.477 1.00 66.99 N
+ATOM 9226 CA THR J 49 15.591 73.149 12.898 1.00 66.10 C
+ATOM 9227 C THR J 49 16.717 73.182 13.913 1.00 67.66 C
+ATOM 9228 O THR J 49 16.543 72.901 15.096 1.00 68.33 O
+ATOM 9229 CB THR J 49 15.607 74.517 12.178 1.00 69.23 C
+ATOM 9230 OG1 THR J 49 15.629 75.597 13.146 1.00 66.63 O
+ATOM 9231 CG2 THR J 49 14.349 74.667 11.308 1.00 61.58 C
+ATOM 9232 H THR J 49 13.953 73.327 14.316 1.00 0.00 H
+ATOM 9233 HA THR J 49 15.829 72.374 12.170 1.00 0.00 H
+ATOM 9234 HB THR J 49 16.480 74.586 11.532 1.00 0.00 H
+ATOM 9235 HG1 THR J 49 16.544 75.773 13.384 1.00 0.00 H
+ATOM 9236 1HG2 THR J 49 14.381 75.627 10.802 1.00 0.00 H
+ATOM 9237 2HG2 THR J 49 14.304 73.867 10.567 1.00 0.00 H
+ATOM 9238 3HG2 THR J 49 13.461 74.623 11.935 1.00 0.00 H
+ATOM 9239 N GLU J 50 17.886 73.585 13.431 1.00 67.93 N
+ATOM 9240 CA GLU J 50 19.068 73.794 14.253 1.00 70.97 C
+ATOM 9241 C GLU J 50 18.788 74.774 15.397 1.00 72.99 C
+ATOM 9242 O GLU J 50 19.429 74.702 16.445 1.00 72.73 O
+ATOM 9243 CB GLU J 50 20.217 74.324 13.389 1.00 71.79 C
+ATOM 9244 CG GLU J 50 21.524 74.536 14.130 1.00 76.45 C
+ATOM 9245 CD GLU J 50 22.655 74.954 13.221 1.00 84.50 C
+ATOM 9246 OE1 GLU J 50 23.744 75.141 13.711 1.00 88.15 O
+ATOM 9247 OE2 GLU J 50 22.431 75.083 12.039 1.00 91.89 O
+ATOM 9248 H GLU J 50 17.960 73.769 12.442 1.00 0.00 H
+ATOM 9249 HA GLU J 50 19.361 72.837 14.687 1.00 0.00 H
+ATOM 9250 1HB GLU J 50 20.405 73.629 12.569 1.00 0.00 H
+ATOM 9251 2HB GLU J 50 19.933 75.280 12.948 1.00 0.00 H
+ATOM 9252 1HG GLU J 50 21.373 75.317 14.875 1.00 0.00 H
+ATOM 9253 2HG GLU J 50 21.791 73.618 14.651 1.00 0.00 H
+ATOM 9254 N HIS J 51 17.876 75.729 15.166 1.00 74.66 N
+ATOM 9255 CA HIS J 51 17.561 76.746 16.158 1.00 77.88 C
+ATOM 9256 C HIS J 51 16.208 76.503 16.826 1.00 78.50 C
+ATOM 9257 O HIS J 51 16.041 76.819 18.004 1.00 79.42 O
+ATOM 9258 CB HIS J 51 17.569 78.134 15.504 1.00 81.98 C
+ATOM 9259 CG HIS J 51 18.915 78.536 14.990 1.00 81.42 C
+ATOM 9260 ND1 HIS J 51 19.393 78.136 13.762 1.00 80.35 N
+ATOM 9261 CD2 HIS J 51 19.878 79.310 15.535 1.00 77.26 C
+ATOM 9262 CE1 HIS J 51 20.605 78.633 13.582 1.00 78.78 C
+ATOM 9263 NE2 HIS J 51 20.918 79.355 14.641 1.00 74.56 N
+ATOM 9264 H HIS J 51 17.354 75.720 14.303 1.00 0.00 H
+ATOM 9265 HA HIS J 51 18.323 76.738 16.935 1.00 0.00 H
+ATOM 9266 1HB HIS J 51 16.859 78.156 14.676 1.00 0.00 H
+ATOM 9267 2HB HIS J 51 17.247 78.883 16.232 1.00 0.00 H
+ATOM 9268 HD2 HIS J 51 19.834 79.805 16.506 1.00 0.00 H
+ATOM 9269 HE1 HIS J 51 21.236 78.474 12.705 1.00 0.00 H
+ATOM 9270 HE2 HIS J 51 21.784 79.858 14.780 1.00 0.00 H
+ATOM 9271 N THR J 52 15.242 75.916 16.109 1.00 77.48 N
+ATOM 9272 CA THR J 52 13.912 75.708 16.692 1.00 76.41 C
+ATOM 9273 C THR J 52 13.712 74.297 17.231 1.00 75.66 C
+ATOM 9274 O THR J 52 13.685 73.331 16.464 1.00 74.36 O
+ATOM 9275 CB THR J 52 12.793 75.955 15.658 1.00 71.17 C
+ATOM 9276 OG1 THR J 52 12.842 77.306 15.199 1.00 66.14 O
+ATOM 9277 CG2 THR J 52 11.427 75.670 16.280 1.00 75.88 C
+ATOM 9278 H THR J 52 15.414 75.650 15.147 1.00 0.00 H
+ATOM 9279 HA THR J 52 13.786 76.405 17.521 1.00 0.00 H
+ATOM 9280 HB THR J 52 12.939 75.293 14.800 1.00 0.00 H
+ATOM 9281 HG1 THR J 52 13.533 77.382 14.529 1.00 0.00 H
+ATOM 9282 1HG2 THR J 52 10.641 75.846 15.545 1.00 0.00 H
+ATOM 9283 2HG2 THR J 52 11.389 74.630 16.613 1.00 0.00 H
+ATOM 9284 3HG2 THR J 52 11.281 76.324 17.127 1.00 0.00 H
+ATOM 9285 N SER J 53 13.514 74.200 18.549 1.00 74.98 N
+ATOM 9286 CA SER J 53 13.322 72.909 19.212 1.00 74.06 C
+ATOM 9287 C SER J 53 11.854 72.658 19.509 1.00 73.37 C
+ATOM 9288 O SER J 53 11.448 71.520 19.785 1.00 73.29 O
+ATOM 9289 CB SER J 53 14.109 72.846 20.494 1.00 73.89 C
+ATOM 9290 OG SER J 53 13.655 73.789 21.424 1.00 62.86 O
+ATOM 9291 H SER J 53 13.518 75.053 19.108 1.00 0.00 H
+ATOM 9292 HA SER J 53 13.681 72.123 18.547 1.00 0.00 H
+ATOM 9293 1HB SER J 53 14.021 71.856 20.909 1.00 0.00 H
+ATOM 9294 2HB SER J 53 15.148 73.012 20.276 1.00 0.00 H
+ATOM 9295 HG SER J 53 13.635 74.641 20.959 1.00 0.00 H
+ATOM 9296 N ALA J 54 11.058 73.722 19.471 1.00 73.39 N
+ATOM 9297 CA ALA J 54 9.631 73.589 19.746 1.00 73.24 C
+ATOM 9298 C ALA J 54 8.838 74.670 19.033 1.00 73.02 C
+ATOM 9299 O ALA J 54 9.354 75.761 18.751 1.00 74.31 O
+ATOM 9300 CB ALA J 54 9.386 73.616 21.247 1.00 75.09 C
+ATOM 9301 H ALA J 54 11.477 74.633 19.281 1.00 0.00 H
+ATOM 9302 HA ALA J 54 9.294 72.624 19.365 1.00 0.00 H
+ATOM 9303 1HB ALA J 54 8.331 73.478 21.451 1.00 0.00 H
+ATOM 9304 2HB ALA J 54 9.956 72.809 21.705 1.00 0.00 H
+ATOM 9305 3HB ALA J 54 9.698 74.536 21.659 1.00 0.00 H
+ATOM 9306 N ILE J 55 7.572 74.355 18.758 1.00 73.06 N
+ATOM 9307 CA ILE J 55 6.638 75.247 18.083 1.00 73.01 C
+ATOM 9308 C ILE J 55 5.403 75.518 18.948 1.00 74.87 C
+ATOM 9309 O ILE J 55 4.752 74.586 19.429 1.00 74.50 O
+ATOM 9310 CB ILE J 55 6.238 74.652 16.714 1.00 69.45 C
+ATOM 9311 CG1 ILE J 55 7.512 74.478 15.833 1.00 75.53 C
+ATOM 9312 CG2 ILE J 55 5.241 75.546 16.034 1.00 72.03 C
+ATOM 9313 CD1 ILE J 55 7.289 73.719 14.536 1.00 64.07 C
+ATOM 9314 H ILE J 55 7.237 73.445 19.058 1.00 0.00 H
+ATOM 9315 HA ILE J 55 7.140 76.192 17.907 1.00 0.00 H
+ATOM 9316 HB ILE J 55 5.794 73.664 16.858 1.00 0.00 H
+ATOM 9317 1HG1 ILE J 55 7.911 75.462 15.592 1.00 0.00 H
+ATOM 9318 2HG1 ILE J 55 8.262 73.934 16.402 1.00 0.00 H
+ATOM 9319 1HG2 ILE J 55 4.961 75.126 15.072 1.00 0.00 H
+ATOM 9320 2HG2 ILE J 55 4.360 75.647 16.658 1.00 0.00 H
+ATOM 9321 3HG2 ILE J 55 5.701 76.520 15.891 1.00 0.00 H
+ATOM 9322 1HD1 ILE J 55 8.239 73.638 13.988 1.00 0.00 H
+ATOM 9323 2HD1 ILE J 55 6.918 72.717 14.752 1.00 0.00 H
+ATOM 9324 3HD1 ILE J 55 6.567 74.250 13.924 1.00 0.00 H
+ATOM 9325 N LYS J 56 5.083 76.787 19.172 1.00 75.05 N
+ATOM 9326 CA LYS J 56 3.946 77.095 20.021 1.00 75.84 C
+ATOM 9327 C LYS J 56 2.871 77.793 19.187 1.00 75.09 C
+ATOM 9328 O LYS J 56 3.180 78.681 18.374 1.00 75.50 O
+ATOM 9329 CB LYS J 56 4.405 77.871 21.246 1.00 76.19 C
+ATOM 9330 CG LYS J 56 3.367 78.088 22.327 1.00 76.70 C
+ATOM 9331 CD LYS J 56 4.029 78.694 23.602 1.00 82.14 C
+ATOM 9332 CE LYS J 56 3.170 78.479 24.850 1.00 81.21 C
+ATOM 9333 NZ LYS J 56 3.686 79.200 26.028 1.00 74.25 N
+ATOM 9334 H LYS J 56 5.649 77.536 18.756 1.00 0.00 H
+ATOM 9335 HA LYS J 56 3.499 76.157 20.376 1.00 0.00 H
+ATOM 9336 1HB LYS J 56 5.224 77.334 21.693 1.00 0.00 H
+ATOM 9337 2HB LYS J 56 4.786 78.858 20.939 1.00 0.00 H
+ATOM 9338 1HG LYS J 56 2.594 78.769 21.964 1.00 0.00 H
+ATOM 9339 2HG LYS J 56 2.880 77.133 22.566 1.00 0.00 H
+ATOM 9340 1HD LYS J 56 5.019 78.238 23.751 1.00 0.00 H
+ATOM 9341 2HD LYS J 56 4.184 79.762 23.459 1.00 0.00 H
+ATOM 9342 1HE LYS J 56 2.149 78.768 24.670 1.00 0.00 H
+ATOM 9343 2HE LYS J 56 3.199 77.440 25.080 1.00 0.00 H
+ATOM 9344 1HZ LYS J 56 3.125 78.978 26.880 1.00 0.00 H
+ATOM 9345 2HZ LYS J 56 4.643 78.911 26.192 1.00 0.00 H
+ATOM 9346 3HZ LYS J 56 3.662 80.188 25.847 1.00 0.00 H
+ATOM 9347 N VAL J 57 1.633 77.334 19.326 1.00 75.16 N
+ATOM 9348 CA VAL J 57 0.531 77.812 18.494 1.00 76.66 C
+ATOM 9349 C VAL J 57 -0.687 78.283 19.321 1.00 77.96 C
+ATOM 9350 O VAL J 57 -1.093 77.607 20.279 1.00 77.81 O
+ATOM 9351 CB VAL J 57 0.090 76.654 17.568 1.00 72.61 C
+ATOM 9352 CG1 VAL J 57 -0.991 77.140 16.609 1.00 72.01 C
+ATOM 9353 CG2 VAL J 57 1.295 76.081 16.846 1.00 74.90 C
+ATOM 9354 H VAL J 57 1.459 76.618 20.035 1.00 0.00 H
+ATOM 9355 HA VAL J 57 0.891 78.645 17.882 1.00 0.00 H
+ATOM 9356 HB VAL J 57 -0.359 75.882 18.176 1.00 0.00 H
+ATOM 9357 1HG1 VAL J 57 -1.332 76.343 15.972 1.00 0.00 H
+ATOM 9358 2HG1 VAL J 57 -1.841 77.531 17.170 1.00 0.00 H
+ATOM 9359 3HG1 VAL J 57 -0.548 77.906 16.015 1.00 0.00 H
+ATOM 9360 1HG2 VAL J 57 0.988 75.245 16.227 1.00 0.00 H
+ATOM 9361 2HG2 VAL J 57 1.767 76.851 16.235 1.00 0.00 H
+ATOM 9362 3HG2 VAL J 57 2.009 75.721 17.589 1.00 0.00 H
+ATOM 9363 N ARG J 58 -1.278 79.446 18.988 1.00 79.73 N
+ATOM 9364 CA ARG J 58 -2.464 79.915 19.710 1.00 80.69 C
+ATOM 9365 C ARG J 58 -3.537 80.392 18.722 1.00 80.92 C
+ATOM 9366 O ARG J 58 -3.213 80.689 17.580 1.00 80.65 O
+ATOM 9367 CB ARG J 58 -2.177 81.093 20.602 1.00 82.03 C
+ATOM 9368 CG ARG J 58 -1.134 80.978 21.703 1.00 92.11 C
+ATOM 9369 CD ARG J 58 -1.164 82.251 22.395 1.00 90.80 C
+ATOM 9370 NE ARG J 58 -0.177 82.476 23.378 1.00 88.36 N
+ATOM 9371 CZ ARG J 58 -0.450 82.160 24.667 1.00 90.83 C
+ATOM 9372 NH1 ARG J 58 0.186 81.243 25.402 1.00 93.42 N
+ATOM 9373 NH2 ARG J 58 -0.058 83.226 25.293 1.00 84.89 N
+ATOM 9374 H ARG J 58 -0.935 80.013 18.201 1.00 0.00 H
+ATOM 9375 HA ARG J 58 -2.895 79.087 20.287 1.00 0.00 H
+ATOM 9376 1HB ARG J 58 -1.942 81.958 19.970 1.00 0.00 H
+ATOM 9377 2HB ARG J 58 -3.108 81.347 21.106 1.00 0.00 H
+ATOM 9378 1HG ARG J 58 -1.380 80.137 22.380 1.00 0.00 H
+ATOM 9379 2HG ARG J 58 -0.197 80.823 21.224 1.00 0.00 H
+ATOM 9380 1HD ARG J 58 -2.125 82.391 22.832 1.00 0.00 H
+ATOM 9381 2HD ARG J 58 -1.001 83.008 21.612 1.00 0.00 H
+ATOM 9382 HE ARG J 58 -0.134 83.498 23.300 1.00 0.00 H
+ATOM 9383 1HH1 ARG J 58 -0.385 80.413 25.671 1.00 0.00 H
+ATOM 9384 2HH1 ARG J 58 0.398 81.574 26.316 1.00 0.00 H
+ATOM 9385 1HH2 ARG J 58 0.081 82.713 26.141 1.00 0.00 H
+ATOM 9386 2HH2 ARG J 58 0.261 83.637 26.188 1.00 0.00 H
+ATOM 9387 N GLY J 59 -4.783 80.525 19.144 1.00 80.95 N
+ATOM 9388 CA GLY J 59 -5.830 81.104 18.308 1.00 80.75 C
+ATOM 9389 C GLY J 59 -6.530 79.988 17.573 1.00 81.27 C
+ATOM 9390 O GLY J 59 -5.942 78.924 17.398 1.00 81.15 O
+ATOM 9391 H GLY J 59 -5.052 80.203 20.071 1.00 0.00 H
+ATOM 9392 1HA GLY J 59 -6.551 81.655 18.923 1.00 0.00 H
+ATOM 9393 2HA GLY J 59 -5.389 81.809 17.608 1.00 0.00 H
+ATOM 9394 N LYS J 60 -7.764 80.190 17.140 1.00 80.39 N
+ATOM 9395 CA LYS J 60 -8.419 79.061 16.505 1.00 80.93 C
+ATOM 9396 C LYS J 60 -7.572 78.623 15.305 1.00 81.91 C
+ATOM 9397 O LYS J 60 -7.350 79.403 14.364 1.00 82.48 O
+ATOM 9398 CB LYS J 60 -9.848 79.433 16.093 1.00 78.94 C
+ATOM 9399 CG LYS J 60 -10.778 78.274 15.732 1.00 83.16 C
+ATOM 9400 CD LYS J 60 -11.219 77.497 16.984 1.00 84.38 C
+ATOM 9401 CE LYS J 60 -12.361 76.505 16.659 1.00 94.65 C
+ATOM 9402 NZ LYS J 60 -12.816 75.750 17.865 1.00 97.36 N
+ATOM 9403 H LYS J 60 -8.244 81.072 17.268 1.00 0.00 H
+ATOM 9404 HA LYS J 60 -8.459 78.249 17.213 1.00 0.00 H
+ATOM 9405 1HB LYS J 60 -10.324 80.044 16.862 1.00 0.00 H
+ATOM 9406 2HB LYS J 60 -9.815 80.022 15.196 1.00 0.00 H
+ATOM 9407 1HG LYS J 60 -11.657 78.668 15.207 1.00 0.00 H
+ATOM 9408 2HG LYS J 60 -10.263 77.593 15.079 1.00 0.00 H
+ATOM 9409 1HD LYS J 60 -10.361 76.926 17.386 1.00 0.00 H
+ATOM 9410 2HD LYS J 60 -11.556 78.195 17.746 1.00 0.00 H
+ATOM 9411 1HE LYS J 60 -13.208 77.060 16.258 1.00 0.00 H
+ATOM 9412 2HE LYS J 60 -12.015 75.788 15.914 1.00 0.00 H
+ATOM 9413 1HZ LYS J 60 -13.565 75.110 17.618 1.00 0.00 H
+ATOM 9414 2HZ LYS J 60 -12.037 75.222 18.230 1.00 0.00 H
+ATOM 9415 3HZ LYS J 60 -13.146 76.406 18.564 1.00 0.00 H
+ATOM 9416 N ALA J 61 -7.124 77.359 15.321 1.00 81.78 N
+ATOM 9417 CA ALA J 61 -6.305 76.838 14.219 1.00 81.97 C
+ATOM 9418 C ALA J 61 -6.430 75.323 14.089 1.00 81.53 C
+ATOM 9419 O ALA J 61 -6.664 74.610 15.065 1.00 82.06 O
+ATOM 9420 CB ALA J 61 -4.835 77.211 14.397 1.00 67.97 C
+ATOM 9421 H ALA J 61 -7.326 76.801 16.147 1.00 0.00 H
+ATOM 9422 HA ALA J 61 -6.661 77.286 13.304 1.00 0.00 H
+ATOM 9423 1HB ALA J 61 -4.253 76.845 13.541 1.00 0.00 H
+ATOM 9424 2HB ALA J 61 -4.742 78.279 14.454 1.00 0.00 H
+ATOM 9425 3HB ALA J 61 -4.445 76.775 15.300 1.00 0.00 H
+ATOM 9426 N TYR J 62 -6.226 74.843 12.854 1.00 79.93 N
+ATOM 9427 CA TYR J 62 -6.245 73.415 12.528 1.00 79.10 C
+ATOM 9428 C TYR J 62 -4.793 72.952 12.359 1.00 78.03 C
+ATOM 9429 O TYR J 62 -4.102 73.403 11.445 1.00 78.35 O
+ATOM 9430 CB TYR J 62 -7.054 73.202 11.238 1.00 77.62 C
+ATOM 9431 CG TYR J 62 -7.423 71.784 10.855 1.00 76.53 C
+ATOM 9432 CD1 TYR J 62 -8.523 71.187 11.450 1.00 76.30 C
+ATOM 9433 CD2 TYR J 62 -6.692 71.091 9.893 1.00 75.40 C
+ATOM 9434 CE1 TYR J 62 -8.902 69.915 11.085 1.00 76.04 C
+ATOM 9435 CE2 TYR J 62 -7.069 69.809 9.528 1.00 73.85 C
+ATOM 9436 CZ TYR J 62 -8.179 69.223 10.119 1.00 75.64 C
+ATOM 9437 OH TYR J 62 -8.579 67.947 9.766 1.00 77.18 O
+ATOM 9438 H TYR J 62 -6.032 75.507 12.106 1.00 0.00 H
+ATOM 9439 HA TYR J 62 -6.690 72.853 13.344 1.00 0.00 H
+ATOM 9440 1HB TYR J 62 -7.976 73.769 11.298 1.00 0.00 H
+ATOM 9441 2HB TYR J 62 -6.505 73.600 10.427 1.00 0.00 H
+ATOM 9442 HD1 TYR J 62 -9.098 71.728 12.204 1.00 0.00 H
+ATOM 9443 HD2 TYR J 62 -5.828 71.559 9.426 1.00 0.00 H
+ATOM 9444 HE1 TYR J 62 -9.774 69.454 11.554 1.00 0.00 H
+ATOM 9445 HE2 TYR J 62 -6.501 69.269 8.774 1.00 0.00 H
+ATOM 9446 HH TYR J 62 -7.885 67.520 9.264 1.00 0.00 H
+ATOM 9447 N ILE J 63 -4.319 72.102 13.271 1.00 76.86 N
+ATOM 9448 CA ILE J 63 -2.912 71.697 13.252 1.00 75.49 C
+ATOM 9449 C ILE J 63 -2.746 70.215 12.912 1.00 74.40 C
+ATOM 9450 O ILE J 63 -3.295 69.347 13.589 1.00 73.46 O
+ATOM 9451 CB ILE J 63 -2.307 71.902 14.645 1.00 77.11 C
+ATOM 9452 CG1 ILE J 63 -2.425 73.350 15.114 1.00 72.47 C
+ATOM 9453 CG2 ILE J 63 -0.850 71.491 14.607 1.00 79.28 C
+ATOM 9454 CD1 ILE J 63 -2.168 73.498 16.602 1.00 72.38 C
+ATOM 9455 H ILE J 63 -4.906 71.743 14.020 1.00 0.00 H
+ATOM 9456 HA ILE J 63 -2.375 72.291 12.522 1.00 0.00 H
+ATOM 9457 HB ILE J 63 -2.827 71.299 15.338 1.00 0.00 H
+ATOM 9458 1HG1 ILE J 63 -1.708 73.951 14.581 1.00 0.00 H
+ATOM 9459 2HG1 ILE J 63 -3.423 73.723 14.896 1.00 0.00 H
+ATOM 9460 1HG2 ILE J 63 -0.421 71.607 15.592 1.00 0.00 H
+ATOM 9461 2HG2 ILE J 63 -0.785 70.456 14.300 1.00 0.00 H
+ATOM 9462 3HG2 ILE J 63 -0.309 72.110 13.896 1.00 0.00 H
+ATOM 9463 1HD1 ILE J 63 -2.269 74.537 16.898 1.00 0.00 H
+ATOM 9464 2HD1 ILE J 63 -2.901 72.905 17.146 1.00 0.00 H
+ATOM 9465 3HD1 ILE J 63 -1.163 73.146 16.840 1.00 0.00 H
+ATOM 9466 N GLN J 64 -1.958 69.922 11.869 1.00 74.15 N
+ATOM 9467 CA GLN J 64 -1.693 68.528 11.511 1.00 71.46 C
+ATOM 9468 C GLN J 64 -0.245 68.209 11.867 1.00 70.31 C
+ATOM 9469 O GLN J 64 0.674 68.929 11.457 1.00 67.94 O
+ATOM 9470 CB GLN J 64 -1.867 68.284 10.004 1.00 64.23 C
+ATOM 9471 CG GLN J 64 -3.214 68.644 9.404 1.00 69.38 C
+ATOM 9472 CD GLN J 64 -3.216 68.496 7.867 1.00 65.44 C
+ATOM 9473 OE1 GLN J 64 -2.184 68.682 7.216 1.00 60.37 O
+ATOM 9474 NE2 GLN J 64 -4.380 68.155 7.316 1.00 52.46 N
+ATOM 9475 H GLN J 64 -1.540 70.675 11.335 1.00 0.00 H
+ATOM 9476 HA GLN J 64 -2.345 67.863 12.075 1.00 0.00 H
+ATOM 9477 1HB GLN J 64 -1.092 68.755 9.474 1.00 0.00 H
+ATOM 9478 2HB GLN J 64 -1.743 67.218 9.825 1.00 0.00 H
+ATOM 9479 1HG GLN J 64 -3.980 67.994 9.799 1.00 0.00 H
+ATOM 9480 2HG GLN J 64 -3.443 69.683 9.647 1.00 0.00 H
+ATOM 9481 1HE2 GLN J 64 -4.493 68.039 6.311 1.00 0.00 H
+ATOM 9482 2HE2 GLN J 64 -5.171 68.010 7.895 1.00 0.00 H
+ATOM 9483 N THR J 65 -0.024 67.149 12.628 1.00 68.72 N
+ATOM 9484 CA THR J 65 1.335 66.745 12.978 1.00 69.10 C
+ATOM 9485 C THR J 65 1.468 65.246 12.755 1.00 69.35 C
+ATOM 9486 O THR J 65 0.497 64.565 12.425 1.00 69.91 O
+ATOM 9487 CB THR J 65 1.723 67.023 14.454 1.00 67.11 C
+ATOM 9488 OG1 THR J 65 1.064 66.077 15.305 1.00 60.30 O
+ATOM 9489 CG2 THR J 65 1.309 68.426 14.890 1.00 64.92 C
+ATOM 9490 H THR J 65 -0.815 66.597 12.969 1.00 0.00 H
+ATOM 9491 HA THR J 65 2.049 67.254 12.323 1.00 0.00 H
+ATOM 9492 HB THR J 65 2.796 66.925 14.559 1.00 0.00 H
+ATOM 9493 HG1 THR J 65 1.037 65.228 14.858 1.00 0.00 H
+ATOM 9494 1HG2 THR J 65 1.598 68.587 15.929 1.00 0.00 H
+ATOM 9495 2HG2 THR J 65 1.791 69.169 14.259 1.00 0.00 H
+ATOM 9496 3HG2 THR J 65 0.233 68.516 14.801 1.00 0.00 H
+ATOM 9497 N ARG J 66 2.649 64.717 13.026 1.00 70.71 N
+ATOM 9498 CA ARG J 66 2.887 63.279 12.960 1.00 71.32 C
+ATOM 9499 C ARG J 66 1.934 62.469 13.838 1.00 71.00 C
+ATOM 9500 O ARG J 66 1.713 61.286 13.582 1.00 69.46 O
+ATOM 9501 CB ARG J 66 4.316 62.922 13.359 1.00 71.51 C
+ATOM 9502 CG ARG J 66 4.612 61.423 13.257 1.00 82.69 C
+ATOM 9503 CD ARG J 66 6.048 61.071 13.486 1.00 91.07 C
+ATOM 9504 NE ARG J 66 6.235 59.609 13.495 1.00 95.34 N
+ATOM 9505 CZ ARG J 66 6.364 58.838 12.390 1.00 96.01 C
+ATOM 9506 NH1 ARG J 66 6.518 57.535 12.506 1.00 95.05 N
+ATOM 9507 NH2 ARG J 66 6.329 59.389 11.191 1.00 95.41 N
+ATOM 9508 H ARG J 66 3.415 65.327 13.269 1.00 0.00 H
+ATOM 9509 HA ARG J 66 2.741 62.963 11.928 1.00 0.00 H
+ATOM 9510 1HB ARG J 66 5.034 63.458 12.731 1.00 0.00 H
+ATOM 9511 2HB ARG J 66 4.493 63.216 14.393 1.00 0.00 H
+ATOM 9512 1HG ARG J 66 4.018 60.899 14.009 1.00 0.00 H
+ATOM 9513 2HG ARG J 66 4.332 61.072 12.266 1.00 0.00 H
+ATOM 9514 1HD ARG J 66 6.664 61.494 12.687 1.00 0.00 H
+ATOM 9515 2HD ARG J 66 6.381 61.467 14.448 1.00 0.00 H
+ATOM 9516 HE ARG J 66 6.265 59.149 14.395 1.00 0.00 H
+ATOM 9517 1HH1 ARG J 66 6.542 57.107 13.419 1.00 0.00 H
+ATOM 9518 2HH1 ARG J 66 6.610 56.962 11.680 1.00 0.00 H
+ATOM 9519 1HH2 ARG J 66 6.208 60.389 11.101 1.00 0.00 H
+ATOM 9520 2HH2 ARG J 66 6.420 58.814 10.368 1.00 0.00 H
+ATOM 9521 N HIS J 67 1.405 63.074 14.911 1.00 71.13 N
+ATOM 9522 CA HIS J 67 0.590 62.308 15.838 1.00 71.96 C
+ATOM 9523 C HIS J 67 -0.911 62.485 15.599 1.00 72.49 C
+ATOM 9524 O HIS J 67 -1.726 62.079 16.429 1.00 71.65 O
+ATOM 9525 CB HIS J 67 0.929 62.712 17.271 1.00 76.13 C
+ATOM 9526 CG HIS J 67 2.372 62.531 17.574 1.00 71.38 C
+ATOM 9527 ND1 HIS J 67 3.089 61.421 17.172 1.00 70.44 N
+ATOM 9528 CD2 HIS J 67 3.232 63.311 18.256 1.00 73.13 C
+ATOM 9529 CE1 HIS J 67 4.340 61.549 17.585 1.00 78.64 C
+ATOM 9530 NE2 HIS J 67 4.441 62.678 18.248 1.00 75.21 N
+ATOM 9531 H HIS J 67 1.546 64.067 15.078 1.00 0.00 H
+ATOM 9532 HA HIS J 67 0.814 61.249 15.726 1.00 0.00 H
+ATOM 9533 1HB HIS J 67 0.666 63.762 17.433 1.00 0.00 H
+ATOM 9534 2HB HIS J 67 0.351 62.109 17.973 1.00 0.00 H
+ATOM 9535 HD2 HIS J 67 3.012 64.262 18.731 1.00 0.00 H
+ATOM 9536 HE1 HIS J 67 5.152 60.839 17.418 1.00 0.00 H
+ATOM 9537 HE2 HIS J 67 5.281 63.040 18.703 1.00 0.00 H
+ATOM 9538 N GLY J 68 -1.282 63.078 14.461 1.00 74.09 N
+ATOM 9539 CA GLY J 68 -2.695 63.263 14.159 1.00 74.98 C
+ATOM 9540 C GLY J 68 -3.061 64.730 14.017 1.00 75.55 C
+ATOM 9541 O GLY J 68 -2.246 65.569 13.638 1.00 74.87 O
+ATOM 9542 H GLY J 68 -0.588 63.410 13.797 1.00 0.00 H
+ATOM 9543 1HA GLY J 68 -2.934 62.736 13.235 1.00 0.00 H
+ATOM 9544 2HA GLY J 68 -3.300 62.814 14.943 1.00 0.00 H
+ATOM 9545 N VAL J 69 -4.331 65.024 14.256 1.00 75.32 N
+ATOM 9546 CA VAL J 69 -4.829 66.378 14.110 1.00 75.84 C
+ATOM 9547 C VAL J 69 -5.320 66.898 15.439 1.00 75.13 C
+ATOM 9548 O VAL J 69 -5.947 66.168 16.208 1.00 74.55 O
+ATOM 9549 CB VAL J 69 -5.946 66.454 13.059 1.00 75.88 C
+ATOM 9550 CG1 VAL J 69 -6.500 67.873 12.982 1.00 81.33 C
+ATOM 9551 CG2 VAL J 69 -5.371 66.029 11.723 1.00 81.26 C
+ATOM 9552 H VAL J 69 -4.958 64.293 14.557 1.00 0.00 H
+ATOM 9553 HA VAL J 69 -4.016 67.016 13.775 1.00 0.00 H
+ATOM 9554 HB VAL J 69 -6.766 65.797 13.335 1.00 0.00 H
+ATOM 9555 1HG1 VAL J 69 -7.274 67.888 12.242 1.00 0.00 H
+ATOM 9556 2HG1 VAL J 69 -6.921 68.168 13.939 1.00 0.00 H
+ATOM 9557 3HG1 VAL J 69 -5.712 68.571 12.708 1.00 0.00 H
+ATOM 9558 1HG2 VAL J 69 -6.143 66.082 10.958 1.00 0.00 H
+ATOM 9559 2HG2 VAL J 69 -4.557 66.692 11.471 1.00 0.00 H
+ATOM 9560 3HG2 VAL J 69 -4.998 65.011 11.796 1.00 0.00 H
+ATOM 9561 N ILE J 70 -4.964 68.137 15.733 1.00 74.99 N
+ATOM 9562 CA ILE J 70 -5.394 68.771 16.964 1.00 75.87 C
+ATOM 9563 C ILE J 70 -5.839 70.192 16.647 1.00 76.24 C
+ATOM 9564 O ILE J 70 -5.222 70.874 15.830 1.00 74.81 O
+ATOM 9565 CB ILE J 70 -4.244 68.795 17.995 1.00 75.15 C
+ATOM 9566 CG1 ILE J 70 -4.733 69.299 19.341 1.00 68.99 C
+ATOM 9567 CG2 ILE J 70 -3.139 69.676 17.502 1.00 68.26 C
+ATOM 9568 CD1 ILE J 70 -3.753 69.052 20.451 1.00 63.69 C
+ATOM 9569 H ILE J 70 -4.405 68.654 15.061 1.00 0.00 H
+ATOM 9570 HA ILE J 70 -6.242 68.224 17.378 1.00 0.00 H
+ATOM 9571 HB ILE J 70 -3.863 67.795 18.139 1.00 0.00 H
+ATOM 9572 1HG1 ILE J 70 -4.920 70.372 19.282 1.00 0.00 H
+ATOM 9573 2HG1 ILE J 70 -5.668 68.795 19.585 1.00 0.00 H
+ATOM 9574 1HG2 ILE J 70 -2.340 69.694 18.219 1.00 0.00 H
+ATOM 9575 2HG2 ILE J 70 -2.767 69.297 16.546 1.00 0.00 H
+ATOM 9576 3HG2 ILE J 70 -3.529 70.677 17.379 1.00 0.00 H
+ATOM 9577 1HD1 ILE J 70 -4.168 69.418 21.368 1.00 0.00 H
+ATOM 9578 2HD1 ILE J 70 -3.558 67.984 20.545 1.00 0.00 H
+ATOM 9579 3HD1 ILE J 70 -2.826 69.570 20.236 1.00 0.00 H
+ATOM 9580 N GLU J 71 -6.905 70.640 17.286 1.00 77.76 N
+ATOM 9581 CA GLU J 71 -7.288 72.026 17.106 1.00 78.48 C
+ATOM 9582 C GLU J 71 -6.889 72.822 18.328 1.00 79.28 C
+ATOM 9583 O GLU J 71 -6.997 72.349 19.466 1.00 77.74 O
+ATOM 9584 CB GLU J 71 -8.782 72.190 16.823 1.00 74.90 C
+ATOM 9585 CG GLU J 71 -9.237 71.596 15.500 1.00 83.11 C
+ATOM 9586 CD GLU J 71 -10.706 71.838 15.222 1.00 85.44 C
+ATOM 9587 OE1 GLU J 71 -11.377 72.379 16.070 1.00 85.43 O
+ATOM 9588 OE2 GLU J 71 -11.150 71.491 14.156 1.00 88.07 O
+ATOM 9589 H GLU J 71 -7.415 70.038 17.914 1.00 0.00 H
+ATOM 9590 HA GLU J 71 -6.744 72.436 16.256 1.00 0.00 H
+ATOM 9591 1HB GLU J 71 -9.363 71.746 17.629 1.00 0.00 H
+ATOM 9592 2HB GLU J 71 -9.018 73.258 16.796 1.00 0.00 H
+ATOM 9593 1HG GLU J 71 -8.649 72.042 14.699 1.00 0.00 H
+ATOM 9594 2HG GLU J 71 -9.037 70.524 15.507 1.00 0.00 H
+ATOM 9595 N SER J 72 -6.455 74.044 18.077 1.00 80.83 N
+ATOM 9596 CA SER J 72 -6.058 74.980 19.126 1.00 82.00 C
+ATOM 9597 C SER J 72 -7.077 76.107 19.238 1.00 83.96 C
+ATOM 9598 O SER J 72 -7.805 76.367 18.276 1.00 83.91 O
+ATOM 9599 CB SER J 72 -4.674 75.489 18.805 1.00 76.60 C
+ATOM 9600 OG SER J 72 -4.675 76.131 17.590 1.00 67.77 O
+ATOM 9601 H SER J 72 -6.413 74.336 17.099 1.00 0.00 H
+ATOM 9602 HA SER J 72 -6.028 74.454 20.081 1.00 0.00 H
+ATOM 9603 1HB SER J 72 -4.325 76.168 19.592 1.00 0.00 H
+ATOM 9604 2HB SER J 72 -3.998 74.659 18.758 1.00 0.00 H
+ATOM 9605 HG SER J 72 -5.052 75.494 16.972 1.00 0.00 H
+ATOM 9606 N GLU J 73 -7.130 76.767 20.406 1.00 85.18 N
+ATOM 9607 CA GLU J 73 -8.052 77.889 20.605 1.00 85.69 C
+ATOM 9608 C GLU J 73 -7.364 79.136 21.175 1.00 85.21 C
+ATOM 9609 O GLU J 73 -6.140 79.231 21.208 1.00 84.77 O
+ATOM 9610 OXT GLU J 73 -8.051 80.116 21.455 1.00 0.00 O
+ATOM 9611 CB GLU J 73 -9.198 77.488 21.543 1.00 86.69 C
+ATOM 9612 CG GLU J 73 -10.069 76.339 21.033 1.00 92.67 C
+ATOM 9613 CD GLU J 73 -11.267 76.025 21.901 1.00 96.12 C
+ATOM 9614 OE1 GLU J 73 -12.352 76.018 21.366 1.00 97.01 O
+ATOM 9615 OE2 GLU J 73 -11.105 75.779 23.074 1.00 96.56 O
+ATOM 9616 H GLU J 73 -6.516 76.488 21.168 1.00 0.00 H
+ATOM 9617 HA GLU J 73 -8.478 78.161 19.641 1.00 0.00 H
+ATOM 9618 1HB GLU J 73 -8.789 77.203 22.504 1.00 0.00 H
+ATOM 9619 2HB GLU J 73 -9.836 78.353 21.704 1.00 0.00 H
+ATOM 9620 1HG GLU J 73 -10.413 76.579 20.031 1.00 0.00 H
+ATOM 9621 2HG GLU J 73 -9.448 75.447 20.966 1.00 0.00 H
+TER
+ATOM 9623 N SER K 7 15.001 63.822 16.401 1.00 80.60 N
+ATOM 9624 CA SER K 7 14.394 63.627 17.710 1.00 80.73 C
+ATOM 9625 C SER K 7 12.877 63.694 17.619 1.00 80.11 C
+ATOM 9626 O SER K 7 12.323 64.445 16.815 1.00 82.35 O
+ATOM 9627 CB SER K 7 14.915 64.657 18.684 1.00 90.75 C
+ATOM 9628 OG SER K 7 16.293 64.485 18.882 1.00 96.26 O
+ATOM 9629 1H SER K 7 15.750 63.157 16.273 1.00 0.00 H
+ATOM 9630 2H SER K 7 14.302 63.684 15.685 1.00 0.00 H
+ATOM 9631 3H SER K 7 15.368 64.760 16.339 1.00 0.00 H
+ATOM 9632 HA SER K 7 14.667 62.638 18.075 1.00 0.00 H
+ATOM 9633 1HB SER K 7 14.717 65.662 18.308 1.00 0.00 H
+ATOM 9634 2HB SER K 7 14.387 64.556 19.635 1.00 0.00 H
+ATOM 9635 HG SER K 7 16.690 64.538 18.012 1.00 0.00 H
+ATOM 9636 N ASP K 8 12.208 62.884 18.433 1.00 77.15 N
+ATOM 9637 CA ASP K 8 10.750 62.815 18.430 1.00 74.30 C
+ATOM 9638 C ASP K 8 10.171 63.981 19.224 1.00 71.74 C
+ATOM 9639 O ASP K 8 10.920 64.736 19.856 1.00 68.33 O
+ATOM 9640 CB ASP K 8 10.289 61.466 19.011 1.00 75.58 C
+ATOM 9641 CG ASP K 8 8.950 60.951 18.439 1.00 79.88 C
+ATOM 9642 OD1 ASP K 8 8.168 61.754 17.982 1.00 69.54 O
+ATOM 9643 OD2 ASP K 8 8.740 59.749 18.438 1.00 81.16 O
+ATOM 9644 H ASP K 8 12.718 62.293 19.074 1.00 0.00 H
+ATOM 9645 HA ASP K 8 10.395 62.895 17.401 1.00 0.00 H
+ATOM 9646 1HB ASP K 8 11.056 60.712 18.846 1.00 0.00 H
+ATOM 9647 2HB ASP K 8 10.164 61.572 20.092 1.00 0.00 H
+ATOM 9648 N PHE K 9 8.844 64.108 19.190 1.00 70.57 N
+ATOM 9649 CA PHE K 9 8.141 65.205 19.866 1.00 70.15 C
+ATOM 9650 C PHE K 9 6.772 64.829 20.397 1.00 70.38 C
+ATOM 9651 O PHE K 9 6.204 63.800 20.027 1.00 70.49 O
+ATOM 9652 CB PHE K 9 7.953 66.409 18.920 1.00 64.57 C
+ATOM 9653 CG PHE K 9 7.070 66.192 17.743 1.00 62.97 C
+ATOM 9654 CD1 PHE K 9 5.721 66.500 17.823 1.00 60.99 C
+ATOM 9655 CD2 PHE K 9 7.573 65.718 16.547 1.00 62.03 C
+ATOM 9656 CE1 PHE K 9 4.890 66.336 16.739 1.00 63.86 C
+ATOM 9657 CE2 PHE K 9 6.744 65.551 15.460 1.00 63.86 C
+ATOM 9658 CZ PHE K 9 5.404 65.861 15.556 1.00 63.59 C
+ATOM 9659 H PHE K 9 8.325 63.413 18.655 1.00 0.00 H
+ATOM 9660 HA PHE K 9 8.742 65.513 20.720 1.00 0.00 H
+ATOM 9661 1HB PHE K 9 7.521 67.231 19.474 1.00 0.00 H
+ATOM 9662 2HB PHE K 9 8.901 66.735 18.561 1.00 0.00 H
+ATOM 9663 HD1 PHE K 9 5.323 66.878 18.765 1.00 0.00 H
+ATOM 9664 HD2 PHE K 9 8.635 65.477 16.467 1.00 0.00 H
+ATOM 9665 HE1 PHE K 9 3.833 66.583 16.824 1.00 0.00 H
+ATOM 9666 HE2 PHE K 9 7.145 65.176 14.520 1.00 0.00 H
+ATOM 9667 HZ PHE K 9 4.767 65.730 14.697 1.00 0.00 H
+ATOM 9668 N VAL K 10 6.237 65.690 21.257 1.00 69.29 N
+ATOM 9669 CA VAL K 10 4.891 65.513 21.790 1.00 68.48 C
+ATOM 9670 C VAL K 10 4.069 66.774 21.529 1.00 67.61 C
+ATOM 9671 O VAL K 10 4.623 67.867 21.394 1.00 66.73 O
+ATOM 9672 CB VAL K 10 4.950 65.249 23.314 1.00 62.16 C
+ATOM 9673 CG1 VAL K 10 5.762 63.986 23.607 1.00 61.69 C
+ATOM 9674 CG2 VAL K 10 5.572 66.447 24.016 1.00 70.51 C
+ATOM 9675 H VAL K 10 6.796 66.496 21.535 1.00 0.00 H
+ATOM 9676 HA VAL K 10 4.412 64.670 21.291 1.00 0.00 H
+ATOM 9677 HB VAL K 10 3.934 65.087 23.690 1.00 0.00 H
+ATOM 9678 1HG1 VAL K 10 5.784 63.825 24.670 1.00 0.00 H
+ATOM 9679 2HG1 VAL K 10 5.305 63.130 23.115 1.00 0.00 H
+ATOM 9680 3HG1 VAL K 10 6.781 64.111 23.249 1.00 0.00 H
+ATOM 9681 1HG2 VAL K 10 5.604 66.263 25.093 1.00 0.00 H
+ATOM 9682 2HG2 VAL K 10 6.587 66.600 23.641 1.00 0.00 H
+ATOM 9683 3HG2 VAL K 10 4.976 67.338 23.819 1.00 0.00 H
+ATOM 9684 N VAL K 11 2.743 66.630 21.484 1.00 66.98 N
+ATOM 9685 CA VAL K 11 1.867 67.793 21.321 1.00 66.60 C
+ATOM 9686 C VAL K 11 1.010 67.959 22.562 1.00 67.36 C
+ATOM 9687 O VAL K 11 0.259 67.058 22.910 1.00 66.25 O
+ATOM 9688 CB VAL K 11 0.927 67.609 20.123 1.00 63.92 C
+ATOM 9689 CG1 VAL K 11 0.043 68.821 19.988 1.00 65.81 C
+ATOM 9690 CG2 VAL K 11 1.720 67.338 18.861 1.00 64.94 C
+ATOM 9691 H VAL K 11 2.331 65.701 21.564 1.00 0.00 H
+ATOM 9692 HA VAL K 11 2.471 68.688 21.186 1.00 0.00 H
+ATOM 9693 HB VAL K 11 0.285 66.785 20.316 1.00 0.00 H
+ATOM 9694 1HG1 VAL K 11 -0.630 68.662 19.160 1.00 0.00 H
+ATOM 9695 2HG1 VAL K 11 -0.529 68.957 20.907 1.00 0.00 H
+ATOM 9696 3HG1 VAL K 11 0.640 69.699 19.809 1.00 0.00 H
+ATOM 9697 1HG2 VAL K 11 1.034 67.191 18.025 1.00 0.00 H
+ATOM 9698 2HG2 VAL K 11 2.363 68.166 18.653 1.00 0.00 H
+ATOM 9699 3HG2 VAL K 11 2.317 66.445 18.995 1.00 0.00 H
+ATOM 9700 N ILE K 12 1.110 69.104 23.226 1.00 67.73 N
+ATOM 9701 CA ILE K 12 0.374 69.312 24.471 1.00 66.15 C
+ATOM 9702 C ILE K 12 -0.605 70.487 24.403 1.00 64.95 C
+ATOM 9703 O ILE K 12 -0.211 71.609 24.099 1.00 63.83 O
+ATOM 9704 CB ILE K 12 1.384 69.581 25.611 1.00 69.39 C
+ATOM 9705 CG1 ILE K 12 2.340 68.371 25.764 1.00 65.58 C
+ATOM 9706 CG2 ILE K 12 0.633 69.852 26.927 1.00 71.36 C
+ATOM 9707 CD1 ILE K 12 3.512 68.642 26.632 1.00 59.92 C
+ATOM 9708 H ILE K 12 1.741 69.820 22.888 1.00 0.00 H
+ATOM 9709 HA ILE K 12 -0.194 68.418 24.699 1.00 0.00 H
+ATOM 9710 HB ILE K 12 1.993 70.448 25.355 1.00 0.00 H
+ATOM 9711 1HG1 ILE K 12 1.805 67.551 26.189 1.00 0.00 H
+ATOM 9712 2HG1 ILE K 12 2.710 68.074 24.789 1.00 0.00 H
+ATOM 9713 1HG2 ILE K 12 1.347 70.048 27.719 1.00 0.00 H
+ATOM 9714 2HG2 ILE K 12 -0.015 70.720 26.799 1.00 0.00 H
+ATOM 9715 3HG2 ILE K 12 0.029 68.993 27.194 1.00 0.00 H
+ATOM 9716 1HD1 ILE K 12 4.129 67.743 26.701 1.00 0.00 H
+ATOM 9717 2HD1 ILE K 12 4.099 69.457 26.212 1.00 0.00 H
+ATOM 9718 3HD1 ILE K 12 3.162 68.921 27.609 1.00 0.00 H
+ATOM 9719 N LYS K 13 -1.883 70.233 24.721 1.00 64.93 N
+ATOM 9720 CA LYS K 13 -2.880 71.300 24.745 1.00 65.84 C
+ATOM 9721 C LYS K 13 -3.516 71.463 26.106 1.00 65.80 C
+ATOM 9722 O LYS K 13 -4.095 70.537 26.666 1.00 64.00 O
+ATOM 9723 CB LYS K 13 -4.004 71.082 23.750 1.00 66.24 C
+ATOM 9724 CG LYS K 13 -5.031 72.233 23.788 1.00 64.47 C
+ATOM 9725 CD LYS K 13 -6.024 72.219 22.645 1.00 65.96 C
+ATOM 9726 CE LYS K 13 -6.973 71.051 22.710 1.00 64.18 C
+ATOM 9727 NZ LYS K 13 -8.108 71.255 21.778 1.00 60.33 N
+ATOM 9728 H LYS K 13 -2.173 69.286 24.932 1.00 0.00 H
+ATOM 9729 HA LYS K 13 -2.384 72.229 24.503 1.00 0.00 H
+ATOM 9730 1HB LYS K 13 -3.604 70.983 22.770 1.00 0.00 H
+ATOM 9731 2HB LYS K 13 -4.520 70.158 23.992 1.00 0.00 H
+ATOM 9732 1HG LYS K 13 -5.587 72.186 24.724 1.00 0.00 H
+ATOM 9733 2HG LYS K 13 -4.496 73.186 23.760 1.00 0.00 H
+ATOM 9734 1HD LYS K 13 -6.607 73.142 22.655 1.00 0.00 H
+ATOM 9735 2HD LYS K 13 -5.485 72.171 21.696 1.00 0.00 H
+ATOM 9736 1HE LYS K 13 -6.434 70.152 22.415 1.00 0.00 H
+ATOM 9737 2HE LYS K 13 -7.353 70.922 23.723 1.00 0.00 H
+ATOM 9738 1HZ LYS K 13 -8.729 70.464 21.796 1.00 0.00 H
+ATOM 9739 2HZ LYS K 13 -8.614 72.086 22.045 1.00 0.00 H
+ATOM 9740 3HZ LYS K 13 -7.736 71.393 20.829 1.00 0.00 H
+ATOM 9741 N ALA K 14 -3.425 72.649 26.658 1.00 66.69 N
+ATOM 9742 CA ALA K 14 -4.023 72.851 27.969 1.00 66.58 C
+ATOM 9743 C ALA K 14 -5.539 72.726 27.921 1.00 67.09 C
+ATOM 9744 O ALA K 14 -6.195 73.312 27.055 1.00 63.14 O
+ATOM 9745 CB ALA K 14 -3.664 74.201 28.486 1.00 61.61 C
+ATOM 9746 H ALA K 14 -2.958 73.404 26.152 1.00 0.00 H
+ATOM 9747 HA ALA K 14 -3.640 72.086 28.644 1.00 0.00 H
+ATOM 9748 1HB ALA K 14 -4.101 74.362 29.466 1.00 0.00 H
+ATOM 9749 2HB ALA K 14 -2.607 74.294 28.547 1.00 0.00 H
+ATOM 9750 3HB ALA K 14 -4.054 74.893 27.791 1.00 0.00 H
+ATOM 9751 N LEU K 15 -6.121 72.054 28.905 1.00 68.52 N
+ATOM 9752 CA LEU K 15 -7.576 71.982 29.030 1.00 70.99 C
+ATOM 9753 C LEU K 15 -8.073 72.936 30.110 1.00 72.89 C
+ATOM 9754 O LEU K 15 -9.277 73.148 30.270 1.00 73.08 O
+ATOM 9755 CB LEU K 15 -7.994 70.536 29.272 1.00 66.63 C
+ATOM 9756 CG LEU K 15 -8.293 69.693 27.998 1.00 69.17 C
+ATOM 9757 CD1 LEU K 15 -7.315 70.035 26.902 1.00 63.39 C
+ATOM 9758 CD2 LEU K 15 -8.154 68.215 28.357 1.00 64.58 C
+ATOM 9759 H LEU K 15 -5.552 71.565 29.599 1.00 0.00 H
+ATOM 9760 HA LEU K 15 -8.021 72.295 28.086 1.00 0.00 H
+ATOM 9761 1HB LEU K 15 -7.175 70.053 29.769 1.00 0.00 H
+ATOM 9762 2HB LEU K 15 -8.863 70.512 29.925 1.00 0.00 H
+ATOM 9763 HG LEU K 15 -9.303 69.899 27.640 1.00 0.00 H
+ATOM 9764 1HD1 LEU K 15 -7.521 69.435 26.026 1.00 0.00 H
+ATOM 9765 2HD1 LEU K 15 -7.412 71.088 26.645 1.00 0.00 H
+ATOM 9766 3HD1 LEU K 15 -6.335 69.846 27.243 1.00 0.00 H
+ATOM 9767 1HD2 LEU K 15 -8.355 67.600 27.478 1.00 0.00 H
+ATOM 9768 2HD2 LEU K 15 -7.144 68.020 28.708 1.00 0.00 H
+ATOM 9769 3HD2 LEU K 15 -8.858 67.964 29.134 1.00 0.00 H
+ATOM 9770 N GLU K 16 -7.122 73.533 30.820 1.00 74.24 N
+ATOM 9771 CA GLU K 16 -7.401 74.493 31.882 1.00 76.94 C
+ATOM 9772 C GLU K 16 -6.279 75.520 31.984 1.00 76.71 C
+ATOM 9773 O GLU K 16 -5.187 75.317 31.469 1.00 77.64 O
+ATOM 9774 CB GLU K 16 -7.603 73.803 33.239 1.00 80.56 C
+ATOM 9775 CG GLU K 16 -6.401 73.046 33.783 1.00 81.34 C
+ATOM 9776 CD GLU K 16 -6.704 72.360 35.119 1.00 87.32 C
+ATOM 9777 OE1 GLU K 16 -7.774 72.573 35.657 1.00 89.42 O
+ATOM 9778 OE2 GLU K 16 -5.883 71.581 35.568 1.00 93.67 O
+ATOM 9779 H GLU K 16 -6.163 73.296 30.615 1.00 0.00 H
+ATOM 9780 HA GLU K 16 -8.320 75.022 31.635 1.00 0.00 H
+ATOM 9781 1HB GLU K 16 -7.878 74.554 33.982 1.00 0.00 H
+ATOM 9782 2HB GLU K 16 -8.426 73.094 33.167 1.00 0.00 H
+ATOM 9783 1HG GLU K 16 -6.089 72.307 33.051 1.00 0.00 H
+ATOM 9784 2HG GLU K 16 -5.576 73.750 33.916 1.00 0.00 H
+ATOM 9785 N ASP K 17 -6.569 76.647 32.611 1.00 75.58 N
+ATOM 9786 CA ASP K 17 -5.546 77.666 32.831 1.00 75.76 C
+ATOM 9787 C ASP K 17 -4.461 77.168 33.787 1.00 75.05 C
+ATOM 9788 O ASP K 17 -4.753 76.406 34.708 1.00 75.31 O
+ATOM 9789 CB ASP K 17 -6.180 78.943 33.358 1.00 88.19 C
+ATOM 9790 CG ASP K 17 -7.012 79.648 32.308 1.00 94.80 C
+ATOM 9791 OD1 ASP K 17 -6.942 79.257 31.150 1.00 95.90 O
+ATOM 9792 OD2 ASP K 17 -7.716 80.569 32.657 1.00 97.41 O
+ATOM 9793 H ASP K 17 -7.496 76.781 32.984 1.00 0.00 H
+ATOM 9794 HA ASP K 17 -5.079 77.894 31.890 1.00 0.00 H
+ATOM 9795 1HB ASP K 17 -6.810 78.713 34.216 1.00 0.00 H
+ATOM 9796 2HB ASP K 17 -5.395 79.616 33.690 1.00 0.00 H
+ATOM 9797 N GLY K 18 -3.223 77.632 33.608 1.00 73.93 N
+ATOM 9798 CA GLY K 18 -2.139 77.279 34.524 1.00 73.88 C
+ATOM 9799 C GLY K 18 -1.437 75.927 34.284 1.00 73.96 C
+ATOM 9800 O GLY K 18 -0.873 75.361 35.220 1.00 73.39 O
+ATOM 9801 H GLY K 18 -3.026 78.277 32.839 1.00 0.00 H
+ATOM 9802 1HA GLY K 18 -1.391 78.073 34.486 1.00 0.00 H
+ATOM 9803 2HA GLY K 18 -2.526 77.299 35.538 1.00 0.00 H
+ATOM 9804 N VAL K 19 -1.483 75.395 33.063 1.00 74.37 N
+ATOM 9805 CA VAL K 19 -0.808 74.126 32.769 1.00 73.64 C
+ATOM 9806 C VAL K 19 0.689 74.359 32.646 1.00 72.53 C
+ATOM 9807 O VAL K 19 1.136 75.303 32.001 1.00 71.27 O
+ATOM 9808 CB VAL K 19 -1.378 73.463 31.501 1.00 76.81 C
+ATOM 9809 CG1 VAL K 19 -0.558 72.212 31.086 1.00 81.35 C
+ATOM 9810 CG2 VAL K 19 -2.803 73.056 31.799 1.00 76.39 C
+ATOM 9811 H VAL K 19 -1.939 75.893 32.305 1.00 0.00 H
+ATOM 9812 HA VAL K 19 -0.980 73.449 33.605 1.00 0.00 H
+ATOM 9813 HB VAL K 19 -1.359 74.170 30.688 1.00 0.00 H
+ATOM 9814 1HG1 VAL K 19 -0.999 71.771 30.191 1.00 0.00 H
+ATOM 9815 2HG1 VAL K 19 0.474 72.496 30.873 1.00 0.00 H
+ATOM 9816 3HG1 VAL K 19 -0.569 71.482 31.894 1.00 0.00 H
+ATOM 9817 1HG2 VAL K 19 -3.255 72.599 30.933 1.00 0.00 H
+ATOM 9818 2HG2 VAL K 19 -2.824 72.343 32.624 1.00 0.00 H
+ATOM 9819 3HG2 VAL K 19 -3.359 73.940 32.079 1.00 0.00 H
+ATOM 9820 N ASN K 20 1.468 73.526 33.318 1.00 71.91 N
+ATOM 9821 CA ASN K 20 2.912 73.708 33.340 1.00 73.16 C
+ATOM 9822 C ASN K 20 3.651 72.533 32.711 1.00 72.75 C
+ATOM 9823 O ASN K 20 3.581 71.405 33.211 1.00 71.11 O
+ATOM 9824 CB ASN K 20 3.363 73.958 34.769 1.00 81.30 C
+ATOM 9825 CG ASN K 20 4.803 74.357 34.903 1.00 87.32 C
+ATOM 9826 OD1 ASN K 20 5.599 74.249 33.971 1.00 93.01 O
+ATOM 9827 ND2 ASN K 20 5.153 74.826 36.080 1.00 82.44 N
+ATOM 9828 H ASN K 20 1.040 72.751 33.820 1.00 0.00 H
+ATOM 9829 HA ASN K 20 3.165 74.590 32.748 1.00 0.00 H
+ATOM 9830 1HB ASN K 20 2.736 74.738 35.210 1.00 0.00 H
+ATOM 9831 2HB ASN K 20 3.209 73.060 35.347 1.00 0.00 H
+ATOM 9832 1HD2 ASN K 20 6.096 75.110 36.248 1.00 0.00 H
+ATOM 9833 2HD2 ASN K 20 4.474 74.901 36.810 1.00 0.00 H
+ATOM 9834 N VAL K 21 4.307 72.783 31.577 1.00 72.83 N
+ATOM 9835 CA VAL K 21 5.057 71.734 30.908 1.00 71.38 C
+ATOM 9836 C VAL K 21 6.528 71.927 31.271 1.00 71.61 C
+ATOM 9837 O VAL K 21 7.114 72.980 31.028 1.00 70.16 O
+ATOM 9838 CB VAL K 21 4.865 71.807 29.390 1.00 65.67 C
+ATOM 9839 CG1 VAL K 21 5.664 70.698 28.750 1.00 68.55 C
+ATOM 9840 CG2 VAL K 21 3.374 71.709 29.060 1.00 63.57 C
+ATOM 9841 H VAL K 21 4.317 73.720 31.182 1.00 0.00 H
+ATOM 9842 HA VAL K 21 4.723 70.763 31.261 1.00 0.00 H
+ATOM 9843 HB VAL K 21 5.254 72.753 29.018 1.00 0.00 H
+ATOM 9844 1HG1 VAL K 21 5.557 70.734 27.675 1.00 0.00 H
+ATOM 9845 2HG1 VAL K 21 6.717 70.814 29.011 1.00 0.00 H
+ATOM 9846 3HG1 VAL K 21 5.302 69.744 29.120 1.00 0.00 H
+ATOM 9847 1HG2 VAL K 21 3.234 71.766 27.982 1.00 0.00 H
+ATOM 9848 2HG2 VAL K 21 2.982 70.768 29.431 1.00 0.00 H
+ATOM 9849 3HG2 VAL K 21 2.843 72.537 29.535 1.00 0.00 H
+ATOM 9850 N ILE K 22 7.116 70.929 31.910 1.00 71.20 N
+ATOM 9851 CA ILE K 22 8.449 71.077 32.459 1.00 70.22 C
+ATOM 9852 C ILE K 22 9.494 70.208 31.763 1.00 70.21 C
+ATOM 9853 O ILE K 22 9.311 69.003 31.575 1.00 70.22 O
+ATOM 9854 CB ILE K 22 8.405 70.760 33.965 1.00 65.80 C
+ATOM 9855 CG1 ILE K 22 7.430 71.712 34.671 1.00 60.59 C
+ATOM 9856 CG2 ILE K 22 9.782 70.865 34.569 1.00 58.94 C
+ATOM 9857 CD1 ILE K 22 7.142 71.325 36.099 1.00 62.88 C
+ATOM 9858 H ILE K 22 6.604 70.072 32.062 1.00 0.00 H
+ATOM 9859 HA ILE K 22 8.747 72.113 32.342 1.00 0.00 H
+ATOM 9860 HB ILE K 22 8.026 69.782 34.105 1.00 0.00 H
+ATOM 9861 1HG1 ILE K 22 7.835 72.718 34.651 1.00 0.00 H
+ATOM 9862 2HG1 ILE K 22 6.482 71.710 34.134 1.00 0.00 H
+ATOM 9863 1HG2 ILE K 22 9.727 70.634 35.633 1.00 0.00 H
+ATOM 9864 2HG2 ILE K 22 10.455 70.164 34.082 1.00 0.00 H
+ATOM 9865 3HG2 ILE K 22 10.157 71.883 34.432 1.00 0.00 H
+ATOM 9866 1HD1 ILE K 22 6.437 72.033 36.536 1.00 0.00 H
+ATOM 9867 2HD1 ILE K 22 6.710 70.322 36.118 1.00 0.00 H
+ATOM 9868 3HD1 ILE K 22 8.070 71.334 36.669 1.00 0.00 H
+ATOM 9869 N GLY K 23 10.594 70.839 31.347 1.00 68.10 N
+ATOM 9870 CA GLY K 23 11.685 70.107 30.717 1.00 66.40 C
+ATOM 9871 C GLY K 23 12.682 69.648 31.777 1.00 66.18 C
+ATOM 9872 O GLY K 23 13.149 70.457 32.595 1.00 66.25 O
+ATOM 9873 H GLY K 23 10.680 71.836 31.519 1.00 0.00 H
+ATOM 9874 1HA GLY K 23 11.293 69.243 30.177 1.00 0.00 H
+ATOM 9875 2HA GLY K 23 12.185 70.745 29.987 1.00 0.00 H
+ATOM 9876 N LEU K 24 13.028 68.353 31.715 1.00 64.83 N
+ATOM 9877 CA LEU K 24 13.976 67.686 32.616 1.00 63.59 C
+ATOM 9878 C LEU K 24 15.292 67.410 31.898 1.00 63.02 C
+ATOM 9879 O LEU K 24 15.306 66.870 30.778 1.00 62.05 O
+ATOM 9880 CB LEU K 24 13.393 66.363 33.118 1.00 60.04 C
+ATOM 9881 CG LEU K 24 12.322 66.437 34.235 1.00 67.47 C
+ATOM 9882 CD1 LEU K 24 11.020 67.013 33.670 1.00 59.94 C
+ATOM 9883 CD2 LEU K 24 12.083 65.036 34.799 1.00 72.45 C
+ATOM 9884 H LEU K 24 12.571 67.776 31.012 1.00 0.00 H
+ATOM 9885 HA LEU K 24 14.173 68.335 33.465 1.00 0.00 H
+ATOM 9886 1HB LEU K 24 12.934 65.895 32.276 1.00 0.00 H
+ATOM 9887 2HB LEU K 24 14.211 65.727 33.465 1.00 0.00 H
+ATOM 9888 HG LEU K 24 12.670 67.094 35.031 1.00 0.00 H
+ATOM 9889 1HD1 LEU K 24 10.283 67.066 34.464 1.00 0.00 H
+ATOM 9890 2HD1 LEU K 24 11.190 67.998 33.287 1.00 0.00 H
+ATOM 9891 3HD1 LEU K 24 10.647 66.375 32.864 1.00 0.00 H
+ATOM 9892 1HD2 LEU K 24 11.334 65.084 35.591 1.00 0.00 H
+ATOM 9893 2HD2 LEU K 24 11.730 64.378 34.013 1.00 0.00 H
+ATOM 9894 3HD2 LEU K 24 13.015 64.647 35.210 1.00 0.00 H
+ATOM 9895 N THR K 25 16.397 67.764 32.558 1.00 62.26 N
+ATOM 9896 CA THR K 25 17.717 67.706 31.943 1.00 62.03 C
+ATOM 9897 C THR K 25 18.204 66.338 31.513 1.00 60.59 C
+ATOM 9898 O THR K 25 17.957 65.326 32.168 1.00 60.59 O
+ATOM 9899 CB THR K 25 18.792 68.269 32.894 1.00 57.99 C
+ATOM 9900 OG1 THR K 25 18.784 67.533 34.131 1.00 56.19 O
+ATOM 9901 CG2 THR K 25 18.550 69.715 33.161 1.00 51.65 C
+ATOM 9902 H THR K 25 16.303 68.161 33.490 1.00 0.00 H
+ATOM 9903 HA THR K 25 17.686 68.342 31.073 1.00 0.00 H
+ATOM 9904 HB THR K 25 19.775 68.165 32.436 1.00 0.00 H
+ATOM 9905 HG1 THR K 25 19.519 66.872 34.150 1.00 0.00 H
+ATOM 9906 1HG2 THR K 25 19.320 70.093 33.827 1.00 0.00 H
+ATOM 9907 2HG2 THR K 25 18.582 70.256 32.219 1.00 0.00 H
+ATOM 9908 3HG2 THR K 25 17.586 69.845 33.615 1.00 0.00 H
+ATOM 9909 N ARG K 26 18.955 66.358 30.413 1.00 57.21 N
+ATOM 9910 CA ARG K 26 19.673 65.209 29.884 1.00 57.02 C
+ATOM 9911 C ARG K 26 21.086 65.179 30.447 1.00 55.71 C
+ATOM 9912 O ARG K 26 21.813 66.169 30.367 1.00 57.12 O
+ATOM 9913 CB ARG K 26 19.778 65.275 28.364 1.00 60.52 C
+ATOM 9914 CG ARG K 26 20.437 64.055 27.718 1.00 66.49 C
+ATOM 9915 CD ARG K 26 20.599 64.209 26.242 1.00 60.94 C
+ATOM 9916 NE ARG K 26 19.329 64.400 25.574 1.00 60.07 N
+ATOM 9917 CZ ARG K 26 18.482 63.418 25.247 1.00 56.19 C
+ATOM 9918 NH1 ARG K 26 18.777 62.171 25.521 1.00 57.13 N
+ATOM 9919 NH2 ARG K 26 17.360 63.738 24.650 1.00 49.05 N
+ATOM 9920 H ARG K 26 19.016 67.240 29.916 1.00 0.00 H
+ATOM 9921 HA ARG K 26 19.156 64.299 30.184 1.00 0.00 H
+ATOM 9922 1HB ARG K 26 18.787 65.400 27.926 1.00 0.00 H
+ATOM 9923 2HB ARG K 26 20.365 66.147 28.081 1.00 0.00 H
+ATOM 9924 1HG ARG K 26 21.432 63.909 28.144 1.00 0.00 H
+ATOM 9925 2HG ARG K 26 19.833 63.169 27.903 1.00 0.00 H
+ATOM 9926 1HD ARG K 26 21.228 65.068 26.033 1.00 0.00 H
+ATOM 9927 2HD ARG K 26 21.068 63.311 25.838 1.00 0.00 H
+ATOM 9928 HE ARG K 26 19.046 65.349 25.311 1.00 0.00 H
+ATOM 9929 1HH1 ARG K 26 19.657 61.957 25.973 1.00 0.00 H
+ATOM 9930 2HH1 ARG K 26 18.146 61.426 25.265 1.00 0.00 H
+ATOM 9931 1HH2 ARG K 26 17.189 64.725 24.452 1.00 0.00 H
+ATOM 9932 2HH2 ARG K 26 16.669 63.035 24.404 1.00 0.00 H
+ATOM 9933 N GLY K 27 21.483 64.046 31.003 1.00 54.08 N
+ATOM 9934 CA GLY K 27 22.828 63.910 31.546 1.00 55.69 C
+ATOM 9935 C GLY K 27 22.805 63.161 32.864 1.00 58.14 C
+ATOM 9936 O GLY K 27 21.766 62.660 33.285 1.00 60.70 O
+ATOM 9937 H GLY K 27 20.844 63.266 31.058 1.00 0.00 H
+ATOM 9938 1HA GLY K 27 23.454 63.377 30.832 1.00 0.00 H
+ATOM 9939 2HA GLY K 27 23.269 64.895 31.690 1.00 0.00 H
+ATOM 9940 N ALA K 28 23.963 63.084 33.519 1.00 57.47 N
+ATOM 9941 CA ALA K 28 24.064 62.368 34.790 1.00 60.30 C
+ATOM 9942 C ALA K 28 23.150 62.985 35.844 1.00 61.47 C
+ATOM 9943 O ALA K 28 22.590 62.275 36.682 1.00 60.83 O
+ATOM 9944 CB ALA K 28 25.500 62.386 35.286 1.00 54.94 C
+ATOM 9945 H ALA K 28 24.783 63.516 33.123 1.00 0.00 H
+ATOM 9946 HA ALA K 28 23.749 61.337 34.627 1.00 0.00 H
+ATOM 9947 1HB ALA K 28 25.562 61.831 36.221 1.00 0.00 H
+ATOM 9948 2HB ALA K 28 26.149 61.922 34.545 1.00 0.00 H
+ATOM 9949 3HB ALA K 28 25.814 63.416 35.454 1.00 0.00 H
+ATOM 9950 N ASP K 29 23.009 64.308 35.812 1.00 61.96 N
+ATOM 9951 CA ASP K 29 22.162 65.009 36.762 1.00 64.40 C
+ATOM 9952 C ASP K 29 20.790 65.308 36.162 1.00 65.76 C
+ATOM 9953 O ASP K 29 20.696 65.997 35.145 1.00 65.21 O
+ATOM 9954 CB ASP K 29 22.769 66.341 37.202 1.00 63.92 C
+ATOM 9955 CG ASP K 29 24.048 66.232 38.039 1.00 74.67 C
+ATOM 9956 OD1 ASP K 29 24.358 65.165 38.510 1.00 76.16 O
+ATOM 9957 OD2 ASP K 29 24.666 67.258 38.247 1.00 77.93 O
+ATOM 9958 H ASP K 29 23.495 64.832 35.098 1.00 0.00 H
+ATOM 9959 HA ASP K 29 22.029 64.379 37.641 1.00 0.00 H
+ATOM 9960 1HB ASP K 29 22.979 66.951 36.323 1.00 0.00 H
+ATOM 9961 2HB ASP K 29 22.024 66.874 37.791 1.00 0.00 H
+ATOM 9962 N THR K 30 19.739 64.814 36.822 1.00 66.39 N
+ATOM 9963 CA THR K 30 18.390 65.105 36.341 1.00 67.36 C
+ATOM 9964 C THR K 30 17.752 66.177 37.217 1.00 70.91 C
+ATOM 9965 O THR K 30 17.623 66.013 38.437 1.00 70.32 O
+ATOM 9966 CB THR K 30 17.476 63.862 36.369 1.00 61.54 C
+ATOM 9967 OG1 THR K 30 18.015 62.830 35.531 1.00 41.25 O
+ATOM 9968 CG2 THR K 30 16.080 64.251 35.840 1.00 46.56 C
+ATOM 9969 H THR K 30 19.880 64.243 37.636 1.00 0.00 H
+ATOM 9970 HA THR K 30 18.439 65.465 35.322 1.00 0.00 H
+ATOM 9971 HB THR K 30 17.396 63.495 37.374 1.00 0.00 H
+ATOM 9972 HG1 THR K 30 18.817 62.487 35.937 1.00 0.00 H
+ATOM 9973 1HG2 THR K 30 15.429 63.376 35.856 1.00 0.00 H
+ATOM 9974 2HG2 THR K 30 15.651 65.031 36.477 1.00 0.00 H
+ATOM 9975 3HG2 THR K 30 16.158 64.624 34.820 1.00 0.00 H
+ATOM 9976 N ARG K 31 17.330 67.266 36.600 1.00 71.32 N
+ATOM 9977 CA ARG K 31 16.665 68.367 37.292 1.00 70.99 C
+ATOM 9978 C ARG K 31 15.798 69.115 36.304 1.00 71.17 C
+ATOM 9979 O ARG K 31 15.957 68.995 35.100 1.00 70.03 O
+ATOM 9980 CB ARG K 31 17.699 69.321 37.891 1.00 69.21 C
+ATOM 9981 CG ARG K 31 18.615 69.994 36.865 1.00 63.94 C
+ATOM 9982 CD ARG K 31 19.560 70.993 37.487 1.00 55.58 C
+ATOM 9983 NE ARG K 31 20.555 70.386 38.390 1.00 58.86 N
+ATOM 9984 CZ ARG K 31 21.776 69.912 38.019 1.00 64.10 C
+ATOM 9985 NH1 ARG K 31 22.167 69.979 36.766 1.00 65.67 N
+ATOM 9986 NH2 ARG K 31 22.584 69.384 38.931 1.00 52.57 N
+ATOM 9987 H ARG K 31 17.524 67.349 35.605 1.00 0.00 H
+ATOM 9988 HA ARG K 31 16.051 67.957 38.090 1.00 0.00 H
+ATOM 9989 1HB ARG K 31 17.177 70.113 38.431 1.00 0.00 H
+ATOM 9990 2HB ARG K 31 18.325 68.789 38.605 1.00 0.00 H
+ATOM 9991 1HG ARG K 31 19.198 69.226 36.352 1.00 0.00 H
+ATOM 9992 2HG ARG K 31 17.994 70.522 36.139 1.00 0.00 H
+ATOM 9993 1HD ARG K 31 20.098 71.514 36.694 1.00 0.00 H
+ATOM 9994 2HD ARG K 31 18.982 71.714 38.060 1.00 0.00 H
+ATOM 9995 HE ARG K 31 20.305 70.307 39.368 1.00 0.00 H
+ATOM 9996 1HH1 ARG K 31 21.561 70.383 36.066 1.00 0.00 H
+ATOM 9997 2HH1 ARG K 31 23.079 69.628 36.503 1.00 0.00 H
+ATOM 9998 1HH2 ARG K 31 22.291 69.330 39.893 1.00 0.00 H
+ATOM 9999 2HH2 ARG K 31 23.511 69.012 38.661 1.00 0.00 H
+ATOM 10000 N PHE K 32 14.834 69.886 36.792 1.00 72.26 N
+ATOM 10001 CA PHE K 32 14.085 70.692 35.819 1.00 73.67 C
+ATOM 10002 C PHE K 32 15.053 71.733 35.266 1.00 73.87 C
+ATOM 10003 O PHE K 32 15.920 72.202 35.994 1.00 75.86 O
+ATOM 10004 CB PHE K 32 12.883 71.370 36.439 1.00 74.97 C
+ATOM 10005 CG PHE K 32 13.143 72.718 37.030 1.00 45.00 C
+ATOM 10006 CD1 PHE K 32 13.549 72.889 38.341 1.00 45.00 C
+ATOM 10007 CD2 PHE K 32 12.930 73.840 36.245 1.00 45.00 C
+ATOM 10008 CE1 PHE K 32 13.756 74.169 38.843 1.00 45.00 C
+ATOM 10009 CE2 PHE K 32 13.129 75.103 36.733 1.00 45.00 C
+ATOM 10010 CZ PHE K 32 13.546 75.274 38.035 1.00 45.00 C
+ATOM 10011 H PHE K 32 14.650 69.959 37.780 1.00 0.00 H
+ATOM 10012 HA PHE K 32 13.755 70.039 35.008 1.00 0.00 H
+ATOM 10013 1HB PHE K 32 12.149 71.505 35.672 1.00 0.00 H
+ATOM 10014 2HB PHE K 32 12.446 70.739 37.210 1.00 0.00 H
+ATOM 10015 HD1 PHE K 32 13.710 72.016 38.974 1.00 0.00 H
+ATOM 10016 HD2 PHE K 32 12.595 73.703 35.220 1.00 0.00 H
+ATOM 10017 HE1 PHE K 32 14.082 74.305 39.874 1.00 0.00 H
+ATOM 10018 HE2 PHE K 32 12.957 75.967 36.093 1.00 0.00 H
+ATOM 10019 HZ PHE K 32 13.706 76.276 38.429 1.00 0.00 H
+ATOM 10020 N HIS K 33 14.850 72.163 34.018 1.00 72.88 N
+ATOM 10021 CA HIS K 33 15.657 73.300 33.556 1.00 70.45 C
+ATOM 10022 C HIS K 33 14.761 74.388 32.979 1.00 68.10 C
+ATOM 10023 O HIS K 33 15.174 75.536 32.853 1.00 67.54 O
+ATOM 10024 CB HIS K 33 16.688 72.873 32.509 1.00 74.84 C
+ATOM 10025 CG HIS K 33 16.141 72.421 31.178 1.00 71.41 C
+ATOM 10026 ND1 HIS K 33 15.805 73.323 30.189 1.00 74.77 N
+ATOM 10027 CD2 HIS K 33 15.870 71.196 30.673 1.00 68.11 C
+ATOM 10028 CE1 HIS K 33 15.356 72.672 29.137 1.00 72.63 C
+ATOM 10029 NE2 HIS K 33 15.386 71.386 29.401 1.00 74.67 N
+ATOM 10030 H HIS K 33 14.174 71.719 33.432 1.00 0.00 H
+ATOM 10031 HA HIS K 33 16.192 73.740 34.391 1.00 0.00 H
+ATOM 10032 1HB HIS K 33 17.352 73.716 32.318 1.00 0.00 H
+ATOM 10033 2HB HIS K 33 17.287 72.093 32.921 1.00 0.00 H
+ATOM 10034 HD2 HIS K 33 16.007 70.244 31.175 1.00 0.00 H
+ATOM 10035 HE1 HIS K 33 15.022 73.127 28.203 1.00 0.00 H
+ATOM 10036 HE2 HIS K 33 15.094 70.669 28.751 1.00 0.00 H
+ATOM 10037 N HIS K 34 13.514 74.025 32.672 1.00 64.91 N
+ATOM 10038 CA HIS K 34 12.597 75.000 32.087 1.00 66.19 C
+ATOM 10039 C HIS K 34 11.132 74.686 32.325 1.00 68.79 C
+ATOM 10040 O HIS K 34 10.693 73.539 32.216 1.00 68.51 O
+ATOM 10041 CB HIS K 34 12.841 75.147 30.582 1.00 70.91 C
+ATOM 10042 CG HIS K 34 11.970 76.168 29.906 1.00 69.71 C
+ATOM 10043 ND1 HIS K 34 12.130 77.530 30.080 1.00 68.41 N
+ATOM 10044 CD2 HIS K 34 10.939 76.016 29.045 1.00 65.44 C
+ATOM 10045 CE1 HIS K 34 11.219 78.168 29.350 1.00 68.50 C
+ATOM 10046 NE2 HIS K 34 10.492 77.268 28.713 1.00 70.10 N
+ATOM 10047 H HIS K 34 13.241 73.054 32.793 1.00 0.00 H
+ATOM 10048 HA HIS K 34 12.783 75.973 32.541 1.00 0.00 H
+ATOM 10049 1HB HIS K 34 13.882 75.431 30.412 1.00 0.00 H
+ATOM 10050 2HB HIS K 34 12.680 74.189 30.095 1.00 0.00 H
+ATOM 10051 HD2 HIS K 34 10.539 75.071 28.678 1.00 0.00 H
+ATOM 10052 HE1 HIS K 34 11.093 79.247 29.282 1.00 0.00 H
+ATOM 10053 HE2 HIS K 34 9.712 77.459 28.069 1.00 0.00 H
+ATOM 10054 N SER K 35 10.365 75.730 32.624 1.00 71.63 N
+ATOM 10055 CA SER K 35 8.923 75.625 32.806 1.00 73.34 C
+ATOM 10056 C SER K 35 8.195 76.445 31.742 1.00 74.33 C
+ATOM 10057 O SER K 35 8.345 77.668 31.689 1.00 76.13 O
+ATOM 10058 CB SER K 35 8.543 76.119 34.186 1.00 80.70 C
+ATOM 10059 OG SER K 35 9.116 75.318 35.181 1.00 89.74 O
+ATOM 10060 H SER K 35 10.800 76.642 32.703 1.00 0.00 H
+ATOM 10061 HA SER K 35 8.620 74.581 32.703 1.00 0.00 H
+ATOM 10062 1HB SER K 35 8.877 77.148 34.304 1.00 0.00 H
+ATOM 10063 2HB SER K 35 7.460 76.113 34.290 1.00 0.00 H
+ATOM 10064 HG SER K 35 8.834 74.420 34.984 1.00 0.00 H
+ATOM 10065 N GLU K 36 7.420 75.770 30.894 1.00 74.87 N
+ATOM 10066 CA GLU K 36 6.699 76.419 29.806 1.00 75.61 C
+ATOM 10067 C GLU K 36 5.203 76.412 30.109 1.00 77.36 C
+ATOM 10068 O GLU K 36 4.584 75.351 30.235 1.00 77.57 O
+ATOM 10069 CB GLU K 36 6.988 75.708 28.477 1.00 67.50 C
+ATOM 10070 CG GLU K 36 6.403 76.372 27.226 1.00 67.53 C
+ATOM 10071 CD GLU K 36 7.081 77.675 26.867 1.00 67.31 C
+ATOM 10072 OE1 GLU K 36 8.286 77.759 26.973 1.00 65.93 O
+ATOM 10073 OE2 GLU K 36 6.399 78.586 26.451 1.00 55.58 O
+ATOM 10074 H GLU K 36 7.336 74.762 30.994 1.00 0.00 H
+ATOM 10075 HA GLU K 36 7.029 77.458 29.737 1.00 0.00 H
+ATOM 10076 1HB GLU K 36 8.058 75.615 28.340 1.00 0.00 H
+ATOM 10077 2HB GLU K 36 6.580 74.695 28.521 1.00 0.00 H
+ATOM 10078 1HG GLU K 36 6.499 75.696 26.382 1.00 0.00 H
+ATOM 10079 2HG GLU K 36 5.343 76.561 27.393 1.00 0.00 H
+ATOM 10080 N LYS K 37 4.623 77.586 30.296 1.00 78.20 N
+ATOM 10081 CA LYS K 37 3.224 77.639 30.687 1.00 78.96 C
+ATOM 10082 C LYS K 37 2.248 77.658 29.515 1.00 79.00 C
+ATOM 10083 O LYS K 37 2.468 78.331 28.497 1.00 77.49 O
+ATOM 10084 CB LYS K 37 2.994 78.851 31.593 1.00 78.48 C
+ATOM 10085 CG LYS K 37 3.711 78.734 32.956 1.00 45.00 C
+ATOM 10086 CD LYS K 37 3.464 79.948 33.865 1.00 45.00 C
+ATOM 10087 CE LYS K 37 4.164 79.755 35.225 1.00 45.00 C
+ATOM 10088 NZ LYS K 37 3.978 80.919 36.130 1.00 45.00 N
+ATOM 10089 H LYS K 37 5.156 78.439 30.179 1.00 0.00 H
+ATOM 10090 HA LYS K 37 3.010 76.744 31.272 1.00 0.00 H
+ATOM 10091 1HB LYS K 37 3.374 79.751 31.096 1.00 0.00 H
+ATOM 10092 2HB LYS K 37 1.921 78.996 31.757 1.00 0.00 H
+ATOM 10093 1HG LYS K 37 3.365 77.828 33.467 1.00 0.00 H
+ATOM 10094 2HG LYS K 37 4.784 78.637 32.787 1.00 0.00 H
+ATOM 10095 1HD LYS K 37 3.851 80.852 33.380 1.00 0.00 H
+ATOM 10096 2HD LYS K 37 2.396 80.076 34.031 1.00 0.00 H
+ATOM 10097 1HE LYS K 37 3.754 78.870 35.707 1.00 0.00 H
+ATOM 10098 2HE LYS K 37 5.231 79.603 35.056 1.00 0.00 H
+ATOM 10099 1HZ LYS K 37 4.450 80.743 37.008 1.00 0.00 H
+ATOM 10100 2HZ LYS K 37 4.366 81.744 35.701 1.00 0.00 H
+ATOM 10101 3HZ LYS K 37 2.994 81.056 36.298 1.00 0.00 H
+ATOM 10102 N LEU K 38 1.144 76.935 29.703 1.00 79.03 N
+ATOM 10103 CA LEU K 38 0.011 76.924 28.787 1.00 81.55 C
+ATOM 10104 C LEU K 38 -1.287 77.243 29.526 1.00 82.78 C
+ATOM 10105 O LEU K 38 -1.553 76.712 30.607 1.00 83.45 O
+ATOM 10106 CB LEU K 38 -0.156 75.551 28.112 1.00 81.01 C
+ATOM 10107 CG LEU K 38 0.947 75.052 27.197 1.00 81.46 C
+ATOM 10108 CD1 LEU K 38 0.635 73.598 26.791 1.00 83.57 C
+ATOM 10109 CD2 LEU K 38 1.007 75.939 25.996 1.00 81.49 C
+ATOM 10110 H LEU K 38 1.084 76.385 30.552 1.00 0.00 H
+ATOM 10111 HA LEU K 38 0.164 77.692 28.031 1.00 0.00 H
+ATOM 10112 1HB LEU K 38 -0.277 74.812 28.882 1.00 0.00 H
+ATOM 10113 2HB LEU K 38 -1.068 75.590 27.511 1.00 0.00 H
+ATOM 10114 HG LEU K 38 1.906 75.067 27.722 1.00 0.00 H
+ATOM 10115 1HD1 LEU K 38 1.409 73.219 26.133 1.00 0.00 H
+ATOM 10116 2HD1 LEU K 38 0.591 72.978 27.687 1.00 0.00 H
+ATOM 10117 3HD1 LEU K 38 -0.326 73.553 26.272 1.00 0.00 H
+ATOM 10118 1HD2 LEU K 38 1.779 75.602 25.334 1.00 0.00 H
+ATOM 10119 2HD2 LEU K 38 0.042 75.911 25.484 1.00 0.00 H
+ATOM 10120 3HD2 LEU K 38 1.222 76.948 26.313 1.00 0.00 H
+ATOM 10121 N ASP K 39 -2.114 78.077 28.930 1.00 81.69 N
+ATOM 10122 CA ASP K 39 -3.410 78.364 29.509 1.00 83.05 C
+ATOM 10123 C ASP K 39 -4.462 77.685 28.639 1.00 82.89 C
+ATOM 10124 O ASP K 39 -4.103 77.117 27.609 1.00 82.27 O
+ATOM 10125 CB ASP K 39 -3.557 79.876 29.716 1.00 82.64 C
+ATOM 10126 CG ASP K 39 -2.565 80.400 30.850 1.00 83.93 C
+ATOM 10127 OD1 ASP K 39 -2.553 79.808 31.956 1.00 84.88 O
+ATOM 10128 OD2 ASP K 39 -1.784 81.325 30.577 1.00 75.49 O
+ATOM 10129 H ASP K 39 -1.860 78.511 28.042 1.00 0.00 H
+ATOM 10130 HA ASP K 39 -3.462 77.884 30.480 1.00 0.00 H
+ATOM 10131 1HB ASP K 39 -3.379 80.423 28.789 1.00 0.00 H
+ATOM 10132 2HB ASP K 39 -4.555 80.088 30.026 1.00 0.00 H
+ATOM 10133 N LYS K 40 -5.718 77.627 29.074 1.00 82.64 N
+ATOM 10134 CA LYS K 40 -6.691 76.800 28.360 1.00 81.19 C
+ATOM 10135 C LYS K 40 -6.752 77.039 26.859 1.00 80.06 C
+ATOM 10136 O LYS K 40 -6.926 78.171 26.400 1.00 79.57 O
+ATOM 10137 CB LYS K 40 -8.077 77.014 28.949 1.00 88.33 C
+ATOM 10138 CG LYS K 40 -9.146 76.172 28.337 1.00 92.76 C
+ATOM 10139 CD LYS K 40 -10.426 76.354 29.086 1.00 96.40 C
+ATOM 10140 CE LYS K 40 -11.468 75.378 28.618 1.00 98.44 C
+ATOM 10141 NZ LYS K 40 -11.970 75.707 27.253 1.00 95.59 N
+ATOM 10142 H LYS K 40 -6.011 78.133 29.914 1.00 0.00 H
+ATOM 10143 HA LYS K 40 -6.420 75.758 28.518 1.00 0.00 H
+ATOM 10144 1HB LYS K 40 -8.052 76.801 30.008 1.00 0.00 H
+ATOM 10145 2HB LYS K 40 -8.356 78.060 28.839 1.00 0.00 H
+ATOM 10146 1HG LYS K 40 -9.296 76.468 27.304 1.00 0.00 H
+ATOM 10147 2HG LYS K 40 -8.855 75.121 28.354 1.00 0.00 H
+ATOM 10148 1HD LYS K 40 -10.240 76.206 30.152 1.00 0.00 H
+ATOM 10149 2HD LYS K 40 -10.793 77.370 28.920 1.00 0.00 H
+ATOM 10150 1HE LYS K 40 -11.018 74.383 28.606 1.00 0.00 H
+ATOM 10151 2HE LYS K 40 -12.297 75.383 29.313 1.00 0.00 H
+ATOM 10152 1HZ LYS K 40 -12.657 75.026 26.972 1.00 0.00 H
+ATOM 10153 2HZ LYS K 40 -12.391 76.622 27.251 1.00 0.00 H
+ATOM 10154 3HZ LYS K 40 -11.194 75.695 26.605 1.00 0.00 H
+ATOM 10155 N GLY K 41 -6.667 75.942 26.096 1.00 79.66 N
+ATOM 10156 CA GLY K 41 -6.764 75.959 24.641 1.00 78.34 C
+ATOM 10157 C GLY K 41 -5.435 76.163 23.904 1.00 76.89 C
+ATOM 10158 O GLY K 41 -5.363 76.050 22.678 1.00 75.87 O
+ATOM 10159 H GLY K 41 -6.504 75.042 26.542 1.00 0.00 H
+ATOM 10160 1HA GLY K 41 -7.216 75.025 24.315 1.00 0.00 H
+ATOM 10161 2HA GLY K 41 -7.449 76.754 24.358 1.00 0.00 H
+ATOM 10162 N GLU K 42 -4.374 76.455 24.643 1.00 76.74 N
+ATOM 10163 CA GLU K 42 -3.079 76.742 24.028 1.00 76.91 C
+ATOM 10164 C GLU K 42 -2.269 75.474 23.731 1.00 77.06 C
+ATOM 10165 O GLU K 42 -2.281 74.530 24.527 1.00 77.71 O
+ATOM 10166 CB GLU K 42 -2.360 77.694 24.955 1.00 68.67 C
+ATOM 10167 CG GLU K 42 -3.165 78.986 25.116 1.00 79.24 C
+ATOM 10168 CD GLU K 42 -2.571 79.921 26.039 1.00 76.34 C
+ATOM 10169 OE1 GLU K 42 -1.590 79.554 26.656 1.00 80.91 O
+ATOM 10170 OE2 GLU K 42 -3.035 81.028 26.137 1.00 74.71 O
+ATOM 10171 H GLU K 42 -4.471 76.539 25.656 1.00 0.00 H
+ATOM 10172 HA GLU K 42 -3.254 77.261 23.085 1.00 0.00 H
+ATOM 10173 1HB GLU K 42 -2.231 77.231 25.929 1.00 0.00 H
+ATOM 10174 2HB GLU K 42 -1.378 77.925 24.572 1.00 0.00 H
+ATOM 10175 1HG GLU K 42 -3.273 79.451 24.155 1.00 0.00 H
+ATOM 10176 2HG GLU K 42 -4.168 78.747 25.463 1.00 0.00 H
+ATOM 10177 N VAL K 43 -1.557 75.454 22.584 1.00 76.63 N
+ATOM 10178 CA VAL K 43 -0.804 74.258 22.176 1.00 75.80 C
+ATOM 10179 C VAL K 43 0.714 74.429 22.096 1.00 74.14 C
+ATOM 10180 O VAL K 43 1.231 75.369 21.483 1.00 73.72 O
+ATOM 10181 CB VAL K 43 -1.302 73.753 20.792 1.00 74.16 C
+ATOM 10182 CG1 VAL K 43 -0.473 72.541 20.315 1.00 75.36 C
+ATOM 10183 CG2 VAL K 43 -2.737 73.346 20.898 1.00 72.75 C
+ATOM 10184 H VAL K 43 -1.547 76.261 21.961 1.00 0.00 H
+ATOM 10185 HA VAL K 43 -1.020 73.481 22.901 1.00 0.00 H
+ATOM 10186 HB VAL K 43 -1.195 74.554 20.058 1.00 0.00 H
+ATOM 10187 1HG1 VAL K 43 -0.838 72.203 19.344 1.00 0.00 H
+ATOM 10188 2HG1 VAL K 43 0.571 72.823 20.223 1.00 0.00 H
+ATOM 10189 3HG1 VAL K 43 -0.568 71.728 21.040 1.00 0.00 H
+ATOM 10190 1HG2 VAL K 43 -3.090 72.990 19.938 1.00 0.00 H
+ATOM 10191 2HG2 VAL K 43 -2.806 72.567 21.612 1.00 0.00 H
+ATOM 10192 3HG2 VAL K 43 -3.340 74.194 21.223 1.00 0.00 H
+ATOM 10193 N LEU K 44 1.426 73.474 22.692 1.00 71.93 N
+ATOM 10194 CA LEU K 44 2.882 73.404 22.629 1.00 69.93 C
+ATOM 10195 C LEU K 44 3.328 72.128 21.930 1.00 68.25 C
+ATOM 10196 O LEU K 44 2.983 71.023 22.357 1.00 68.19 O
+ATOM 10197 CB LEU K 44 3.486 73.403 24.032 1.00 65.19 C
+ATOM 10198 CG LEU K 44 5.002 73.252 24.136 1.00 67.11 C
+ATOM 10199 CD1 LEU K 44 5.703 74.493 23.520 1.00 60.95 C
+ATOM 10200 CD2 LEU K 44 5.346 73.055 25.609 1.00 73.53 C
+ATOM 10201 H LEU K 44 0.920 72.753 23.202 1.00 0.00 H
+ATOM 10202 HA LEU K 44 3.258 74.260 22.067 1.00 0.00 H
+ATOM 10203 1HB LEU K 44 3.249 74.327 24.502 1.00 0.00 H
+ATOM 10204 2HB LEU K 44 3.037 72.590 24.603 1.00 0.00 H
+ATOM 10205 HG LEU K 44 5.328 72.374 23.570 1.00 0.00 H
+ATOM 10206 1HD1 LEU K 44 6.789 74.378 23.598 1.00 0.00 H
+ATOM 10207 2HD1 LEU K 44 5.421 74.585 22.464 1.00 0.00 H
+ATOM 10208 3HD1 LEU K 44 5.395 75.394 24.058 1.00 0.00 H
+ATOM 10209 1HD2 LEU K 44 6.420 72.929 25.729 1.00 0.00 H
+ATOM 10210 2HD2 LEU K 44 5.019 73.920 26.184 1.00 0.00 H
+ATOM 10211 3HD2 LEU K 44 4.835 72.169 25.975 1.00 0.00 H
+ATOM 10212 N ILE K 45 4.094 72.260 20.862 1.00 66.92 N
+ATOM 10213 CA ILE K 45 4.608 71.096 20.169 1.00 63.47 C
+ATOM 10214 C ILE K 45 6.102 71.071 20.440 1.00 62.13 C
+ATOM 10215 O ILE K 45 6.804 72.018 20.086 1.00 58.36 O
+ATOM 10216 CB ILE K 45 4.356 71.191 18.664 1.00 59.92 C
+ATOM 10217 CG1 ILE K 45 2.855 71.364 18.403 1.00 60.60 C
+ATOM 10218 CG2 ILE K 45 4.867 69.928 18.026 1.00 71.18 C
+ATOM 10219 CD1 ILE K 45 2.492 71.725 16.990 1.00 68.90 C
+ATOM 10220 H ILE K 45 4.334 73.182 20.508 1.00 0.00 H
+ATOM 10221 HA ILE K 45 4.158 70.190 20.570 1.00 0.00 H
+ATOM 10222 HB ILE K 45 4.870 72.047 18.255 1.00 0.00 H
+ATOM 10223 1HG1 ILE K 45 2.357 70.453 18.656 1.00 0.00 H
+ATOM 10224 2HG1 ILE K 45 2.488 72.154 19.051 1.00 0.00 H
+ATOM 10225 1HG2 ILE K 45 4.698 69.962 16.957 1.00 0.00 H
+ATOM 10226 2HG2 ILE K 45 5.928 69.832 18.234 1.00 0.00 H
+ATOM 10227 3HG2 ILE K 45 4.349 69.083 18.451 1.00 0.00 H
+ATOM 10228 1HD1 ILE K 45 1.414 71.836 16.922 1.00 0.00 H
+ATOM 10229 2HD1 ILE K 45 2.973 72.667 16.714 1.00 0.00 H
+ATOM 10230 3HD1 ILE K 45 2.820 70.938 16.324 1.00 0.00 H
+ATOM 10231 N ALA K 46 6.620 70.027 21.074 1.00 62.27 N
+ATOM 10232 CA ALA K 46 8.027 70.138 21.445 1.00 63.65 C
+ATOM 10233 C ALA K 46 8.812 68.856 21.339 1.00 64.34 C
+ATOM 10234 O ALA K 46 8.340 67.773 21.699 1.00 63.59 O
+ATOM 10235 CB ALA K 46 8.118 70.655 22.874 1.00 51.66 C
+ATOM 10236 H ALA K 46 6.039 69.224 21.318 1.00 0.00 H
+ATOM 10237 HA ALA K 46 8.500 70.848 20.772 1.00 0.00 H
+ATOM 10238 1HB ALA K 46 9.167 70.787 23.148 1.00 0.00 H
+ATOM 10239 2HB ALA K 46 7.600 71.608 22.947 1.00 0.00 H
+ATOM 10240 3HB ALA K 46 7.653 69.938 23.549 1.00 0.00 H
+ATOM 10241 N GLN K 47 10.045 69.006 20.857 1.00 62.80 N
+ATOM 10242 CA GLN K 47 10.967 67.900 20.692 1.00 62.85 C
+ATOM 10243 C GLN K 47 11.772 67.618 21.933 1.00 63.63 C
+ATOM 10244 O GLN K 47 11.987 68.495 22.774 1.00 63.04 O
+ATOM 10245 CB GLN K 47 11.964 68.158 19.550 1.00 62.80 C
+ATOM 10246 CG GLN K 47 11.379 68.243 18.157 1.00 54.93 C
+ATOM 10247 CD GLN K 47 12.453 68.453 17.106 1.00 58.15 C
+ATOM 10248 OE1 GLN K 47 13.325 69.330 17.235 1.00 57.45 O
+ATOM 10249 NE2 GLN K 47 12.403 67.643 16.052 1.00 62.82 N
+ATOM 10250 H GLN K 47 10.372 69.931 20.577 1.00 0.00 H
+ATOM 10251 HA GLN K 47 10.399 67.014 20.457 1.00 0.00 H
+ATOM 10252 1HB GLN K 47 12.504 69.083 19.748 1.00 0.00 H
+ATOM 10253 2HB GLN K 47 12.701 67.352 19.539 1.00 0.00 H
+ATOM 10254 1HG GLN K 47 10.905 67.300 17.929 1.00 0.00 H
+ATOM 10255 2HG GLN K 47 10.659 69.060 18.110 1.00 0.00 H
+ATOM 10256 1HE2 GLN K 47 13.078 67.720 15.323 1.00 0.00 H
+ATOM 10257 2HE2 GLN K 47 11.677 66.948 15.989 1.00 0.00 H
+ATOM 10258 N PHE K 48 12.284 66.405 21.998 1.00 63.02 N
+ATOM 10259 CA PHE K 48 13.265 66.063 23.010 1.00 63.23 C
+ATOM 10260 C PHE K 48 14.580 66.569 22.431 1.00 61.18 C
+ATOM 10261 O PHE K 48 14.748 66.569 21.213 1.00 60.89 O
+ATOM 10262 CB PHE K 48 13.276 64.574 23.264 1.00 66.08 C
+ATOM 10263 CG PHE K 48 12.005 64.091 23.916 1.00 72.93 C
+ATOM 10264 CD1 PHE K 48 11.829 64.120 25.298 1.00 69.02 C
+ATOM 10265 CD2 PHE K 48 10.964 63.629 23.122 1.00 69.79 C
+ATOM 10266 CE1 PHE K 48 10.633 63.691 25.847 1.00 65.58 C
+ATOM 10267 CE2 PHE K 48 9.783 63.211 23.674 1.00 69.79 C
+ATOM 10268 CZ PHE K 48 9.620 63.248 25.031 1.00 59.32 C
+ATOM 10269 H PHE K 48 11.996 65.721 21.297 1.00 0.00 H
+ATOM 10270 HA PHE K 48 13.053 66.593 23.939 1.00 0.00 H
+ATOM 10271 1HB PHE K 48 13.420 64.041 22.329 1.00 0.00 H
+ATOM 10272 2HB PHE K 48 14.113 64.339 23.922 1.00 0.00 H
+ATOM 10273 HD1 PHE K 48 12.638 64.486 25.939 1.00 0.00 H
+ATOM 10274 HD2 PHE K 48 11.095 63.614 22.041 1.00 0.00 H
+ATOM 10275 HE1 PHE K 48 10.481 63.713 26.912 1.00 0.00 H
+ATOM 10276 HE2 PHE K 48 8.973 62.860 23.036 1.00 0.00 H
+ATOM 10277 HZ PHE K 48 8.688 62.941 25.456 1.00 0.00 H
+ATOM 10278 N THR K 49 15.465 67.090 23.273 1.00 57.53 N
+ATOM 10279 CA THR K 49 16.667 67.745 22.749 1.00 53.38 C
+ATOM 10280 C THR K 49 17.949 67.268 23.391 1.00 54.10 C
+ATOM 10281 O THR K 49 17.972 66.355 24.208 1.00 54.01 O
+ATOM 10282 CB THR K 49 16.629 69.272 22.948 1.00 57.59 C
+ATOM 10283 OG1 THR K 49 16.803 69.581 24.337 1.00 51.40 O
+ATOM 10284 CG2 THR K 49 15.303 69.849 22.471 1.00 38.20 C
+ATOM 10285 H THR K 49 15.310 67.010 24.273 1.00 0.00 H
+ATOM 10286 HA THR K 49 16.738 67.534 21.683 1.00 0.00 H
+ATOM 10287 HB THR K 49 17.427 69.737 22.378 1.00 0.00 H
+ATOM 10288 HG1 THR K 49 17.466 68.990 24.712 1.00 0.00 H
+ATOM 10289 1HG2 THR K 49 15.311 70.926 22.627 1.00 0.00 H
+ATOM 10290 2HG2 THR K 49 15.165 69.632 21.412 1.00 0.00 H
+ATOM 10291 3HG2 THR K 49 14.482 69.411 23.038 1.00 0.00 H
+ATOM 10292 N GLU K 50 19.024 67.954 23.028 1.00 55.70 N
+ATOM 10293 CA GLU K 50 20.356 67.733 23.570 1.00 58.37 C
+ATOM 10294 C GLU K 50 20.376 68.049 25.073 1.00 61.15 C
+ATOM 10295 O GLU K 50 21.256 67.573 25.794 1.00 60.14 O
+ATOM 10296 CB GLU K 50 21.365 68.610 22.821 1.00 52.29 C
+ATOM 10297 CG GLU K 50 21.579 68.213 21.352 1.00 53.74 C
+ATOM 10298 CD GLU K 50 22.529 69.126 20.613 1.00 53.75 C
+ATOM 10299 OE1 GLU K 50 22.814 68.864 19.480 1.00 48.94 O
+ATOM 10300 OE2 GLU K 50 22.963 70.087 21.181 1.00 54.28 O
+ATOM 10301 H GLU K 50 18.924 68.682 22.335 1.00 0.00 H
+ATOM 10302 HA GLU K 50 20.617 66.684 23.433 1.00 0.00 H
+ATOM 10303 1HB GLU K 50 21.025 69.650 22.838 1.00 0.00 H
+ATOM 10304 2HB GLU K 50 22.329 68.572 23.327 1.00 0.00 H
+ATOM 10305 1HG GLU K 50 21.984 67.204 21.330 1.00 0.00 H
+ATOM 10306 2HG GLU K 50 20.619 68.206 20.841 1.00 0.00 H
+ATOM 10307 N HIS K 51 19.426 68.866 25.537 1.00 61.89 N
+ATOM 10308 CA HIS K 51 19.353 69.232 26.941 1.00 66.41 C
+ATOM 10309 C HIS K 51 18.103 68.679 27.643 1.00 68.94 C
+ATOM 10310 O HIS K 51 18.126 68.516 28.857 1.00 68.97 O
+ATOM 10311 CB HIS K 51 19.424 70.758 27.099 1.00 71.02 C
+ATOM 10312 CG HIS K 51 20.724 71.336 26.612 1.00 72.98 C
+ATOM 10313 ND1 HIS K 51 20.965 71.609 25.286 1.00 76.16 N
+ATOM 10314 CD2 HIS K 51 21.857 71.677 27.275 1.00 77.14 C
+ATOM 10315 CE1 HIS K 51 22.190 72.088 25.149 1.00 74.97 C
+ATOM 10316 NE2 HIS K 51 22.752 72.141 26.341 1.00 76.08 N
+ATOM 10317 H HIS K 51 18.707 69.221 24.915 1.00 0.00 H
+ATOM 10318 HA HIS K 51 20.221 68.815 27.459 1.00 0.00 H
+ATOM 10319 1HB HIS K 51 18.608 71.217 26.537 1.00 0.00 H
+ATOM 10320 2HB HIS K 51 19.293 71.032 28.148 1.00 0.00 H
+ATOM 10321 HD2 HIS K 51 22.030 71.596 28.349 1.00 0.00 H
+ATOM 10322 HE1 HIS K 51 22.652 72.386 24.210 1.00 0.00 H
+ATOM 10323 HE2 HIS K 51 23.689 72.465 26.540 1.00 0.00 H
+ATOM 10324 N THR K 52 17.034 68.361 26.887 1.00 69.75 N
+ATOM 10325 CA THR K 52 15.796 67.832 27.497 1.00 69.68 C
+ATOM 10326 C THR K 52 15.612 66.337 27.213 1.00 70.20 C
+ATOM 10327 O THR K 52 15.435 65.938 26.061 1.00 71.48 O
+ATOM 10328 CB THR K 52 14.529 68.538 26.953 1.00 65.46 C
+ATOM 10329 OG1 THR K 52 14.573 69.943 27.226 1.00 65.52 O
+ATOM 10330 CG2 THR K 52 13.263 67.933 27.599 1.00 69.69 C
+ATOM 10331 H THR K 52 17.058 68.527 25.892 1.00 0.00 H
+ATOM 10332 HA THR K 52 15.851 67.974 28.576 1.00 0.00 H
+ATOM 10333 HB THR K 52 14.483 68.397 25.879 1.00 0.00 H
+ATOM 10334 HG1 THR K 52 14.011 70.399 26.586 1.00 0.00 H
+ATOM 10335 1HG2 THR K 52 12.372 68.428 27.205 1.00 0.00 H
+ATOM 10336 2HG2 THR K 52 13.205 66.866 27.379 1.00 0.00 H
+ATOM 10337 3HG2 THR K 52 13.309 68.074 28.678 1.00 0.00 H
+ATOM 10338 N SER K 53 15.602 65.522 28.278 1.00 68.10 N
+ATOM 10339 CA SER K 53 15.435 64.072 28.122 1.00 65.00 C
+ATOM 10340 C SER K 53 14.027 63.637 28.487 1.00 64.54 C
+ATOM 10341 O SER K 53 13.588 62.532 28.141 1.00 63.74 O
+ATOM 10342 CB SER K 53 16.424 63.316 28.977 1.00 67.80 C
+ATOM 10343 OG SER K 53 16.203 63.538 30.338 1.00 45.11 O
+ATOM 10344 H SER K 53 15.723 65.922 29.204 1.00 0.00 H
+ATOM 10345 HA SER K 53 15.610 63.813 27.080 1.00 0.00 H
+ATOM 10346 1HB SER K 53 16.345 62.253 28.760 1.00 0.00 H
+ATOM 10347 2HB SER K 53 17.417 63.622 28.717 1.00 0.00 H
+ATOM 10348 HG SER K 53 16.082 64.490 30.441 1.00 0.00 H
+ATOM 10349 N ALA K 54 13.312 64.505 29.192 1.00 66.03 N
+ATOM 10350 CA ALA K 54 11.953 64.157 29.582 1.00 67.02 C
+ATOM 10351 C ALA K 54 11.079 65.394 29.709 1.00 67.66 C
+ATOM 10352 O ALA K 54 11.546 66.487 30.043 1.00 66.00 O
+ATOM 10353 CB ALA K 54 11.957 63.362 30.877 1.00 58.48 C
+ATOM 10354 H ALA K 54 13.735 65.384 29.481 1.00 0.00 H
+ATOM 10355 HA ALA K 54 11.529 63.536 28.800 1.00 0.00 H
+ATOM 10356 1HB ALA K 54 10.936 63.084 31.123 1.00 0.00 H
+ATOM 10357 2HB ALA K 54 12.561 62.464 30.743 1.00 0.00 H
+ATOM 10358 3HB ALA K 54 12.366 63.936 31.674 1.00 0.00 H
+ATOM 10359 N ILE K 55 9.789 65.185 29.462 1.00 69.38 N
+ATOM 10360 CA ILE K 55 8.778 66.223 29.574 1.00 70.47 C
+ATOM 10361 C ILE K 55 7.730 65.855 30.625 1.00 71.82 C
+ATOM 10362 O ILE K 55 7.100 64.801 30.567 1.00 71.26 O
+ATOM 10363 CB ILE K 55 8.111 66.466 28.199 1.00 58.82 C
+ATOM 10364 CG1 ILE K 55 9.189 66.947 27.163 1.00 64.27 C
+ATOM 10365 CG2 ILE K 55 6.993 67.482 28.336 1.00 63.12 C
+ATOM 10366 CD1 ILE K 55 8.703 66.992 25.718 1.00 62.43 C
+ATOM 10367 H ILE K 55 9.496 64.252 29.201 1.00 0.00 H
+ATOM 10368 HA ILE K 55 9.258 67.147 29.886 1.00 0.00 H
+ATOM 10369 HB ILE K 55 7.699 65.529 27.826 1.00 0.00 H
+ATOM 10370 1HG1 ILE K 55 9.524 67.945 27.448 1.00 0.00 H
+ATOM 10371 2HG1 ILE K 55 10.040 66.275 27.203 1.00 0.00 H
+ATOM 10372 1HG2 ILE K 55 6.528 67.644 27.367 1.00 0.00 H
+ATOM 10373 2HG2 ILE K 55 6.247 67.118 29.040 1.00 0.00 H
+ATOM 10374 3HG2 ILE K 55 7.413 68.418 28.702 1.00 0.00 H
+ATOM 10375 1HD1 ILE K 55 9.515 67.332 25.065 1.00 0.00 H
+ATOM 10376 2HD1 ILE K 55 8.387 65.995 25.408 1.00 0.00 H
+ATOM 10377 3HD1 ILE K 55 7.865 67.680 25.636 1.00 0.00 H
+ATOM 10378 N LYS K 56 7.551 66.735 31.592 1.00 72.53 N
+ATOM 10379 CA LYS K 56 6.607 66.533 32.683 1.00 72.51 C
+ATOM 10380 C LYS K 56 5.426 67.481 32.528 1.00 72.10 C
+ATOM 10381 O LYS K 56 5.622 68.679 32.334 1.00 72.88 O
+ATOM 10382 CB LYS K 56 7.341 66.755 33.999 1.00 74.37 C
+ATOM 10383 CG LYS K 56 6.572 66.605 35.290 1.00 77.58 C
+ATOM 10384 CD LYS K 56 7.511 67.029 36.434 1.00 73.01 C
+ATOM 10385 CE LYS K 56 6.896 66.921 37.812 1.00 74.87 C
+ATOM 10386 NZ LYS K 56 6.862 65.535 38.267 1.00 71.21 N
+ATOM 10387 H LYS K 56 8.117 67.582 31.584 1.00 0.00 H
+ATOM 10388 HA LYS K 56 6.229 65.511 32.649 1.00 0.00 H
+ATOM 10389 1HB LYS K 56 8.148 66.024 34.049 1.00 0.00 H
+ATOM 10390 2HB LYS K 56 7.805 67.710 33.989 1.00 0.00 H
+ATOM 10391 1HG LYS K 56 5.689 67.252 35.281 1.00 0.00 H
+ATOM 10392 2HG LYS K 56 6.250 65.568 35.431 1.00 0.00 H
+ATOM 10393 1HD LYS K 56 8.399 66.390 36.416 1.00 0.00 H
+ATOM 10394 2HD LYS K 56 7.828 68.059 36.274 1.00 0.00 H
+ATOM 10395 1HE LYS K 56 7.494 67.507 38.507 1.00 0.00 H
+ATOM 10396 2HE LYS K 56 5.871 67.313 37.802 1.00 0.00 H
+ATOM 10397 1HZ LYS K 56 6.472 65.481 39.205 1.00 0.00 H
+ATOM 10398 2HZ LYS K 56 6.306 64.978 37.638 1.00 0.00 H
+ATOM 10399 3HZ LYS K 56 7.825 65.181 38.283 1.00 0.00 H
+ATOM 10400 N VAL K 57 4.203 66.971 32.572 1.00 71.29 N
+ATOM 10401 CA VAL K 57 3.056 67.855 32.400 1.00 72.49 C
+ATOM 10402 C VAL K 57 2.171 67.879 33.641 1.00 72.87 C
+ATOM 10403 O VAL K 57 1.701 66.843 34.126 1.00 70.08 O
+ATOM 10404 CB VAL K 57 2.219 67.425 31.187 1.00 73.75 C
+ATOM 10405 CG1 VAL K 57 1.037 68.397 31.016 1.00 79.46 C
+ATOM 10406 CG2 VAL K 57 3.107 67.377 29.955 1.00 74.58 C
+ATOM 10407 H VAL K 57 4.073 65.974 32.711 1.00 0.00 H
+ATOM 10408 HA VAL K 57 3.416 68.869 32.223 1.00 0.00 H
+ATOM 10409 HB VAL K 57 1.799 66.438 31.367 1.00 0.00 H
+ATOM 10410 1HG1 VAL K 57 0.423 68.103 30.176 1.00 0.00 H
+ATOM 10411 2HG1 VAL K 57 0.423 68.392 31.922 1.00 0.00 H
+ATOM 10412 3HG1 VAL K 57 1.419 69.404 30.848 1.00 0.00 H
+ATOM 10413 1HG2 VAL K 57 2.522 67.068 29.094 1.00 0.00 H
+ATOM 10414 2HG2 VAL K 57 3.519 68.361 29.784 1.00 0.00 H
+ATOM 10415 3HG2 VAL K 57 3.916 66.665 30.112 1.00 0.00 H
+ATOM 10416 N ARG K 58 1.960 69.094 34.149 1.00 73.11 N
+ATOM 10417 CA ARG K 58 1.157 69.344 35.337 1.00 72.69 C
+ATOM 10418 C ARG K 58 -0.105 70.148 35.029 1.00 72.91 C
+ATOM 10419 O ARG K 58 -0.052 71.219 34.420 1.00 72.21 O
+ATOM 10420 CB ARG K 58 2.003 70.086 36.351 1.00 74.70 C
+ATOM 10421 CG ARG K 58 1.299 70.532 37.604 1.00 79.65 C
+ATOM 10422 CD ARG K 58 2.271 71.146 38.548 1.00 84.46 C
+ATOM 10423 NE ARG K 58 3.186 70.168 39.065 1.00 84.81 N
+ATOM 10424 CZ ARG K 58 4.330 70.437 39.695 1.00 82.14 C
+ATOM 10425 NH1 ARG K 58 4.723 71.683 39.894 1.00 81.13 N
+ATOM 10426 NH2 ARG K 58 5.043 69.415 40.111 1.00 72.27 N
+ATOM 10427 H ARG K 58 2.410 69.885 33.699 1.00 0.00 H
+ATOM 10428 HA ARG K 58 0.857 68.386 35.762 1.00 0.00 H
+ATOM 10429 1HB ARG K 58 2.826 69.433 36.663 1.00 0.00 H
+ATOM 10430 2HB ARG K 58 2.440 70.961 35.885 1.00 0.00 H
+ATOM 10431 1HG ARG K 58 0.553 71.285 37.343 1.00 0.00 H
+ATOM 10432 2HG ARG K 58 0.814 69.678 38.085 1.00 0.00 H
+ATOM 10433 1HD ARG K 58 2.849 71.912 38.029 1.00 0.00 H
+ATOM 10434 2HD ARG K 58 1.743 71.592 39.386 1.00 0.00 H
+ATOM 10435 HE ARG K 58 2.954 69.173 38.952 1.00 0.00 H
+ATOM 10436 1HH1 ARG K 58 4.156 72.451 39.567 1.00 0.00 H
+ATOM 10437 2HH1 ARG K 58 5.591 71.868 40.376 1.00 0.00 H
+ATOM 10438 1HH2 ARG K 58 4.669 68.478 39.933 1.00 0.00 H
+ATOM 10439 2HH2 ARG K 58 5.907 69.549 40.593 1.00 0.00 H
+ATOM 10440 N GLY K 59 -1.245 69.636 35.476 1.00 73.86 N
+ATOM 10441 CA GLY K 59 -2.535 70.269 35.212 1.00 73.78 C
+ATOM 10442 C GLY K 59 -3.227 69.503 34.101 1.00 74.31 C
+ATOM 10443 O GLY K 59 -2.613 68.635 33.482 1.00 72.03 O
+ATOM 10444 H GLY K 59 -1.234 68.758 35.982 1.00 0.00 H
+ATOM 10445 1HA GLY K 59 -3.151 70.242 36.112 1.00 0.00 H
+ATOM 10446 2HA GLY K 59 -2.403 71.314 34.930 1.00 0.00 H
+ATOM 10447 N LYS K 60 -4.502 69.788 33.877 1.00 75.28 N
+ATOM 10448 CA LYS K 60 -5.271 69.036 32.891 1.00 76.89 C
+ATOM 10449 C LYS K 60 -4.914 69.448 31.466 1.00 77.83 C
+ATOM 10450 O LYS K 60 -4.954 70.639 31.136 1.00 77.22 O
+ATOM 10451 CB LYS K 60 -6.766 69.204 33.178 1.00 69.81 C
+ATOM 10452 CG LYS K 60 -7.701 68.331 32.375 1.00 79.47 C
+ATOM 10453 CD LYS K 60 -9.132 68.551 32.833 1.00 81.41 C
+ATOM 10454 CE LYS K 60 -10.099 67.650 32.115 1.00 78.56 C
+ATOM 10455 NZ LYS K 60 -11.482 67.837 32.615 1.00 88.74 N
+ATOM 10456 H LYS K 60 -4.952 70.523 34.425 1.00 0.00 H
+ATOM 10457 HA LYS K 60 -5.020 67.993 32.990 1.00 0.00 H
+ATOM 10458 1HB LYS K 60 -6.948 69.003 34.232 1.00 0.00 H
+ATOM 10459 2HB LYS K 60 -7.055 70.231 32.995 1.00 0.00 H
+ATOM 10460 1HG LYS K 60 -7.619 68.552 31.329 1.00 0.00 H
+ATOM 10461 2HG LYS K 60 -7.438 67.278 32.527 1.00 0.00 H
+ATOM 10462 1HD LYS K 60 -9.201 68.360 33.905 1.00 0.00 H
+ATOM 10463 2HD LYS K 60 -9.417 69.592 32.645 1.00 0.00 H
+ATOM 10464 1HE LYS K 60 -10.078 67.874 31.055 1.00 0.00 H
+ATOM 10465 2HE LYS K 60 -9.801 66.610 32.267 1.00 0.00 H
+ATOM 10466 1HZ LYS K 60 -12.112 67.221 32.118 1.00 0.00 H
+ATOM 10467 2HZ LYS K 60 -11.511 67.625 33.602 1.00 0.00 H
+ATOM 10468 3HZ LYS K 60 -11.763 68.794 32.470 1.00 0.00 H
+ATOM 10469 N ALA K 61 -4.556 68.471 30.631 1.00 78.17 N
+ATOM 10470 CA ALA K 61 -4.147 68.764 29.256 1.00 78.29 C
+ATOM 10471 C ALA K 61 -4.321 67.572 28.322 1.00 77.67 C
+ATOM 10472 O ALA K 61 -4.127 66.414 28.707 1.00 78.05 O
+ATOM 10473 CB ALA K 61 -2.691 69.222 29.219 1.00 72.26 C
+ATOM 10474 H ALA K 61 -4.582 67.508 30.971 1.00 0.00 H
+ATOM 10475 HA ALA K 61 -4.776 69.572 28.891 1.00 0.00 H
+ATOM 10476 1HB ALA K 61 -2.409 69.477 28.200 1.00 0.00 H
+ATOM 10477 2HB ALA K 61 -2.571 70.092 29.857 1.00 0.00 H
+ATOM 10478 3HB ALA K 61 -2.049 68.421 29.573 1.00 0.00 H
+ATOM 10479 N TYR K 62 -4.650 67.853 27.071 1.00 75.65 N
+ATOM 10480 CA TYR K 62 -4.763 66.831 26.046 1.00 74.72 C
+ATOM 10481 C TYR K 62 -3.432 66.674 25.363 1.00 71.76 C
+ATOM 10482 O TYR K 62 -2.886 67.641 24.835 1.00 69.85 O
+ATOM 10483 CB TYR K 62 -5.861 67.167 25.049 1.00 76.88 C
+ATOM 10484 CG TYR K 62 -5.912 66.258 23.845 1.00 81.56 C
+ATOM 10485 CD1 TYR K 62 -6.303 64.934 23.967 1.00 82.81 C
+ATOM 10486 CD2 TYR K 62 -5.595 66.772 22.605 1.00 83.59 C
+ATOM 10487 CE1 TYR K 62 -6.376 64.134 22.843 1.00 84.06 C
+ATOM 10488 CE2 TYR K 62 -5.673 65.975 21.485 1.00 84.19 C
+ATOM 10489 CZ TYR K 62 -6.062 64.663 21.596 1.00 84.71 C
+ATOM 10490 OH TYR K 62 -6.153 63.873 20.466 1.00 84.74 O
+ATOM 10491 H TYR K 62 -4.774 68.832 26.814 1.00 0.00 H
+ATOM 10492 HA TYR K 62 -5.007 65.880 26.524 1.00 0.00 H
+ATOM 10493 1HB TYR K 62 -6.829 67.104 25.549 1.00 0.00 H
+ATOM 10494 2HB TYR K 62 -5.737 68.191 24.704 1.00 0.00 H
+ATOM 10495 HD1 TYR K 62 -6.555 64.525 24.942 1.00 0.00 H
+ATOM 10496 HD2 TYR K 62 -5.291 67.814 22.515 1.00 0.00 H
+ATOM 10497 HE1 TYR K 62 -6.687 63.098 22.938 1.00 0.00 H
+ATOM 10498 HE2 TYR K 62 -5.432 66.385 20.510 1.00 0.00 H
+ATOM 10499 HH TYR K 62 -5.980 64.408 19.687 1.00 0.00 H
+ATOM 10500 N ILE K 63 -2.886 65.471 25.391 1.00 68.17 N
+ATOM 10501 CA ILE K 63 -1.569 65.287 24.828 1.00 66.67 C
+ATOM 10502 C ILE K 63 -1.561 64.236 23.714 1.00 65.04 C
+ATOM 10503 O ILE K 63 -2.117 63.148 23.855 1.00 62.33 O
+ATOM 10504 CB ILE K 63 -0.602 64.849 25.936 1.00 70.94 C
+ATOM 10505 CG1 ILE K 63 -0.567 65.882 27.062 1.00 73.32 C
+ATOM 10506 CG2 ILE K 63 0.803 64.651 25.353 1.00 79.45 C
+ATOM 10507 CD1 ILE K 63 0.183 65.397 28.294 1.00 62.19 C
+ATOM 10508 H ILE K 63 -3.347 64.688 25.840 1.00 0.00 H
+ATOM 10509 HA ILE K 63 -1.238 66.220 24.426 1.00 0.00 H
+ATOM 10510 HB ILE K 63 -0.961 63.958 26.352 1.00 0.00 H
+ATOM 10511 1HG1 ILE K 63 -0.121 66.771 26.693 1.00 0.00 H
+ATOM 10512 2HG1 ILE K 63 -1.583 66.115 27.372 1.00 0.00 H
+ATOM 10513 1HG2 ILE K 63 1.470 64.323 26.136 1.00 0.00 H
+ATOM 10514 2HG2 ILE K 63 0.761 63.904 24.577 1.00 0.00 H
+ATOM 10515 3HG2 ILE K 63 1.169 65.583 24.930 1.00 0.00 H
+ATOM 10516 1HD1 ILE K 63 0.167 66.170 29.054 1.00 0.00 H
+ATOM 10517 2HD1 ILE K 63 -0.296 64.500 28.687 1.00 0.00 H
+ATOM 10518 3HD1 ILE K 63 1.215 65.168 28.028 1.00 0.00 H
+ATOM 10519 N GLN K 64 -0.937 64.571 22.582 1.00 64.99 N
+ATOM 10520 CA GLN K 64 -0.809 63.586 21.517 1.00 64.59 C
+ATOM 10521 C GLN K 64 0.631 63.096 21.493 1.00 63.72 C
+ATOM 10522 O GLN K 64 1.571 63.893 21.458 1.00 63.29 O
+ATOM 10523 CB GLN K 64 -1.201 64.141 20.137 1.00 65.44 C
+ATOM 10524 CG GLN K 64 -2.636 64.620 20.038 1.00 59.81 C
+ATOM 10525 CD GLN K 64 -3.025 65.132 18.659 1.00 56.23 C
+ATOM 10526 OE1 GLN K 64 -2.206 65.665 17.905 1.00 55.69 O
+ATOM 10527 NE2 GLN K 64 -4.311 64.954 18.340 1.00 49.99 N
+ATOM 10528 H GLN K 64 -0.520 65.490 22.499 1.00 0.00 H
+ATOM 10529 HA GLN K 64 -1.438 62.739 21.736 1.00 0.00 H
+ATOM 10530 1HB GLN K 64 -0.530 64.909 19.821 1.00 0.00 H
+ATOM 10531 2HB GLN K 64 -1.113 63.332 19.415 1.00 0.00 H
+ATOM 10532 1HG GLN K 64 -3.294 63.804 20.276 1.00 0.00 H
+ATOM 10533 2HG GLN K 64 -2.782 65.431 20.748 1.00 0.00 H
+ATOM 10534 1HE2 GLN K 64 -4.698 65.265 17.455 1.00 0.00 H
+ATOM 10535 2HE2 GLN K 64 -4.919 64.520 18.997 1.00 0.00 H
+ATOM 10536 N THR K 65 0.806 61.776 21.539 1.00 63.12 N
+ATOM 10537 CA THR K 65 2.150 61.216 21.490 1.00 60.48 C
+ATOM 10538 C THR K 65 2.161 60.060 20.511 1.00 59.79 C
+ATOM 10539 O THR K 65 1.114 59.550 20.102 1.00 59.41 O
+ATOM 10540 CB THR K 65 2.638 60.630 22.836 1.00 62.30 C
+ATOM 10541 OG1 THR K 65 2.006 59.363 23.046 1.00 59.79 O
+ATOM 10542 CG2 THR K 65 2.286 61.561 23.988 1.00 53.95 C
+ATOM 10543 H THR K 65 0.011 61.163 21.595 1.00 0.00 H
+ATOM 10544 HA THR K 65 2.857 61.972 21.141 1.00 0.00 H
+ATOM 10545 HB THR K 65 3.720 60.497 22.807 1.00 0.00 H
+ATOM 10546 HG1 THR K 65 2.233 58.791 22.313 1.00 0.00 H
+ATOM 10547 1HG2 THR K 65 2.631 61.138 24.925 1.00 0.00 H
+ATOM 10548 2HG2 THR K 65 2.764 62.530 23.831 1.00 0.00 H
+ATOM 10549 3HG2 THR K 65 1.204 61.683 24.030 1.00 0.00 H
+ATOM 10550 N ARG K 66 3.356 59.574 20.263 1.00 58.76 N
+ATOM 10551 CA ARG K 66 3.638 58.431 19.407 1.00 57.33 C
+ATOM 10552 C ARG K 66 2.922 57.137 19.787 1.00 57.17 C
+ATOM 10553 O ARG K 66 2.790 56.250 18.947 1.00 55.21 O
+ATOM 10554 CB ARG K 66 5.135 58.180 19.400 1.00 67.71 C
+ATOM 10555 CG ARG K 66 5.618 57.099 18.482 1.00 73.28 C
+ATOM 10556 CD ARG K 66 7.098 57.167 18.349 1.00 80.80 C
+ATOM 10557 NE ARG K 66 7.662 56.039 17.632 1.00 84.36 N
+ATOM 10558 CZ ARG K 66 8.968 55.929 17.293 1.00 45.00 C
+ATOM 10559 NH1 ARG K 66 9.816 56.899 17.587 1.00 45.00 N
+ATOM 10560 NH2 ARG K 66 9.395 54.845 16.661 1.00 45.00 N
+ATOM 10561 H ARG K 66 4.145 60.066 20.656 1.00 0.00 H
+ATOM 10562 HA ARG K 66 3.332 58.695 18.392 1.00 0.00 H
+ATOM 10563 1HB ARG K 66 5.671 59.097 19.156 1.00 0.00 H
+ATOM 10564 2HB ARG K 66 5.440 57.881 20.405 1.00 0.00 H
+ATOM 10565 1HG ARG K 66 5.335 56.121 18.887 1.00 0.00 H
+ATOM 10566 2HG ARG K 66 5.175 57.230 17.496 1.00 0.00 H
+ATOM 10567 1HD ARG K 66 7.336 58.056 17.785 1.00 0.00 H
+ATOM 10568 2HD ARG K 66 7.561 57.226 19.335 1.00 0.00 H
+ATOM 10569 HE ARG K 66 7.046 55.282 17.391 1.00 0.00 H
+ATOM 10570 1HH1 ARG K 66 9.488 57.760 18.058 1.00 0.00 H
+ATOM 10571 2HH1 ARG K 66 10.788 56.808 17.334 1.00 0.00 H
+ATOM 10572 1HH2 ARG K 66 8.747 54.106 16.435 1.00 0.00 H
+ATOM 10573 2HH2 ARG K 66 10.368 54.757 16.407 1.00 0.00 H
+ATOM 10574 N HIS K 67 2.508 56.979 21.055 1.00 57.65 N
+ATOM 10575 CA HIS K 67 1.936 55.693 21.439 1.00 57.13 C
+ATOM 10576 C HIS K 67 0.408 55.687 21.404 1.00 57.80 C
+ATOM 10577 O HIS K 67 -0.222 54.681 21.718 1.00 58.24 O
+ATOM 10578 CB HIS K 67 2.401 55.334 22.848 1.00 61.41 C
+ATOM 10579 CG HIS K 67 3.886 55.317 22.970 1.00 65.59 C
+ATOM 10580 ND1 HIS K 67 4.719 54.881 21.961 1.00 65.39 N
+ATOM 10581 CD2 HIS K 67 4.688 55.647 24.002 1.00 72.92 C
+ATOM 10582 CE1 HIS K 67 5.968 54.981 22.362 1.00 73.59 C
+ATOM 10583 NE2 HIS K 67 5.969 55.432 23.598 1.00 74.91 N
+ATOM 10584 H HIS K 67 2.558 57.737 21.733 1.00 0.00 H
+ATOM 10585 HA HIS K 67 2.294 54.917 20.759 1.00 0.00 H
+ATOM 10586 1HB HIS K 67 2.018 56.077 23.562 1.00 0.00 H
+ATOM 10587 2HB HIS K 67 2.017 54.356 23.135 1.00 0.00 H
+ATOM 10588 HD2 HIS K 67 4.373 56.007 24.973 1.00 0.00 H
+ATOM 10589 HE1 HIS K 67 6.855 54.716 21.778 1.00 0.00 H
+ATOM 10590 HE2 HIS K 67 6.797 55.588 24.168 1.00 0.00 H
+ATOM 10591 N GLY K 68 -0.182 56.820 21.018 1.00 57.61 N
+ATOM 10592 CA GLY K 68 -1.628 56.978 20.979 1.00 58.61 C
+ATOM 10593 C GLY K 68 -2.106 57.692 22.236 1.00 60.44 C
+ATOM 10594 O GLY K 68 -2.401 57.020 23.228 1.00 57.76 O
+ATOM 10595 H GLY K 68 0.398 57.598 20.731 1.00 0.00 H
+ATOM 10596 1HA GLY K 68 -1.900 57.582 20.104 1.00 0.00 H
+ATOM 10597 2HA GLY K 68 -2.114 56.012 20.876 1.00 0.00 H
+ATOM 10598 N VAL K 69 -2.186 59.008 22.135 1.00 60.80 N
+ATOM 10599 CA VAL K 69 -2.536 60.049 23.134 1.00 64.25 C
+ATOM 10600 C VAL K 69 -2.452 59.734 24.627 1.00 65.93 C
+ATOM 10601 O VAL K 69 -2.266 58.629 25.086 1.00 65.17 O
+ATOM 10602 CB VAL K 69 -3.977 60.532 22.875 1.00 69.82 C
+ATOM 10603 CG1 VAL K 69 -4.064 61.125 21.486 1.00 66.08 C
+ATOM 10604 CG2 VAL K 69 -4.983 59.387 23.046 1.00 63.87 C
+ATOM 10605 H VAL K 69 -1.940 59.366 21.229 1.00 0.00 H
+ATOM 10606 HA VAL K 69 -1.887 60.881 22.934 1.00 0.00 H
+ATOM 10607 HB VAL K 69 -4.234 61.350 23.571 1.00 0.00 H
+ATOM 10608 1HG1 VAL K 69 -5.074 61.494 21.301 1.00 0.00 H
+ATOM 10609 2HG1 VAL K 69 -3.386 61.926 21.399 1.00 0.00 H
+ATOM 10610 3HG1 VAL K 69 -3.824 60.359 20.751 1.00 0.00 H
+ATOM 10611 1HG2 VAL K 69 -5.991 59.756 22.866 1.00 0.00 H
+ATOM 10612 2HG2 VAL K 69 -4.784 58.575 22.343 1.00 0.00 H
+ATOM 10613 3HG2 VAL K 69 -4.911 58.998 24.068 1.00 0.00 H
+ATOM 10614 N ILE K 70 -2.698 60.775 25.408 1.00 66.46 N
+ATOM 10615 CA ILE K 70 -2.755 60.660 26.850 1.00 65.32 C
+ATOM 10616 C ILE K 70 -3.409 61.945 27.374 1.00 68.44 C
+ATOM 10617 O ILE K 70 -3.296 62.990 26.735 1.00 68.86 O
+ATOM 10618 CB ILE K 70 -1.335 60.383 27.448 1.00 56.61 C
+ATOM 10619 CG1 ILE K 70 -1.398 59.973 28.944 1.00 52.82 C
+ATOM 10620 CG2 ILE K 70 -0.459 61.548 27.271 1.00 47.17 C
+ATOM 10621 CD1 ILE K 70 -1.992 58.580 29.169 1.00 45.00 C
+ATOM 10622 H ILE K 70 -2.821 61.675 24.978 1.00 0.00 H
+ATOM 10623 HA ILE K 70 -3.402 59.837 27.126 1.00 0.00 H
+ATOM 10624 HB ILE K 70 -0.883 59.545 26.921 1.00 0.00 H
+ATOM 10625 1HG1 ILE K 70 -0.388 59.986 29.363 1.00 0.00 H
+ATOM 10626 2HG1 ILE K 70 -1.987 60.701 29.491 1.00 0.00 H
+ATOM 10627 1HG2 ILE K 70 0.528 61.339 27.651 1.00 0.00 H
+ATOM 10628 2HG2 ILE K 70 -0.395 61.787 26.203 1.00 0.00 H
+ATOM 10629 3HG2 ILE K 70 -0.900 62.359 27.820 1.00 0.00 H
+ATOM 10630 1HD1 ILE K 70 -2.008 58.366 30.231 1.00 0.00 H
+ATOM 10631 2HD1 ILE K 70 -3.009 58.551 28.773 1.00 0.00 H
+ATOM 10632 3HD1 ILE K 70 -1.381 57.834 28.649 1.00 0.00 H
+ATOM 10633 N GLU K 71 -4.093 61.866 28.503 1.00 70.82 N
+ATOM 10634 CA GLU K 71 -4.684 63.080 29.063 1.00 72.17 C
+ATOM 10635 C GLU K 71 -4.243 63.300 30.495 1.00 73.47 C
+ATOM 10636 O GLU K 71 -4.477 62.458 31.368 1.00 72.49 O
+ATOM 10637 CB GLU K 71 -6.214 63.015 29.002 1.00 79.17 C
+ATOM 10638 CG GLU K 71 -6.782 63.040 27.593 1.00 79.40 C
+ATOM 10639 CD GLU K 71 -8.292 63.072 27.560 1.00 85.81 C
+ATOM 10640 OE1 GLU K 71 -8.900 63.055 28.605 1.00 82.39 O
+ATOM 10641 OE2 GLU K 71 -8.833 63.129 26.487 1.00 93.76 O
+ATOM 10642 H GLU K 71 -4.175 60.988 28.985 1.00 0.00 H
+ATOM 10643 HA GLU K 71 -4.366 63.931 28.481 1.00 0.00 H
+ATOM 10644 1HB GLU K 71 -6.558 62.110 29.478 1.00 0.00 H
+ATOM 10645 2HB GLU K 71 -6.623 63.861 29.543 1.00 0.00 H
+ATOM 10646 1HG GLU K 71 -6.403 63.923 27.102 1.00 0.00 H
+ATOM 10647 2HG GLU K 71 -6.432 62.171 27.045 1.00 0.00 H
+ATOM 10648 N SER K 72 -3.563 64.423 30.734 1.00 74.43 N
+ATOM 10649 CA SER K 72 -3.089 64.745 32.069 1.00 74.53 C
+ATOM 10650 C SER K 72 -4.250 65.338 32.841 1.00 76.47 C
+ATOM 10651 O SER K 72 -5.210 65.795 32.212 1.00 75.66 O
+ATOM 10652 CB SER K 72 -1.892 65.674 32.008 1.00 66.96 C
+ATOM 10653 OG SER K 72 -2.245 66.920 31.521 1.00 67.77 O
+ATOM 10654 H SER K 72 -3.425 65.093 29.970 1.00 0.00 H
+ATOM 10655 HA SER K 72 -2.788 63.816 32.572 1.00 0.00 H
+ATOM 10656 1HB SER K 72 -1.456 65.794 33.002 1.00 0.00 H
+ATOM 10657 2HB SER K 72 -1.138 65.239 31.363 1.00 0.00 H
+ATOM 10658 HG SER K 72 -2.526 67.439 32.297 1.00 0.00 H
+ATOM 10659 N GLU K 73 -4.145 65.363 34.172 1.00 77.63 N
+ATOM 10660 CA GLU K 73 -5.201 65.924 35.027 1.00 78.57 C
+ATOM 10661 C GLU K 73 -4.653 66.859 36.108 1.00 79.15 C
+ATOM 10662 O GLU K 73 -3.458 66.865 36.406 1.00 78.97 O
+ATOM 10663 CB GLU K 73 -6.046 64.809 35.658 1.00 75.68 C
+ATOM 10664 CG GLU K 73 -6.824 63.957 34.649 1.00 81.91 C
+ATOM 10665 CD GLU K 73 -7.689 62.920 35.298 1.00 84.12 C
+ATOM 10666 OE1 GLU K 73 -8.584 63.284 36.012 1.00 93.72 O
+ATOM 10667 OE2 GLU K 73 -7.461 61.754 35.068 1.00 77.59 O
+ATOM 10668 H GLU K 73 -3.313 64.970 34.599 1.00 0.00 H
+ATOM 10669 HA GLU K 73 -5.875 66.500 34.406 1.00 0.00 H
+ATOM 10670 1HB GLU K 73 -5.426 64.150 36.240 1.00 0.00 H
+ATOM 10671 2HB GLU K 73 -6.774 65.257 36.338 1.00 0.00 H
+ATOM 10672 1HG GLU K 73 -7.452 64.615 34.038 1.00 0.00 H
+ATOM 10673 2HG GLU K 73 -6.117 63.466 33.989 1.00 0.00 H
+ATOM 10674 N GLY K 74 -5.550 67.681 36.653 1.00 80.48 N
+ATOM 10675 CA GLY K 74 -5.218 68.618 37.718 1.00 80.15 C
+ATOM 10676 C GLY K 74 -6.065 68.347 38.957 1.00 80.36 C
+ATOM 10677 O GLY K 74 -7.178 67.838 38.847 1.00 80.35 O
+ATOM 10678 OXT GLY K 74 -5.716 68.815 40.041 1.00 0.00 O
+ATOM 10679 H GLY K 74 -6.504 67.631 36.327 1.00 0.00 H
+ATOM 10680 1HA GLY K 74 -4.161 68.539 37.969 1.00 0.00 H
+ATOM 10681 2HA GLY K 74 -5.395 69.637 37.370 1.00 0.00 H
+TER
+ATOM 10683 N SER Z 7 16.768 60.555 -4.200 1.00 68.86 N
+ATOM 10684 CA SER Z 7 15.934 61.750 -4.237 1.00 68.49 C
+ATOM 10685 C SER Z 7 14.541 61.470 -4.794 1.00 67.58 C
+ATOM 10686 O SER Z 7 14.360 60.711 -5.754 1.00 66.56 O
+ATOM 10687 CB SER Z 7 16.610 62.841 -5.041 1.00 75.84 C
+ATOM 10688 OG SER Z 7 17.790 63.263 -4.407 1.00 79.83 O
+ATOM 10689 1H SER Z 7 17.585 60.735 -3.635 1.00 0.00 H
+ATOM 10690 2H SER Z 7 16.241 59.795 -3.795 1.00 0.00 H
+ATOM 10691 3H SER Z 7 17.056 60.307 -5.133 1.00 0.00 H
+ATOM 10692 HA SER Z 7 15.814 62.111 -3.215 1.00 0.00 H
+ATOM 10693 1HB SER Z 7 16.837 62.476 -6.042 1.00 0.00 H
+ATOM 10694 2HB SER Z 7 15.926 63.685 -5.149 1.00 0.00 H
+ATOM 10695 HG SER Z 7 18.302 62.469 -4.248 1.00 0.00 H
+ATOM 10696 N ASP Z 8 13.555 62.102 -4.173 1.00 66.74 N
+ATOM 10697 CA ASP Z 8 12.147 61.966 -4.536 1.00 66.83 C
+ATOM 10698 C ASP Z 8 11.873 62.469 -5.940 1.00 67.24 C
+ATOM 10699 O ASP Z 8 12.585 63.347 -6.439 1.00 66.67 O
+ATOM 10700 CB ASP Z 8 11.265 62.700 -3.528 1.00 70.76 C
+ATOM 10701 CG ASP Z 8 11.236 61.987 -2.185 1.00 72.82 C
+ATOM 10702 OD1 ASP Z 8 10.699 60.894 -2.109 1.00 63.18 O
+ATOM 10703 OD2 ASP Z 8 11.783 62.521 -1.249 1.00 70.96 O
+ATOM 10704 H ASP Z 8 13.787 62.717 -3.406 1.00 0.00 H
+ATOM 10705 HA ASP Z 8 11.886 60.908 -4.505 1.00 0.00 H
+ATOM 10706 1HB ASP Z 8 11.631 63.714 -3.381 1.00 0.00 H
+ATOM 10707 2HB ASP Z 8 10.251 62.769 -3.924 1.00 0.00 H
+ATOM 10708 N PHE Z 9 10.842 61.904 -6.566 1.00 66.27 N
+ATOM 10709 CA PHE Z 9 10.465 62.274 -7.923 1.00 66.38 C
+ATOM 10710 C PHE Z 9 8.969 62.368 -8.113 1.00 66.70 C
+ATOM 10711 O PHE Z 9 8.191 61.892 -7.278 1.00 67.01 O
+ATOM 10712 CB PHE Z 9 10.988 61.246 -8.938 1.00 55.66 C
+ATOM 10713 CG PHE Z 9 10.376 59.882 -8.839 1.00 56.48 C
+ATOM 10714 CD1 PHE Z 9 9.255 59.571 -9.593 1.00 51.24 C
+ATOM 10715 CD2 PHE Z 9 10.920 58.900 -8.025 1.00 58.47 C
+ATOM 10716 CE1 PHE Z 9 8.687 58.321 -9.546 1.00 60.71 C
+ATOM 10717 CE2 PHE Z 9 10.347 57.644 -7.973 1.00 59.12 C
+ATOM 10718 CZ PHE Z 9 9.230 57.361 -8.741 1.00 58.38 C
+ATOM 10719 H PHE Z 9 10.311 61.190 -6.089 1.00 0.00 H
+ATOM 10720 HA PHE Z 9 10.881 63.255 -8.137 1.00 0.00 H
+ATOM 10721 1HB PHE Z 9 10.795 61.602 -9.942 1.00 0.00 H
+ATOM 10722 2HB PHE Z 9 12.046 61.144 -8.834 1.00 0.00 H
+ATOM 10723 HD1 PHE Z 9 8.826 60.338 -10.233 1.00 0.00 H
+ATOM 10724 HD2 PHE Z 9 11.807 59.123 -7.425 1.00 0.00 H
+ATOM 10725 HE1 PHE Z 9 7.808 58.100 -10.149 1.00 0.00 H
+ATOM 10726 HE2 PHE Z 9 10.779 56.873 -7.328 1.00 0.00 H
+ATOM 10727 HZ PHE Z 9 8.789 56.385 -8.706 1.00 0.00 H
+ATOM 10728 N VAL Z 10 8.586 62.991 -9.225 1.00 65.47 N
+ATOM 10729 CA VAL Z 10 7.190 63.139 -9.599 1.00 63.81 C
+ATOM 10730 C VAL Z 10 6.974 62.572 -11.003 1.00 61.86 C
+ATOM 10731 O VAL Z 10 7.893 62.559 -11.822 1.00 61.21 O
+ATOM 10732 CB VAL Z 10 6.824 64.639 -9.607 1.00 61.90 C
+ATOM 10733 CG1 VAL Z 10 7.081 65.255 -8.219 1.00 52.20 C
+ATOM 10734 CG2 VAL Z 10 7.639 65.352 -10.681 1.00 65.96 C
+ATOM 10735 H VAL Z 10 9.312 63.376 -9.824 1.00 0.00 H
+ATOM 10736 HA VAL Z 10 6.560 62.598 -8.893 1.00 0.00 H
+ATOM 10737 HB VAL Z 10 5.757 64.746 -9.826 1.00 0.00 H
+ATOM 10738 1HG1 VAL Z 10 6.820 66.302 -8.233 1.00 0.00 H
+ATOM 10739 2HG1 VAL Z 10 6.488 64.738 -7.468 1.00 0.00 H
+ATOM 10740 3HG1 VAL Z 10 8.138 65.161 -7.973 1.00 0.00 H
+ATOM 10741 1HG2 VAL Z 10 7.374 66.408 -10.701 1.00 0.00 H
+ATOM 10742 2HG2 VAL Z 10 8.703 65.249 -10.464 1.00 0.00 H
+ATOM 10743 3HG2 VAL Z 10 7.421 64.908 -11.653 1.00 0.00 H
+ATOM 10744 N VAL Z 11 5.747 62.134 -11.289 1.00 60.89 N
+ATOM 10745 CA VAL Z 11 5.397 61.643 -12.628 1.00 62.75 C
+ATOM 10746 C VAL Z 11 4.384 62.577 -13.259 1.00 64.58 C
+ATOM 10747 O VAL Z 11 3.297 62.744 -12.724 1.00 63.81 O
+ATOM 10748 CB VAL Z 11 4.745 60.251 -12.549 1.00 65.50 C
+ATOM 10749 CG1 VAL Z 11 4.355 59.772 -13.928 1.00 61.90 C
+ATOM 10750 CG2 VAL Z 11 5.674 59.262 -11.862 1.00 65.87 C
+ATOM 10751 H VAL Z 11 5.037 62.149 -10.559 1.00 0.00 H
+ATOM 10752 HA VAL Z 11 6.289 61.603 -13.250 1.00 0.00 H
+ATOM 10753 HB VAL Z 11 3.845 60.337 -12.000 1.00 0.00 H
+ATOM 10754 1HG1 VAL Z 11 3.863 58.809 -13.825 1.00 0.00 H
+ATOM 10755 2HG1 VAL Z 11 3.665 60.489 -14.379 1.00 0.00 H
+ATOM 10756 3HG1 VAL Z 11 5.226 59.673 -14.554 1.00 0.00 H
+ATOM 10757 1HG2 VAL Z 11 5.179 58.291 -11.790 1.00 0.00 H
+ATOM 10758 2HG2 VAL Z 11 6.578 59.153 -12.415 1.00 0.00 H
+ATOM 10759 3HG2 VAL Z 11 5.910 59.620 -10.876 1.00 0.00 H
+ATOM 10760 N ILE Z 12 4.730 63.178 -14.398 1.00 64.87 N
+ATOM 10761 CA ILE Z 12 3.827 64.132 -15.030 1.00 66.01 C
+ATOM 10762 C ILE Z 12 3.413 63.688 -16.439 1.00 65.12 C
+ATOM 10763 O ILE Z 12 4.258 63.465 -17.305 1.00 63.57 O
+ATOM 10764 CB ILE Z 12 4.505 65.516 -15.101 1.00 62.08 C
+ATOM 10765 CG1 ILE Z 12 4.867 65.980 -13.668 1.00 60.24 C
+ATOM 10766 CG2 ILE Z 12 3.547 66.527 -15.765 1.00 65.25 C
+ATOM 10767 CD1 ILE Z 12 5.767 67.161 -13.614 1.00 58.56 C
+ATOM 10768 H ILE Z 12 5.640 63.004 -14.803 1.00 0.00 H
+ATOM 10769 HA ILE Z 12 2.931 64.221 -14.428 1.00 0.00 H
+ATOM 10770 HB ILE Z 12 5.427 65.447 -15.677 1.00 0.00 H
+ATOM 10771 1HG1 ILE Z 12 3.959 66.227 -13.152 1.00 0.00 H
+ATOM 10772 2HG1 ILE Z 12 5.359 65.169 -13.142 1.00 0.00 H
+ATOM 10773 1HG2 ILE Z 12 4.016 67.503 -15.813 1.00 0.00 H
+ATOM 10774 2HG2 ILE Z 12 3.307 66.193 -16.774 1.00 0.00 H
+ATOM 10775 3HG2 ILE Z 12 2.632 66.597 -15.186 1.00 0.00 H
+ATOM 10776 1HD1 ILE Z 12 5.967 67.425 -12.575 1.00 0.00 H
+ATOM 10777 2HD1 ILE Z 12 6.703 66.921 -14.115 1.00 0.00 H
+ATOM 10778 3HD1 ILE Z 12 5.290 67.984 -14.111 1.00 0.00 H
+ATOM 10779 N LYS Z 13 2.098 63.570 -16.656 1.00 64.97 N
+ATOM 10780 CA LYS Z 13 1.561 63.184 -17.965 1.00 67.43 C
+ATOM 10781 C LYS Z 13 0.830 64.325 -18.646 1.00 70.53 C
+ATOM 10782 O LYS Z 13 -0.093 64.924 -18.095 1.00 70.29 O
+ATOM 10783 CB LYS Z 13 0.599 62.008 -17.864 1.00 59.77 C
+ATOM 10784 CG LYS Z 13 0.005 61.638 -19.226 1.00 49.10 C
+ATOM 10785 CD LYS Z 13 -0.891 60.437 -19.163 1.00 49.26 C
+ATOM 10786 CE LYS Z 13 -1.545 60.185 -20.527 1.00 42.93 C
+ATOM 10787 NZ LYS Z 13 -2.288 58.904 -20.544 1.00 53.88 N
+ATOM 10788 H LYS Z 13 1.458 63.746 -15.890 1.00 0.00 H
+ATOM 10789 HA LYS Z 13 2.387 62.893 -18.609 1.00 0.00 H
+ATOM 10790 1HB LYS Z 13 1.112 61.140 -17.454 1.00 0.00 H
+ATOM 10791 2HB LYS Z 13 -0.215 62.257 -17.200 1.00 0.00 H
+ATOM 10792 1HG LYS Z 13 -0.577 62.478 -19.610 1.00 0.00 H
+ATOM 10793 2HG LYS Z 13 0.816 61.439 -19.931 1.00 0.00 H
+ATOM 10794 1HD LYS Z 13 -0.307 59.558 -18.877 1.00 0.00 H
+ATOM 10795 2HD LYS Z 13 -1.668 60.599 -18.416 1.00 0.00 H
+ATOM 10796 1HE LYS Z 13 -2.237 60.998 -20.746 1.00 0.00 H
+ATOM 10797 2HE LYS Z 13 -0.774 60.155 -21.301 1.00 0.00 H
+ATOM 10798 1HZ LYS Z 13 -2.716 58.746 -21.468 1.00 0.00 H
+ATOM 10799 2HZ LYS Z 13 -1.601 58.167 -20.351 1.00 0.00 H
+ATOM 10800 3HZ LYS Z 13 -3.002 58.899 -19.848 1.00 0.00 H
+ATOM 10801 N ALA Z 14 1.231 64.629 -19.875 1.00 72.45 N
+ATOM 10802 CA ALA Z 14 0.565 65.719 -20.572 1.00 74.90 C
+ATOM 10803 C ALA Z 14 -0.817 65.302 -21.046 1.00 76.39 C
+ATOM 10804 O ALA Z 14 -0.970 64.323 -21.775 1.00 76.13 O
+ATOM 10805 CB ALA Z 14 1.389 66.151 -21.757 1.00 73.01 C
+ATOM 10806 H ALA Z 14 1.998 64.114 -20.310 1.00 0.00 H
+ATOM 10807 HA ALA Z 14 0.454 66.543 -19.879 1.00 0.00 H
+ATOM 10808 1HB ALA Z 14 0.905 66.983 -22.268 1.00 0.00 H
+ATOM 10809 2HB ALA Z 14 2.337 66.453 -21.400 1.00 0.00 H
+ATOM 10810 3HB ALA Z 14 1.499 65.321 -22.436 1.00 0.00 H
+ATOM 10811 N LEU Z 15 -1.831 66.084 -20.676 1.00 78.37 N
+ATOM 10812 CA LEU Z 15 -3.185 65.771 -21.116 1.00 80.25 C
+ATOM 10813 C LEU Z 15 -3.553 66.630 -22.330 1.00 81.00 C
+ATOM 10814 O LEU Z 15 -4.630 66.485 -22.916 1.00 80.94 O
+ATOM 10815 CB LEU Z 15 -4.140 65.961 -19.942 1.00 78.45 C
+ATOM 10816 CG LEU Z 15 -3.830 65.038 -18.716 1.00 77.27 C
+ATOM 10817 CD1 LEU Z 15 -4.775 65.365 -17.559 1.00 76.39 C
+ATOM 10818 CD2 LEU Z 15 -3.949 63.593 -19.136 1.00 68.32 C
+ATOM 10819 H LEU Z 15 -1.690 66.895 -20.073 1.00 0.00 H
+ATOM 10820 HA LEU Z 15 -3.223 64.726 -21.416 1.00 0.00 H
+ATOM 10821 1HB LEU Z 15 -4.068 66.987 -19.621 1.00 0.00 H
+ATOM 10822 2HB LEU Z 15 -5.158 65.764 -20.273 1.00 0.00 H
+ATOM 10823 HG LEU Z 15 -2.821 65.204 -18.386 1.00 0.00 H
+ATOM 10824 1HD1 LEU Z 15 -4.554 64.732 -16.712 1.00 0.00 H
+ATOM 10825 2HD1 LEU Z 15 -4.646 66.395 -17.261 1.00 0.00 H
+ATOM 10826 3HD1 LEU Z 15 -5.804 65.200 -17.866 1.00 0.00 H
+ATOM 10827 1HD2 LEU Z 15 -3.713 62.946 -18.289 1.00 0.00 H
+ATOM 10828 2HD2 LEU Z 15 -4.965 63.396 -19.474 1.00 0.00 H
+ATOM 10829 3HD2 LEU Z 15 -3.247 63.397 -19.948 1.00 0.00 H
+ATOM 10830 N GLU Z 16 -2.619 67.498 -22.713 1.00 81.36 N
+ATOM 10831 CA GLU Z 16 -2.753 68.379 -23.870 1.00 81.67 C
+ATOM 10832 C GLU Z 16 -1.377 68.786 -24.395 1.00 81.60 C
+ATOM 10833 O GLU Z 16 -0.383 68.704 -23.683 1.00 80.68 O
+ATOM 10834 CB GLU Z 16 -3.578 69.624 -23.531 1.00 76.16 C
+ATOM 10835 CG GLU Z 16 -2.974 70.556 -22.490 1.00 78.26 C
+ATOM 10836 CD GLU Z 16 -3.884 71.726 -22.181 1.00 86.94 C
+ATOM 10837 OE1 GLU Z 16 -4.909 71.844 -22.812 1.00 90.43 O
+ATOM 10838 OE2 GLU Z 16 -3.576 72.477 -21.282 1.00 86.49 O
+ATOM 10839 H GLU Z 16 -1.772 67.541 -22.168 1.00 0.00 H
+ATOM 10840 HA GLU Z 16 -3.267 67.838 -24.662 1.00 0.00 H
+ATOM 10841 1HB GLU Z 16 -3.733 70.206 -24.439 1.00 0.00 H
+ATOM 10842 2HB GLU Z 16 -4.558 69.319 -23.166 1.00 0.00 H
+ATOM 10843 1HG GLU Z 16 -2.766 70.001 -21.576 1.00 0.00 H
+ATOM 10844 2HG GLU Z 16 -2.024 70.936 -22.875 1.00 0.00 H
+ATOM 10845 N ASP Z 17 -1.306 69.206 -25.651 1.00 80.54 N
+ATOM 10846 CA ASP Z 17 -0.043 69.722 -26.164 1.00 79.49 C
+ATOM 10847 C ASP Z 17 0.313 71.008 -25.429 1.00 78.01 C
+ATOM 10848 O ASP Z 17 -0.549 71.872 -25.267 1.00 78.86 O
+ATOM 10849 CB ASP Z 17 -0.146 70.033 -27.662 1.00 84.27 C
+ATOM 10850 CG ASP Z 17 -0.266 68.809 -28.582 1.00 90.58 C
+ATOM 10851 OD1 ASP Z 17 -0.021 67.699 -28.151 1.00 92.65 O
+ATOM 10852 OD2 ASP Z 17 -0.609 69.004 -29.719 1.00 93.60 O
+ATOM 10853 H ASP Z 17 -2.136 69.224 -26.226 1.00 0.00 H
+ATOM 10854 HA ASP Z 17 0.745 68.995 -25.984 1.00 0.00 H
+ATOM 10855 1HB ASP Z 17 -1.004 70.684 -27.835 1.00 0.00 H
+ATOM 10856 2HB ASP Z 17 0.744 70.592 -27.962 1.00 0.00 H
+ATOM 10857 N GLY Z 18 1.585 71.196 -25.084 1.00 76.71 N
+ATOM 10858 CA GLY Z 18 1.980 72.469 -24.483 1.00 76.09 C
+ATOM 10859 C GLY Z 18 2.105 72.430 -22.963 1.00 78.92 C
+ATOM 10860 O GLY Z 18 2.077 73.474 -22.310 1.00 79.60 O
+ATOM 10861 H GLY Z 18 2.269 70.446 -25.187 1.00 0.00 H
+ATOM 10862 1HA GLY Z 18 2.933 72.780 -24.910 1.00 0.00 H
+ATOM 10863 2HA GLY Z 18 1.255 73.232 -24.760 1.00 0.00 H
+ATOM 10864 N VAL Z 19 2.207 71.239 -22.392 1.00 78.08 N
+ATOM 10865 CA VAL Z 19 2.380 71.145 -20.948 1.00 76.28 C
+ATOM 10866 C VAL Z 19 3.812 71.477 -20.618 1.00 74.87 C
+ATOM 10867 O VAL Z 19 4.730 71.023 -21.293 1.00 72.79 O
+ATOM 10868 CB VAL Z 19 1.976 69.772 -20.408 1.00 75.09 C
+ATOM 10869 CG1 VAL Z 19 2.356 69.635 -18.928 1.00 73.56 C
+ATOM 10870 CG2 VAL Z 19 0.487 69.637 -20.568 1.00 73.28 C
+ATOM 10871 H VAL Z 19 2.239 70.404 -22.973 1.00 0.00 H
+ATOM 10872 HA VAL Z 19 1.736 71.884 -20.470 1.00 0.00 H
+ATOM 10873 HB VAL Z 19 2.464 69.017 -20.956 1.00 0.00 H
+ATOM 10874 1HG1 VAL Z 19 2.064 68.658 -18.569 1.00 0.00 H
+ATOM 10875 2HG1 VAL Z 19 3.437 69.746 -18.816 1.00 0.00 H
+ATOM 10876 3HG1 VAL Z 19 1.852 70.404 -18.346 1.00 0.00 H
+ATOM 10877 1HG2 VAL Z 19 0.158 68.686 -20.209 1.00 0.00 H
+ATOM 10878 2HG2 VAL Z 19 -0.011 70.422 -20.002 1.00 0.00 H
+ATOM 10879 3HG2 VAL Z 19 0.232 69.738 -21.614 1.00 0.00 H
+ATOM 10880 N ASN Z 20 4.009 72.317 -19.622 1.00 75.20 N
+ATOM 10881 CA ASN Z 20 5.354 72.754 -19.289 1.00 76.35 C
+ATOM 10882 C ASN Z 20 5.720 72.483 -17.850 1.00 77.34 C
+ATOM 10883 O ASN Z 20 5.019 72.891 -16.920 1.00 78.47 O
+ATOM 10884 CB ASN Z 20 5.538 74.219 -19.640 1.00 79.28 C
+ATOM 10885 CG ASN Z 20 5.521 74.470 -21.138 1.00 89.07 C
+ATOM 10886 OD1 ASN Z 20 6.513 74.247 -21.834 1.00 94.49 O
+ATOM 10887 ND2 ASN Z 20 4.409 74.931 -21.643 1.00 91.31 N
+ATOM 10888 H ASN Z 20 3.207 72.645 -19.087 1.00 0.00 H
+ATOM 10889 HA ASN Z 20 6.059 72.181 -19.890 1.00 0.00 H
+ATOM 10890 1HB ASN Z 20 4.742 74.802 -19.193 1.00 0.00 H
+ATOM 10891 2HB ASN Z 20 6.483 74.575 -19.227 1.00 0.00 H
+ATOM 10892 1HD2 ASN Z 20 4.334 75.110 -22.623 1.00 0.00 H
+ATOM 10893 2HD2 ASN Z 20 3.620 75.094 -21.057 1.00 0.00 H
+ATOM 10894 N VAL Z 21 6.812 71.749 -17.679 1.00 75.13 N
+ATOM 10895 CA VAL Z 21 7.312 71.410 -16.362 1.00 74.02 C
+ATOM 10896 C VAL Z 21 8.575 72.232 -16.121 1.00 73.34 C
+ATOM 10897 O VAL Z 21 9.548 72.140 -16.873 1.00 74.07 O
+ATOM 10898 CB VAL Z 21 7.598 69.907 -16.291 1.00 69.64 C
+ATOM 10899 CG1 VAL Z 21 8.119 69.558 -14.923 1.00 66.58 C
+ATOM 10900 CG2 VAL Z 21 6.310 69.144 -16.631 1.00 61.67 C
+ATOM 10901 H VAL Z 21 7.325 71.426 -18.498 1.00 0.00 H
+ATOM 10902 HA VAL Z 21 6.567 71.667 -15.610 1.00 0.00 H
+ATOM 10903 HB VAL Z 21 8.374 69.652 -17.013 1.00 0.00 H
+ATOM 10904 1HG1 VAL Z 21 8.337 68.496 -14.872 1.00 0.00 H
+ATOM 10905 2HG1 VAL Z 21 9.028 70.125 -14.724 1.00 0.00 H
+ATOM 10906 3HG1 VAL Z 21 7.363 69.812 -14.188 1.00 0.00 H
+ATOM 10907 1HG2 VAL Z 21 6.493 68.073 -16.594 1.00 0.00 H
+ATOM 10908 2HG2 VAL Z 21 5.540 69.409 -15.914 1.00 0.00 H
+ATOM 10909 3HG2 VAL Z 21 5.975 69.415 -17.634 1.00 0.00 H
+ATOM 10910 N ILE Z 22 8.539 73.074 -15.096 1.00 72.16 N
+ATOM 10911 CA ILE Z 22 9.605 74.033 -14.866 1.00 71.22 C
+ATOM 10912 C ILE Z 22 10.427 73.744 -13.622 1.00 69.95 C
+ATOM 10913 O ILE Z 22 9.897 73.561 -12.525 1.00 69.76 O
+ATOM 10914 CB ILE Z 22 9.026 75.461 -14.778 1.00 74.57 C
+ATOM 10915 CG1 ILE Z 22 8.293 75.800 -16.076 1.00 71.78 C
+ATOM 10916 CG2 ILE Z 22 10.124 76.477 -14.502 1.00 66.14 C
+ATOM 10917 CD1 ILE Z 22 6.806 75.502 -16.018 1.00 71.68 C
+ATOM 10918 H ILE Z 22 7.729 73.084 -14.495 1.00 0.00 H
+ATOM 10919 HA ILE Z 22 10.269 73.999 -15.716 1.00 0.00 H
+ATOM 10920 HB ILE Z 22 8.304 75.492 -13.996 1.00 0.00 H
+ATOM 10921 1HG1 ILE Z 22 8.431 76.854 -16.301 1.00 0.00 H
+ATOM 10922 2HG1 ILE Z 22 8.725 75.213 -16.887 1.00 0.00 H
+ATOM 10923 1HG2 ILE Z 22 9.688 77.474 -14.439 1.00 0.00 H
+ATOM 10924 2HG2 ILE Z 22 10.621 76.243 -13.565 1.00 0.00 H
+ATOM 10925 3HG2 ILE Z 22 10.850 76.446 -15.316 1.00 0.00 H
+ATOM 10926 1HD1 ILE Z 22 6.350 75.753 -16.970 1.00 0.00 H
+ATOM 10927 2HD1 ILE Z 22 6.654 74.452 -15.813 1.00 0.00 H
+ATOM 10928 3HD1 ILE Z 22 6.346 76.090 -15.226 1.00 0.00 H
+ATOM 10929 N GLY Z 23 11.742 73.674 -13.809 1.00 68.71 N
+ATOM 10930 CA GLY Z 23 12.652 73.451 -12.697 1.00 67.52 C
+ATOM 10931 C GLY Z 23 13.066 74.785 -12.086 1.00 67.48 C
+ATOM 10932 O GLY Z 23 13.563 75.680 -12.793 1.00 66.25 O
+ATOM 10933 H GLY Z 23 12.109 73.827 -14.741 1.00 0.00 H
+ATOM 10934 1HA GLY Z 23 12.171 72.830 -11.941 1.00 0.00 H
+ATOM 10935 2HA GLY Z 23 13.534 72.916 -13.048 1.00 0.00 H
+ATOM 10936 N LEU Z 24 12.890 74.880 -10.758 1.00 69.58 N
+ATOM 10937 CA LEU Z 24 13.222 76.052 -9.946 1.00 68.49 C
+ATOM 10938 C LEU Z 24 14.467 75.775 -9.116 1.00 68.94 C
+ATOM 10939 O LEU Z 24 14.574 74.725 -8.459 1.00 66.69 O
+ATOM 10940 CB LEU Z 24 12.069 76.413 -9.015 1.00 63.79 C
+ATOM 10941 CG LEU Z 24 10.845 77.121 -9.641 1.00 69.14 C
+ATOM 10942 CD1 LEU Z 24 10.038 76.119 -10.461 1.00 69.90 C
+ATOM 10943 CD2 LEU Z 24 9.980 77.718 -8.531 1.00 73.28 C
+ATOM 10944 H LEU Z 24 12.457 74.094 -10.277 1.00 0.00 H
+ATOM 10945 HA LEU Z 24 13.422 76.888 -10.600 1.00 0.00 H
+ATOM 10946 1HB LEU Z 24 11.724 75.500 -8.603 1.00 0.00 H
+ATOM 10947 2HB LEU Z 24 12.455 77.040 -8.210 1.00 0.00 H
+ATOM 10948 HG LEU Z 24 11.186 77.915 -10.308 1.00 0.00 H
+ATOM 10949 1HD1 LEU Z 24 9.188 76.624 -10.905 1.00 0.00 H
+ATOM 10950 2HD1 LEU Z 24 10.650 75.709 -11.239 1.00 0.00 H
+ATOM 10951 3HD1 LEU Z 24 9.688 75.310 -9.817 1.00 0.00 H
+ATOM 10952 1HD2 LEU Z 24 9.117 78.224 -8.972 1.00 0.00 H
+ATOM 10953 2HD2 LEU Z 24 9.635 76.927 -7.872 1.00 0.00 H
+ATOM 10954 3HD2 LEU Z 24 10.564 78.440 -7.958 1.00 0.00 H
+ATOM 10955 N THR Z 25 15.398 76.728 -9.154 1.00 71.22 N
+ATOM 10956 CA THR Z 25 16.721 76.556 -8.571 1.00 71.81 C
+ATOM 10957 C THR Z 25 16.785 76.388 -7.068 1.00 72.21 C
+ATOM 10958 O THR Z 25 16.056 77.029 -6.310 1.00 72.78 O
+ATOM 10959 CB THR Z 25 17.630 77.749 -8.938 1.00 76.13 C
+ATOM 10960 OG1 THR Z 25 17.048 78.993 -8.457 1.00 83.05 O
+ATOM 10961 CG2 THR Z 25 17.799 77.801 -10.443 1.00 76.92 C
+ATOM 10962 H THR Z 25 15.193 77.576 -9.671 1.00 0.00 H
+ATOM 10963 HA THR Z 25 17.148 75.674 -9.022 1.00 0.00 H
+ATOM 10964 HB THR Z 25 18.614 77.623 -8.479 1.00 0.00 H
+ATOM 10965 HG1 THR Z 25 17.503 79.309 -7.634 1.00 0.00 H
+ATOM 10966 1HG2 THR Z 25 18.443 78.631 -10.707 1.00 0.00 H
+ATOM 10967 2HG2 THR Z 25 18.249 76.869 -10.779 1.00 0.00 H
+ATOM 10968 3HG2 THR Z 25 16.830 77.923 -10.918 1.00 0.00 H
+ATOM 10969 N ARG Z 26 17.732 75.545 -6.666 1.00 71.56 N
+ATOM 10970 CA ARG Z 26 18.076 75.314 -5.272 1.00 70.46 C
+ATOM 10971 C ARG Z 26 19.090 76.344 -4.797 1.00 69.20 C
+ATOM 10972 O ARG Z 26 20.086 76.602 -5.475 1.00 67.76 O
+ATOM 10973 CB ARG Z 26 18.655 73.918 -5.077 1.00 64.50 C
+ATOM 10974 CG ARG Z 26 18.949 73.553 -3.625 1.00 58.10 C
+ATOM 10975 CD ARG Z 26 19.535 72.189 -3.487 1.00 63.26 C
+ATOM 10976 NE ARG Z 26 18.661 71.151 -4.008 1.00 61.46 N
+ATOM 10977 CZ ARG Z 26 17.623 70.604 -3.357 1.00 60.61 C
+ATOM 10978 NH1 ARG Z 26 17.312 70.991 -2.142 1.00 57.93 N
+ATOM 10979 NH2 ARG Z 26 16.938 69.673 -3.971 1.00 58.21 N
+ATOM 10980 H ARG Z 26 18.227 75.027 -7.387 1.00 0.00 H
+ATOM 10981 HA ARG Z 26 17.172 75.412 -4.671 1.00 0.00 H
+ATOM 10982 1HB ARG Z 26 17.957 73.177 -5.466 1.00 0.00 H
+ATOM 10983 2HB ARG Z 26 19.579 73.817 -5.647 1.00 0.00 H
+ATOM 10984 1HG ARG Z 26 19.677 74.260 -3.227 1.00 0.00 H
+ATOM 10985 2HG ARG Z 26 18.034 73.604 -3.038 1.00 0.00 H
+ATOM 10986 1HD ARG Z 26 20.476 72.145 -4.025 1.00 0.00 H
+ATOM 10987 2HD ARG Z 26 19.714 71.982 -2.435 1.00 0.00 H
+ATOM 10988 HE ARG Z 26 18.845 70.781 -4.950 1.00 0.00 H
+ATOM 10989 1HH1 ARG Z 26 17.862 71.703 -1.694 1.00 0.00 H
+ATOM 10990 2HH1 ARG Z 26 16.536 70.566 -1.652 1.00 0.00 H
+ATOM 10991 1HH2 ARG Z 26 17.241 69.405 -4.910 1.00 0.00 H
+ATOM 10992 2HH2 ARG Z 26 16.126 69.240 -3.541 1.00 0.00 H
+ATOM 10993 N GLY Z 27 18.850 76.930 -3.631 1.00 68.81 N
+ATOM 10994 CA GLY Z 27 19.775 77.911 -3.074 1.00 68.77 C
+ATOM 10995 C GLY Z 27 19.058 79.196 -2.692 1.00 69.85 C
+ATOM 10996 O GLY Z 27 17.840 79.300 -2.809 1.00 69.21 O
+ATOM 10997 H GLY Z 27 18.009 76.696 -3.120 1.00 0.00 H
+ATOM 10998 1HA GLY Z 27 20.263 77.488 -2.198 1.00 0.00 H
+ATOM 10999 2HA GLY Z 27 20.557 78.130 -3.802 1.00 0.00 H
+ATOM 11000 N ALA Z 28 19.822 80.182 -2.218 1.00 71.48 N
+ATOM 11001 CA ALA Z 28 19.256 81.459 -1.785 1.00 72.94 C
+ATOM 11002 C ALA Z 28 18.508 82.156 -2.919 1.00 73.37 C
+ATOM 11003 O ALA Z 28 17.484 82.800 -2.697 1.00 72.84 O
+ATOM 11004 CB ALA Z 28 20.359 82.368 -1.274 1.00 65.55 C
+ATOM 11005 H ALA Z 28 20.818 80.037 -2.145 1.00 0.00 H
+ATOM 11006 HA ALA Z 28 18.549 81.264 -0.977 1.00 0.00 H
+ATOM 11007 1HB ALA Z 28 19.925 83.307 -0.933 1.00 0.00 H
+ATOM 11008 2HB ALA Z 28 20.879 81.890 -0.449 1.00 0.00 H
+ATOM 11009 3HB ALA Z 28 21.065 82.568 -2.081 1.00 0.00 H
+ATOM 11010 N ASP Z 29 19.033 82.039 -4.135 1.00 75.46 N
+ATOM 11011 CA ASP Z 29 18.409 82.668 -5.287 1.00 77.29 C
+ATOM 11012 C ASP Z 29 17.478 81.684 -5.998 1.00 78.34 C
+ATOM 11013 O ASP Z 29 17.935 80.685 -6.567 1.00 78.34 O
+ATOM 11014 CB ASP Z 29 19.471 83.187 -6.265 1.00 84.16 C
+ATOM 11015 CG ASP Z 29 20.295 84.363 -5.687 1.00 87.97 C
+ATOM 11016 OD1 ASP Z 29 19.743 85.164 -4.968 1.00 92.12 O
+ATOM 11017 OD2 ASP Z 29 21.461 84.444 -5.988 1.00 87.48 O
+ATOM 11018 H ASP Z 29 19.873 81.491 -4.255 1.00 0.00 H
+ATOM 11019 HA ASP Z 29 17.813 83.517 -4.946 1.00 0.00 H
+ATOM 11020 1HB ASP Z 29 20.153 82.371 -6.510 1.00 0.00 H
+ATOM 11021 2HB ASP Z 29 19.000 83.504 -7.195 1.00 0.00 H
+ATOM 11022 N THR Z 30 16.182 81.993 -5.978 1.00 79.18 N
+ATOM 11023 CA THR Z 30 15.210 81.108 -6.606 1.00 80.41 C
+ATOM 11024 C THR Z 30 14.736 81.715 -7.923 1.00 82.92 C
+ATOM 11025 O THR Z 30 14.213 82.823 -7.969 1.00 83.65 O
+ATOM 11026 CB THR Z 30 13.997 80.842 -5.693 1.00 76.91 C
+ATOM 11027 OG1 THR Z 30 14.429 80.208 -4.476 1.00 78.62 O
+ATOM 11028 CG2 THR Z 30 13.010 79.914 -6.407 1.00 72.81 C
+ATOM 11029 H THR Z 30 15.871 82.827 -5.504 1.00 0.00 H
+ATOM 11030 HA THR Z 30 15.678 80.151 -6.814 1.00 0.00 H
+ATOM 11031 HB THR Z 30 13.516 81.775 -5.450 1.00 0.00 H
+ATOM 11032 HG1 THR Z 30 14.999 80.805 -3.980 1.00 0.00 H
+ATOM 11033 1HG2 THR Z 30 12.160 79.728 -5.754 1.00 0.00 H
+ATOM 11034 2HG2 THR Z 30 12.664 80.387 -7.327 1.00 0.00 H
+ATOM 11035 3HG2 THR Z 30 13.501 78.969 -6.647 1.00 0.00 H
+ATOM 11036 N ARG Z 31 14.946 80.957 -8.986 1.00 83.13 N
+ATOM 11037 CA ARG Z 31 14.602 81.332 -10.349 1.00 83.71 C
+ATOM 11038 C ARG Z 31 14.349 80.072 -11.141 1.00 83.79 C
+ATOM 11039 O ARG Z 31 14.612 78.977 -10.655 1.00 85.08 O
+ATOM 11040 CB ARG Z 31 15.747 82.114 -10.985 1.00 89.44 C
+ATOM 11041 CG ARG Z 31 17.066 81.353 -10.953 1.00 96.86 C
+ATOM 11042 CD ARG Z 31 18.074 81.786 -11.957 1.00 96.40 C
+ATOM 11043 NE ARG Z 31 17.716 81.330 -13.282 1.00 97.43 N
+ATOM 11044 CZ ARG Z 31 18.430 81.516 -14.397 1.00 96.58 C
+ATOM 11045 NH1 ARG Z 31 19.568 82.179 -14.378 1.00 97.23 N
+ATOM 11046 NH2 ARG Z 31 17.960 81.001 -15.511 1.00 96.73 N
+ATOM 11047 H ARG Z 31 15.429 80.079 -8.842 1.00 0.00 H
+ATOM 11048 HA ARG Z 31 13.702 81.943 -10.341 1.00 0.00 H
+ATOM 11049 1HB ARG Z 31 15.511 82.329 -12.026 1.00 0.00 H
+ATOM 11050 2HB ARG Z 31 15.888 83.062 -10.468 1.00 0.00 H
+ATOM 11051 1HG ARG Z 31 17.510 81.427 -9.955 1.00 0.00 H
+ATOM 11052 2HG ARG Z 31 16.835 80.322 -11.166 1.00 0.00 H
+ATOM 11053 1HD ARG Z 31 18.146 82.874 -11.973 1.00 0.00 H
+ATOM 11054 2HD ARG Z 31 19.041 81.359 -11.701 1.00 0.00 H
+ATOM 11055 HE ARG Z 31 16.846 80.797 -13.392 1.00 0.00 H
+ATOM 11056 1HH1 ARG Z 31 19.916 82.562 -13.511 1.00 0.00 H
+ATOM 11057 2HH1 ARG Z 31 20.093 82.301 -15.229 1.00 0.00 H
+ATOM 11058 1HH2 ARG Z 31 17.080 80.477 -15.456 1.00 0.00 H
+ATOM 11059 2HH2 ARG Z 31 18.459 81.104 -16.379 1.00 0.00 H
+ATOM 11060 N PHE Z 32 13.820 80.183 -12.347 1.00 81.47 N
+ATOM 11061 CA PHE Z 32 13.693 78.956 -13.107 1.00 79.61 C
+ATOM 11062 C PHE Z 32 14.984 78.751 -13.871 1.00 78.31 C
+ATOM 11063 O PHE Z 32 15.662 79.729 -14.204 1.00 79.99 O
+ATOM 11064 CB PHE Z 32 12.513 79.006 -14.068 1.00 85.70 C
+ATOM 11065 CG PHE Z 32 12.605 80.063 -15.106 1.00 96.52 C
+ATOM 11066 CD1 PHE Z 32 12.071 81.323 -14.885 1.00 98.62 C
+ATOM 11067 CD2 PHE Z 32 13.217 79.798 -16.320 1.00 99.55 C
+ATOM 11068 CE1 PHE Z 32 12.151 82.301 -15.859 1.00 95.02 C
+ATOM 11069 CE2 PHE Z 32 13.298 80.772 -17.297 1.00 98.18 C
+ATOM 11070 CZ PHE Z 32 12.764 82.026 -17.065 1.00 97.66 C
+ATOM 11071 H PHE Z 32 13.553 81.077 -12.736 1.00 0.00 H
+ATOM 11072 HA PHE Z 32 13.548 78.120 -12.433 1.00 0.00 H
+ATOM 11073 1HB PHE Z 32 12.448 78.050 -14.575 1.00 0.00 H
+ATOM 11074 2HB PHE Z 32 11.588 79.146 -13.508 1.00 0.00 H
+ATOM 11075 HD1 PHE Z 32 11.585 81.538 -13.934 1.00 0.00 H
+ATOM 11076 HD2 PHE Z 32 13.635 78.804 -16.499 1.00 0.00 H
+ATOM 11077 HE1 PHE Z 32 11.728 83.288 -15.674 1.00 0.00 H
+ATOM 11078 HE2 PHE Z 32 13.780 80.553 -18.248 1.00 0.00 H
+ATOM 11079 HZ PHE Z 32 12.825 82.796 -17.833 1.00 0.00 H
+ATOM 11080 N HIS Z 33 15.314 77.503 -14.168 1.00 74.57 N
+ATOM 11081 CA HIS Z 33 16.507 77.242 -14.956 1.00 69.97 C
+ATOM 11082 C HIS Z 33 16.187 76.381 -16.168 1.00 67.05 C
+ATOM 11083 O HIS Z 33 16.954 76.341 -17.129 1.00 65.58 O
+ATOM 11084 CB HIS Z 33 17.580 76.576 -14.086 1.00 71.21 C
+ATOM 11085 CG HIS Z 33 17.234 75.194 -13.604 1.00 72.81 C
+ATOM 11086 ND1 HIS Z 33 17.420 74.083 -14.392 1.00 71.05 N
+ATOM 11087 CD2 HIS Z 33 16.709 74.739 -12.435 1.00 73.72 C
+ATOM 11088 CE1 HIS Z 33 17.031 73.010 -13.738 1.00 74.58 C
+ATOM 11089 NE2 HIS Z 33 16.599 73.377 -12.551 1.00 71.27 N
+ATOM 11090 H HIS Z 33 14.731 76.744 -13.824 1.00 0.00 H
+ATOM 11091 HA HIS Z 33 16.915 78.179 -15.327 1.00 0.00 H
+ATOM 11092 1HB HIS Z 33 18.511 76.509 -14.652 1.00 0.00 H
+ATOM 11093 2HB HIS Z 33 17.775 77.200 -13.222 1.00 0.00 H
+ATOM 11094 HD2 HIS Z 33 16.427 75.332 -11.569 1.00 0.00 H
+ATOM 11095 HE1 HIS Z 33 17.066 71.989 -14.119 1.00 0.00 H
+ATOM 11096 HE2 HIS Z 33 16.247 72.741 -11.848 1.00 0.00 H
+ATOM 11097 N HIS Z 34 15.027 75.726 -16.142 1.00 66.06 N
+ATOM 11098 CA HIS Z 34 14.656 74.855 -17.258 1.00 66.21 C
+ATOM 11099 C HIS Z 34 13.160 74.651 -17.388 1.00 67.22 C
+ATOM 11100 O HIS Z 34 12.454 74.471 -16.401 1.00 66.30 O
+ATOM 11101 CB HIS Z 34 15.331 73.483 -17.156 1.00 65.21 C
+ATOM 11102 CG HIS Z 34 15.045 72.580 -18.339 1.00 66.45 C
+ATOM 11103 ND1 HIS Z 34 15.587 72.795 -19.591 1.00 65.62 N
+ATOM 11104 CD2 HIS Z 34 14.281 71.464 -18.446 1.00 69.54 C
+ATOM 11105 CE1 HIS Z 34 15.162 71.845 -20.419 1.00 69.97 C
+ATOM 11106 NE2 HIS Z 34 14.374 71.028 -19.747 1.00 69.77 N
+ATOM 11107 H HIS Z 34 14.439 75.792 -15.314 1.00 0.00 H
+ATOM 11108 HA HIS Z 34 14.996 75.313 -18.186 1.00 0.00 H
+ATOM 11109 1HB HIS Z 34 16.414 73.612 -17.084 1.00 0.00 H
+ATOM 11110 2HB HIS Z 34 15.002 72.979 -16.249 1.00 0.00 H
+ATOM 11111 HD2 HIS Z 34 13.703 70.998 -17.650 1.00 0.00 H
+ATOM 11112 HE1 HIS Z 34 15.422 71.752 -21.473 1.00 0.00 H
+ATOM 11113 HE2 HIS Z 34 13.903 70.195 -20.135 1.00 0.00 H
+ATOM 11114 N SER Z 35 12.680 74.642 -18.627 1.00 68.43 N
+ATOM 11115 CA SER Z 35 11.270 74.384 -18.891 1.00 70.13 C
+ATOM 11116 C SER Z 35 11.136 73.280 -19.934 1.00 70.57 C
+ATOM 11117 O SER Z 35 11.457 73.471 -21.109 1.00 72.35 O
+ATOM 11118 CB SER Z 35 10.588 75.659 -19.363 1.00 73.21 C
+ATOM 11119 OG SER Z 35 9.244 75.431 -19.683 1.00 75.09 O
+ATOM 11120 H SER Z 35 13.310 74.794 -19.403 1.00 0.00 H
+ATOM 11121 HA SER Z 35 10.791 74.044 -17.978 1.00 0.00 H
+ATOM 11122 1HB SER Z 35 10.653 76.413 -18.580 1.00 0.00 H
+ATOM 11123 2HB SER Z 35 11.111 76.048 -20.234 1.00 0.00 H
+ATOM 11124 HG SER Z 35 9.244 74.723 -20.334 1.00 0.00 H
+ATOM 11125 N GLU Z 36 10.701 72.110 -19.478 1.00 69.75 N
+ATOM 11126 CA GLU Z 36 10.578 70.935 -20.329 1.00 70.41 C
+ATOM 11127 C GLU Z 36 9.166 70.861 -20.884 1.00 71.53 C
+ATOM 11128 O GLU Z 36 8.199 70.763 -20.120 1.00 72.50 O
+ATOM 11129 CB GLU Z 36 10.918 69.660 -19.536 1.00 63.50 C
+ATOM 11130 CG GLU Z 36 10.947 68.353 -20.346 1.00 73.15 C
+ATOM 11131 CD GLU Z 36 12.109 68.237 -21.324 1.00 68.26 C
+ATOM 11132 OE1 GLU Z 36 13.164 68.793 -21.080 1.00 62.66 O
+ATOM 11133 OE2 GLU Z 36 11.933 67.561 -22.321 1.00 59.79 O
+ATOM 11134 H GLU Z 36 10.432 72.040 -18.499 1.00 0.00 H
+ATOM 11135 HA GLU Z 36 11.273 71.029 -21.164 1.00 0.00 H
+ATOM 11136 1HB GLU Z 36 11.884 69.775 -19.059 1.00 0.00 H
+ATOM 11137 2HB GLU Z 36 10.183 69.527 -18.742 1.00 0.00 H
+ATOM 11138 1HG GLU Z 36 11.015 67.517 -19.657 1.00 0.00 H
+ATOM 11139 2HG GLU Z 36 10.007 68.261 -20.893 1.00 0.00 H
+ATOM 11140 N LYS Z 37 9.020 70.956 -22.201 1.00 70.76 N
+ATOM 11141 CA LYS Z 37 7.675 70.935 -22.748 1.00 70.04 C
+ATOM 11142 C LYS Z 37 7.256 69.516 -23.073 1.00 70.08 C
+ATOM 11143 O LYS Z 37 8.086 68.693 -23.484 1.00 69.58 O
+ATOM 11144 CB LYS Z 37 7.571 71.791 -24.008 1.00 72.60 C
+ATOM 11145 CG LYS Z 37 8.376 71.274 -25.194 1.00 49.86 C
+ATOM 11146 CD LYS Z 37 8.229 72.193 -26.409 1.00 45.00 C
+ATOM 11147 CE LYS Z 37 8.966 71.635 -27.624 1.00 45.00 C
+ATOM 11148 NZ LYS Z 37 8.818 72.514 -28.816 1.00 45.00 N
+ATOM 11149 H LYS Z 37 9.829 71.042 -22.803 1.00 0.00 H
+ATOM 11150 HA LYS Z 37 6.990 71.332 -22.004 1.00 0.00 H
+ATOM 11151 1HB LYS Z 37 6.524 71.857 -24.306 1.00 0.00 H
+ATOM 11152 2HB LYS Z 37 7.911 72.803 -23.782 1.00 0.00 H
+ATOM 11153 1HG LYS Z 37 9.430 71.210 -24.919 1.00 0.00 H
+ATOM 11154 2HG LYS Z 37 8.023 70.274 -25.459 1.00 0.00 H
+ATOM 11155 1HD LYS Z 37 7.170 72.303 -26.654 1.00 0.00 H
+ATOM 11156 2HD LYS Z 37 8.633 73.176 -26.170 1.00 0.00 H
+ATOM 11157 1HE LYS Z 37 10.023 71.539 -27.384 1.00 0.00 H
+ATOM 11158 2HE LYS Z 37 8.566 70.648 -27.862 1.00 0.00 H
+ATOM 11159 1HZ LYS Z 37 9.319 72.111 -29.597 1.00 0.00 H
+ATOM 11160 2HZ LYS Z 37 7.838 72.597 -29.052 1.00 0.00 H
+ATOM 11161 3HZ LYS Z 37 9.195 73.428 -28.611 1.00 0.00 H
+ATOM 11162 N LEU Z 38 5.970 69.237 -22.927 1.00 72.61 N
+ATOM 11163 CA LEU Z 38 5.416 67.950 -23.284 1.00 75.12 C
+ATOM 11164 C LEU Z 38 4.341 68.076 -24.363 1.00 75.83 C
+ATOM 11165 O LEU Z 38 3.487 68.987 -24.308 1.00 76.18 O
+ATOM 11166 CB LEU Z 38 4.798 67.297 -22.051 1.00 74.29 C
+ATOM 11167 CG LEU Z 38 5.677 67.121 -20.791 1.00 76.98 C
+ATOM 11168 CD1 LEU Z 38 4.817 66.560 -19.643 1.00 65.02 C
+ATOM 11169 CD2 LEU Z 38 6.811 66.210 -21.089 1.00 75.65 C
+ATOM 11170 H LEU Z 38 5.356 69.951 -22.547 1.00 0.00 H
+ATOM 11171 HA LEU Z 38 6.220 67.317 -23.672 1.00 0.00 H
+ATOM 11172 1HB LEU Z 38 3.986 67.895 -21.777 1.00 0.00 H
+ATOM 11173 2HB LEU Z 38 4.424 66.322 -22.336 1.00 0.00 H
+ATOM 11174 HG LEU Z 38 6.068 68.096 -20.485 1.00 0.00 H
+ATOM 11175 1HD1 LEU Z 38 5.427 66.445 -18.747 1.00 0.00 H
+ATOM 11176 2HD1 LEU Z 38 3.998 67.243 -19.437 1.00 0.00 H
+ATOM 11177 3HD1 LEU Z 38 4.412 65.586 -19.932 1.00 0.00 H
+ATOM 11178 1HD2 LEU Z 38 7.424 66.113 -20.208 1.00 0.00 H
+ATOM 11179 2HD2 LEU Z 38 6.430 65.232 -21.388 1.00 0.00 H
+ATOM 11180 3HD2 LEU Z 38 7.398 66.633 -21.893 1.00 0.00 H
+ATOM 11181 N ASP Z 39 4.316 67.121 -25.278 1.00 75.64 N
+ATOM 11182 CA ASP Z 39 3.223 67.004 -26.236 1.00 77.35 C
+ATOM 11183 C ASP Z 39 2.164 66.132 -25.576 1.00 76.51 C
+ATOM 11184 O ASP Z 39 2.490 65.390 -24.647 1.00 76.90 O
+ATOM 11185 CB ASP Z 39 3.675 66.378 -27.556 1.00 85.95 C
+ATOM 11186 CG ASP Z 39 4.675 67.241 -28.341 1.00 90.46 C
+ATOM 11187 OD1 ASP Z 39 4.859 68.388 -27.994 1.00 86.79 O
+ATOM 11188 OD2 ASP Z 39 5.233 66.744 -29.288 1.00 94.97 O
+ATOM 11189 H ASP Z 39 5.066 66.429 -25.284 1.00 0.00 H
+ATOM 11190 HA ASP Z 39 2.800 67.989 -26.432 1.00 0.00 H
+ATOM 11191 1HB ASP Z 39 4.122 65.402 -27.362 1.00 0.00 H
+ATOM 11192 2HB ASP Z 39 2.796 66.212 -28.189 1.00 0.00 H
+ATOM 11193 N LYS Z 40 0.920 66.190 -26.035 1.00 76.11 N
+ATOM 11194 CA LYS Z 40 -0.103 65.349 -25.430 1.00 76.13 C
+ATOM 11195 C LYS Z 40 0.338 63.900 -25.449 1.00 76.38 C
+ATOM 11196 O LYS Z 40 0.761 63.390 -26.487 1.00 74.71 O
+ATOM 11197 CB LYS Z 40 -1.444 65.489 -26.152 1.00 80.90 C
+ATOM 11198 CG LYS Z 40 -2.587 64.691 -25.524 1.00 76.56 C
+ATOM 11199 CD LYS Z 40 -3.919 65.004 -26.201 1.00 79.58 C
+ATOM 11200 CE LYS Z 40 -5.069 64.245 -25.556 1.00 83.69 C
+ATOM 11201 NZ LYS Z 40 -6.378 64.616 -26.155 1.00 86.89 N
+ATOM 11202 H LYS Z 40 0.670 66.816 -26.804 1.00 0.00 H
+ATOM 11203 HA LYS Z 40 -0.234 65.654 -24.390 1.00 0.00 H
+ATOM 11204 1HB LYS Z 40 -1.734 66.527 -26.183 1.00 0.00 H
+ATOM 11205 2HB LYS Z 40 -1.331 65.164 -27.186 1.00 0.00 H
+ATOM 11206 1HG LYS Z 40 -2.382 63.622 -25.621 1.00 0.00 H
+ATOM 11207 2HG LYS Z 40 -2.657 64.926 -24.466 1.00 0.00 H
+ATOM 11208 1HD LYS Z 40 -4.122 66.071 -26.120 1.00 0.00 H
+ATOM 11209 2HD LYS Z 40 -3.863 64.740 -27.258 1.00 0.00 H
+ATOM 11210 1HE LYS Z 40 -4.912 63.175 -25.690 1.00 0.00 H
+ATOM 11211 2HE LYS Z 40 -5.091 64.468 -24.491 1.00 0.00 H
+ATOM 11212 1HZ LYS Z 40 -7.113 64.097 -25.701 1.00 0.00 H
+ATOM 11213 2HZ LYS Z 40 -6.534 65.606 -26.023 1.00 0.00 H
+ATOM 11214 3HZ LYS Z 40 -6.374 64.404 -27.139 1.00 0.00 H
+ATOM 11215 N GLY Z 41 0.245 63.236 -24.303 1.00 76.21 N
+ATOM 11216 CA GLY Z 41 0.626 61.836 -24.204 1.00 76.11 C
+ATOM 11217 C GLY Z 41 2.042 61.600 -23.680 1.00 74.33 C
+ATOM 11218 O GLY Z 41 2.378 60.477 -23.299 1.00 73.66 O
+ATOM 11219 H GLY Z 41 -0.108 63.703 -23.470 1.00 0.00 H
+ATOM 11220 1HA GLY Z 41 -0.090 61.317 -23.566 1.00 0.00 H
+ATOM 11221 2HA GLY Z 41 0.545 61.391 -25.193 1.00 0.00 H
+ATOM 11222 N GLU Z 42 2.891 62.623 -23.642 1.00 72.42 N
+ATOM 11223 CA GLU Z 42 4.231 62.355 -23.126 1.00 71.89 C
+ATOM 11224 C GLU Z 42 4.227 62.247 -21.611 1.00 70.88 C
+ATOM 11225 O GLU Z 42 3.506 62.969 -20.911 1.00 73.08 O
+ATOM 11226 CB GLU Z 42 5.266 63.401 -23.565 1.00 67.54 C
+ATOM 11227 CG GLU Z 42 5.631 63.379 -25.048 1.00 70.70 C
+ATOM 11228 CD GLU Z 42 6.810 64.295 -25.386 1.00 71.34 C
+ATOM 11229 OE1 GLU Z 42 7.061 65.225 -24.660 1.00 62.04 O
+ATOM 11230 OE2 GLU Z 42 7.482 64.035 -26.351 1.00 74.90 O
+ATOM 11231 H GLU Z 42 2.623 63.551 -23.972 1.00 0.00 H
+ATOM 11232 HA GLU Z 42 4.561 61.391 -23.520 1.00 0.00 H
+ATOM 11233 1HB GLU Z 42 4.888 64.389 -23.342 1.00 0.00 H
+ATOM 11234 2HB GLU Z 42 6.187 63.261 -22.997 1.00 0.00 H
+ATOM 11235 1HG GLU Z 42 5.891 62.356 -25.329 1.00 0.00 H
+ATOM 11236 2HG GLU Z 42 4.756 63.677 -25.629 1.00 0.00 H
+ATOM 11237 N VAL Z 43 5.061 61.341 -21.103 1.00 68.25 N
+ATOM 11238 CA VAL Z 43 5.219 61.189 -19.662 1.00 66.06 C
+ATOM 11239 C VAL Z 43 6.634 61.514 -19.228 1.00 64.93 C
+ATOM 11240 O VAL Z 43 7.605 60.999 -19.784 1.00 63.95 O
+ATOM 11241 CB VAL Z 43 4.837 59.761 -19.194 1.00 65.08 C
+ATOM 11242 CG1 VAL Z 43 5.113 59.609 -17.697 1.00 53.78 C
+ATOM 11243 CG2 VAL Z 43 3.343 59.522 -19.453 1.00 56.05 C
+ATOM 11244 H VAL Z 43 5.609 60.759 -21.740 1.00 0.00 H
+ATOM 11245 HA VAL Z 43 4.546 61.885 -19.168 1.00 0.00 H
+ATOM 11246 HB VAL Z 43 5.436 59.028 -19.735 1.00 0.00 H
+ATOM 11247 1HG1 VAL Z 43 4.844 58.608 -17.373 1.00 0.00 H
+ATOM 11248 2HG1 VAL Z 43 6.171 59.776 -17.503 1.00 0.00 H
+ATOM 11249 3HG1 VAL Z 43 4.522 60.343 -17.145 1.00 0.00 H
+ATOM 11250 1HG2 VAL Z 43 3.062 58.521 -19.126 1.00 0.00 H
+ATOM 11251 2HG2 VAL Z 43 2.770 60.253 -18.899 1.00 0.00 H
+ATOM 11252 3HG2 VAL Z 43 3.138 59.631 -20.513 1.00 0.00 H
+ATOM 11253 N LEU Z 44 6.744 62.397 -18.244 1.00 62.89 N
+ATOM 11254 CA LEU Z 44 8.033 62.801 -17.705 1.00 62.43 C
+ATOM 11255 C LEU Z 44 8.151 62.431 -16.240 1.00 63.36 C
+ATOM 11256 O LEU Z 44 7.328 62.830 -15.419 1.00 62.06 O
+ATOM 11257 CB LEU Z 44 8.214 64.312 -17.858 1.00 52.77 C
+ATOM 11258 CG LEU Z 44 9.501 64.910 -17.262 1.00 56.20 C
+ATOM 11259 CD1 LEU Z 44 10.723 64.369 -18.029 1.00 59.83 C
+ATOM 11260 CD2 LEU Z 44 9.409 66.435 -17.331 1.00 56.52 C
+ATOM 11261 H LEU Z 44 5.894 62.797 -17.853 1.00 0.00 H
+ATOM 11262 HA LEU Z 44 8.822 62.290 -18.251 1.00 0.00 H
+ATOM 11263 1HB LEU Z 44 8.226 64.526 -18.914 1.00 0.00 H
+ATOM 11264 2HB LEU Z 44 7.357 64.817 -17.408 1.00 0.00 H
+ATOM 11265 HG LEU Z 44 9.602 64.602 -16.219 1.00 0.00 H
+ATOM 11266 1HD1 LEU Z 44 11.632 64.785 -17.603 1.00 0.00 H
+ATOM 11267 2HD1 LEU Z 44 10.751 63.282 -17.948 1.00 0.00 H
+ATOM 11268 3HD1 LEU Z 44 10.652 64.655 -19.078 1.00 0.00 H
+ATOM 11269 1HD2 LEU Z 44 10.311 66.879 -16.908 1.00 0.00 H
+ATOM 11270 2HD2 LEU Z 44 9.303 66.747 -18.365 1.00 0.00 H
+ATOM 11271 3HD2 LEU Z 44 8.542 66.769 -16.767 1.00 0.00 H
+ATOM 11272 N ILE Z 45 9.169 61.657 -15.913 1.00 61.33 N
+ATOM 11273 CA ILE Z 45 9.383 61.269 -14.535 1.00 57.32 C
+ATOM 11274 C ILE Z 45 10.654 61.963 -14.072 1.00 54.26 C
+ATOM 11275 O ILE Z 45 11.712 61.775 -14.670 1.00 52.20 O
+ATOM 11276 CB ILE Z 45 9.501 59.750 -14.418 1.00 60.79 C
+ATOM 11277 CG1 ILE Z 45 8.227 59.118 -15.010 1.00 50.37 C
+ATOM 11278 CG2 ILE Z 45 9.613 59.408 -12.946 1.00 53.36 C
+ATOM 11279 CD1 ILE Z 45 8.256 57.641 -15.170 1.00 60.66 C
+ATOM 11280 H ILE Z 45 9.805 61.327 -16.631 1.00 0.00 H
+ATOM 11281 HA ILE Z 45 8.555 61.609 -13.926 1.00 0.00 H
+ATOM 11282 HB ILE Z 45 10.368 59.387 -14.971 1.00 0.00 H
+ATOM 11283 1HG1 ILE Z 45 7.414 59.377 -14.382 1.00 0.00 H
+ATOM 11284 2HG1 ILE Z 45 8.050 59.550 -15.990 1.00 0.00 H
+ATOM 11285 1HG2 ILE Z 45 9.677 58.335 -12.806 1.00 0.00 H
+ATOM 11286 2HG2 ILE Z 45 10.489 59.886 -12.524 1.00 0.00 H
+ATOM 11287 3HG2 ILE Z 45 8.736 59.785 -12.443 1.00 0.00 H
+ATOM 11288 1HD1 ILE Z 45 7.304 57.320 -15.586 1.00 0.00 H
+ATOM 11289 2HD1 ILE Z 45 9.067 57.353 -15.841 1.00 0.00 H
+ATOM 11290 3HD1 ILE Z 45 8.403 57.182 -14.205 1.00 0.00 H
+ATOM 11291 N ALA Z 46 10.571 62.798 -13.037 1.00 54.12 N
+ATOM 11292 CA ALA Z 46 11.762 63.584 -12.712 1.00 55.26 C
+ATOM 11293 C ALA Z 46 12.007 63.777 -11.233 1.00 58.80 C
+ATOM 11294 O ALA Z 46 11.085 64.004 -10.448 1.00 61.18 O
+ATOM 11295 CB ALA Z 46 11.637 64.953 -13.364 1.00 53.18 C
+ATOM 11296 H ALA Z 46 9.692 62.899 -12.532 1.00 0.00 H
+ATOM 11297 HA ALA Z 46 12.630 63.069 -13.112 1.00 0.00 H
+ATOM 11298 1HB ALA Z 46 12.541 65.531 -13.162 1.00 0.00 H
+ATOM 11299 2HB ALA Z 46 11.511 64.836 -14.439 1.00 0.00 H
+ATOM 11300 3HB ALA Z 46 10.772 65.471 -12.952 1.00 0.00 H
+ATOM 11301 N GLN Z 47 13.291 63.706 -10.879 1.00 60.48 N
+ATOM 11302 CA GLN Z 47 13.770 63.884 -9.515 1.00 62.46 C
+ATOM 11303 C GLN Z 47 14.076 65.314 -9.136 1.00 63.55 C
+ATOM 11304 O GLN Z 47 14.414 66.145 -9.982 1.00 64.47 O
+ATOM 11305 CB GLN Z 47 15.050 63.078 -9.277 1.00 63.28 C
+ATOM 11306 CG GLN Z 47 14.900 61.592 -9.315 1.00 57.46 C
+ATOM 11307 CD GLN Z 47 16.203 60.916 -9.037 1.00 57.13 C
+ATOM 11308 OE1 GLN Z 47 17.177 61.094 -9.778 1.00 59.48 O
+ATOM 11309 NE2 GLN Z 47 16.253 60.149 -7.953 1.00 58.97 N
+ATOM 11310 H GLN Z 47 13.986 63.502 -11.597 1.00 0.00 H
+ATOM 11311 HA GLN Z 47 13.007 63.524 -8.839 1.00 0.00 H
+ATOM 11312 1HB GLN Z 47 15.789 63.353 -10.030 1.00 0.00 H
+ATOM 11313 2HB GLN Z 47 15.463 63.344 -8.303 1.00 0.00 H
+ATOM 11314 1HG GLN Z 47 14.212 61.293 -8.533 1.00 0.00 H
+ATOM 11315 2HG GLN Z 47 14.536 61.282 -10.297 1.00 0.00 H
+ATOM 11316 1HE2 GLN Z 47 17.096 59.673 -7.716 1.00 0.00 H
+ATOM 11317 2HE2 GLN Z 47 15.434 60.072 -7.351 1.00 0.00 H
+ATOM 11318 N PHE Z 48 14.049 65.561 -7.834 1.00 62.01 N
+ATOM 11319 CA PHE Z 48 14.558 66.808 -7.284 1.00 62.86 C
+ATOM 11320 C PHE Z 48 16.062 66.599 -7.173 1.00 64.44 C
+ATOM 11321 O PHE Z 48 16.512 65.480 -6.920 1.00 66.84 O
+ATOM 11322 CB PHE Z 48 13.922 67.113 -5.943 1.00 59.63 C
+ATOM 11323 CG PHE Z 48 12.475 67.448 -6.060 1.00 61.39 C
+ATOM 11324 CD1 PHE Z 48 12.067 68.730 -6.360 1.00 60.19 C
+ATOM 11325 CD2 PHE Z 48 11.511 66.467 -5.882 1.00 60.45 C
+ATOM 11326 CE1 PHE Z 48 10.730 69.016 -6.483 1.00 59.31 C
+ATOM 11327 CE2 PHE Z 48 10.178 66.757 -6.008 1.00 62.15 C
+ATOM 11328 CZ PHE Z 48 9.796 68.035 -6.314 1.00 64.66 C
+ATOM 11329 H PHE Z 48 13.684 64.839 -7.213 1.00 0.00 H
+ATOM 11330 HA PHE Z 48 14.363 67.631 -7.976 1.00 0.00 H
+ATOM 11331 1HB PHE Z 48 14.032 66.258 -5.279 1.00 0.00 H
+ATOM 11332 2HB PHE Z 48 14.434 67.963 -5.494 1.00 0.00 H
+ATOM 11333 HD1 PHE Z 48 12.817 69.511 -6.503 1.00 0.00 H
+ATOM 11334 HD2 PHE Z 48 11.826 65.459 -5.645 1.00 0.00 H
+ATOM 11335 HE1 PHE Z 48 10.412 70.008 -6.724 1.00 0.00 H
+ATOM 11336 HE2 PHE Z 48 9.429 65.975 -5.873 1.00 0.00 H
+ATOM 11337 HZ PHE Z 48 8.764 68.269 -6.432 1.00 0.00 H
+ATOM 11338 N THR Z 49 16.842 67.634 -7.458 1.00 63.27 N
+ATOM 11339 CA THR Z 49 18.292 67.474 -7.539 1.00 63.46 C
+ATOM 11340 C THR Z 49 19.085 68.525 -6.792 1.00 64.26 C
+ATOM 11341 O THR Z 49 18.538 69.422 -6.154 1.00 65.74 O
+ATOM 11342 CB THR Z 49 18.785 67.511 -9.002 1.00 58.02 C
+ATOM 11343 OG1 THR Z 49 18.650 68.847 -9.525 1.00 59.86 O
+ATOM 11344 CG2 THR Z 49 17.974 66.552 -9.876 1.00 49.01 C
+ATOM 11345 H THR Z 49 16.415 68.546 -7.596 1.00 0.00 H
+ATOM 11346 HA THR Z 49 18.553 66.505 -7.113 1.00 0.00 H
+ATOM 11347 HB THR Z 49 19.830 67.216 -9.040 1.00 0.00 H
+ATOM 11348 HG1 THR Z 49 17.746 68.952 -9.849 1.00 0.00 H
+ATOM 11349 1HG2 THR Z 49 18.348 66.598 -10.896 1.00 0.00 H
+ATOM 11350 2HG2 THR Z 49 18.065 65.535 -9.502 1.00 0.00 H
+ATOM 11351 3HG2 THR Z 49 16.926 66.842 -9.865 1.00 0.00 H
+ATOM 11352 N GLU Z 50 20.398 68.435 -6.936 1.00 64.19 N
+ATOM 11353 CA GLU Z 50 21.339 69.409 -6.418 1.00 66.78 C
+ATOM 11354 C GLU Z 50 21.034 70.815 -6.951 1.00 69.06 C
+ATOM 11355 O GLU Z 50 21.395 71.806 -6.322 1.00 70.94 O
+ATOM 11356 CB GLU Z 50 22.774 69.007 -6.774 1.00 59.96 C
+ATOM 11357 CG GLU Z 50 23.855 69.925 -6.219 1.00 64.48 C
+ATOM 11358 CD GLU Z 50 25.261 69.425 -6.499 1.00 74.07 C
+ATOM 11359 OE1 GLU Z 50 25.393 68.354 -7.037 1.00 78.04 O
+ATOM 11360 OE2 GLU Z 50 26.197 70.121 -6.181 1.00 72.69 O
+ATOM 11361 H GLU Z 50 20.768 67.654 -7.458 1.00 0.00 H
+ATOM 11362 HA GLU Z 50 21.245 69.435 -5.331 1.00 0.00 H
+ATOM 11363 1HB GLU Z 50 22.970 68.003 -6.398 1.00 0.00 H
+ATOM 11364 2HB GLU Z 50 22.886 68.982 -7.858 1.00 0.00 H
+ATOM 11365 1HG GLU Z 50 23.733 70.913 -6.663 1.00 0.00 H
+ATOM 11366 2HG GLU Z 50 23.716 70.016 -5.145 1.00 0.00 H
+ATOM 11367 N HIS Z 51 20.432 70.900 -8.149 1.00 67.96 N
+ATOM 11368 CA HIS Z 51 20.150 72.196 -8.741 1.00 70.59 C
+ATOM 11369 C HIS Z 51 18.654 72.542 -8.755 1.00 71.12 C
+ATOM 11370 O HIS Z 51 18.317 73.721 -8.825 1.00 72.23 O
+ATOM 11371 CB HIS Z 51 20.722 72.261 -10.163 1.00 65.65 C
+ATOM 11372 CG HIS Z 51 22.227 72.155 -10.199 1.00 70.66 C
+ATOM 11373 ND1 HIS Z 51 22.891 70.949 -10.152 1.00 70.08 N
+ATOM 11374 CD2 HIS Z 51 23.187 73.107 -10.274 1.00 69.19 C
+ATOM 11375 CE1 HIS Z 51 24.196 71.163 -10.188 1.00 64.58 C
+ATOM 11376 NE2 HIS Z 51 24.402 72.464 -10.267 1.00 64.06 N
+ATOM 11377 H HIS Z 51 20.118 70.065 -8.633 1.00 0.00 H
+ATOM 11378 HA HIS Z 51 20.649 72.968 -8.157 1.00 0.00 H
+ATOM 11379 1HB HIS Z 51 20.302 71.452 -10.766 1.00 0.00 H
+ATOM 11380 2HB HIS Z 51 20.429 73.202 -10.629 1.00 0.00 H
+ATOM 11381 HD2 HIS Z 51 23.028 74.185 -10.327 1.00 0.00 H
+ATOM 11382 HE1 HIS Z 51 24.969 70.393 -10.157 1.00 0.00 H
+ATOM 11383 HE2 HIS Z 51 25.305 72.917 -10.309 1.00 0.00 H
+ATOM 11384 N THR Z 52 17.764 71.538 -8.645 1.00 71.24 N
+ATOM 11385 CA THR Z 52 16.305 71.798 -8.654 1.00 71.62 C
+ATOM 11386 C THR Z 52 15.653 71.487 -7.299 1.00 71.79 C
+ATOM 11387 O THR Z 52 15.659 70.341 -6.850 1.00 71.58 O
+ATOM 11388 CB THR Z 52 15.565 70.935 -9.708 1.00 69.97 C
+ATOM 11389 OG1 THR Z 52 16.070 71.212 -11.022 1.00 71.73 O
+ATOM 11390 CG2 THR Z 52 14.040 71.225 -9.672 1.00 74.60 C
+ATOM 11391 H THR Z 52 18.106 70.586 -8.605 1.00 0.00 H
+ATOM 11392 HA THR Z 52 16.141 72.851 -8.874 1.00 0.00 H
+ATOM 11393 HB THR Z 52 15.723 69.880 -9.487 1.00 0.00 H
+ATOM 11394 HG1 THR Z 52 16.960 70.857 -11.106 1.00 0.00 H
+ATOM 11395 1HG2 THR Z 52 13.529 70.610 -10.411 1.00 0.00 H
+ATOM 11396 2HG2 THR Z 52 13.643 70.996 -8.683 1.00 0.00 H
+ATOM 11397 3HG2 THR Z 52 13.863 72.277 -9.893 1.00 0.00 H
+ATOM 11398 N SER Z 53 15.036 72.506 -6.686 1.00 71.18 N
+ATOM 11399 CA SER Z 53 14.376 72.318 -5.385 1.00 70.03 C
+ATOM 11400 C SER Z 53 12.858 72.357 -5.500 1.00 67.83 C
+ATOM 11401 O SER Z 53 12.141 71.953 -4.578 1.00 66.45 O
+ATOM 11402 CB SER Z 53 14.818 73.356 -4.387 1.00 75.16 C
+ATOM 11403 OG SER Z 53 14.481 74.641 -4.801 1.00 69.69 O
+ATOM 11404 H SER Z 53 15.034 73.418 -7.137 1.00 0.00 H
+ATOM 11405 HA SER Z 53 14.653 71.339 -4.996 1.00 0.00 H
+ATOM 11406 1HB SER Z 53 14.332 73.144 -3.442 1.00 0.00 H
+ATOM 11407 2HB SER Z 53 15.881 73.282 -4.227 1.00 0.00 H
+ATOM 11408 HG SER Z 53 13.611 74.571 -5.205 1.00 0.00 H
+ATOM 11409 N ALA Z 54 12.365 72.838 -6.636 1.00 66.15 N
+ATOM 11410 CA ALA Z 54 10.921 72.876 -6.820 1.00 63.92 C
+ATOM 11411 C ALA Z 54 10.564 72.657 -8.285 1.00 62.95 C
+ATOM 11412 O ALA Z 54 11.310 73.038 -9.191 1.00 61.66 O
+ATOM 11413 CB ALA Z 54 10.338 74.180 -6.297 1.00 62.74 C
+ATOM 11414 H ALA Z 54 12.994 73.193 -7.354 1.00 0.00 H
+ATOM 11415 HA ALA Z 54 10.486 72.068 -6.246 1.00 0.00 H
+ATOM 11416 1HB ALA Z 54 9.256 74.155 -6.418 1.00 0.00 H
+ATOM 11417 2HB ALA Z 54 10.583 74.283 -5.241 1.00 0.00 H
+ATOM 11418 3HB ALA Z 54 10.729 75.014 -6.819 1.00 0.00 H
+ATOM 11419 N ILE Z 55 9.399 72.050 -8.495 1.00 63.55 N
+ATOM 11420 CA ILE Z 55 8.862 71.799 -9.825 1.00 65.81 C
+ATOM 11421 C ILE Z 55 7.517 72.483 -10.015 1.00 67.72 C
+ATOM 11422 O ILE Z 55 6.591 72.307 -9.227 1.00 69.31 O
+ATOM 11423 CB ILE Z 55 8.725 70.283 -10.102 1.00 68.85 C
+ATOM 11424 CG1 ILE Z 55 10.122 69.605 -10.051 1.00 70.90 C
+ATOM 11425 CG2 ILE Z 55 8.060 70.063 -11.446 1.00 65.89 C
+ATOM 11426 CD1 ILE Z 55 10.085 68.081 -10.061 1.00 60.82 C
+ATOM 11427 H ILE Z 55 8.853 71.774 -7.685 1.00 0.00 H
+ATOM 11428 HA ILE Z 55 9.554 72.208 -10.556 1.00 0.00 H
+ATOM 11429 HB ILE Z 55 8.114 69.827 -9.326 1.00 0.00 H
+ATOM 11430 1HG1 ILE Z 55 10.702 69.941 -10.914 1.00 0.00 H
+ATOM 11431 2HG1 ILE Z 55 10.632 69.924 -9.157 1.00 0.00 H
+ATOM 11432 1HG2 ILE Z 55 7.959 68.997 -11.633 1.00 0.00 H
+ATOM 11433 2HG2 ILE Z 55 7.073 70.525 -11.451 1.00 0.00 H
+ATOM 11434 3HG2 ILE Z 55 8.676 70.518 -12.223 1.00 0.00 H
+ATOM 11435 1HD1 ILE Z 55 11.107 67.691 -10.021 1.00 0.00 H
+ATOM 11436 2HD1 ILE Z 55 9.528 67.721 -9.197 1.00 0.00 H
+ATOM 11437 3HD1 ILE Z 55 9.602 67.732 -10.971 1.00 0.00 H
+ATOM 11438 N LYS Z 56 7.416 73.281 -11.062 1.00 68.87 N
+ATOM 11439 CA LYS Z 56 6.181 73.991 -11.347 1.00 70.08 C
+ATOM 11440 C LYS Z 56 5.552 73.431 -12.614 1.00 70.21 C
+ATOM 11441 O LYS Z 56 6.239 73.225 -13.606 1.00 69.86 O
+ATOM 11442 CB LYS Z 56 6.476 75.482 -11.428 1.00 71.50 C
+ATOM 11443 CG LYS Z 56 5.321 76.379 -11.703 1.00 69.77 C
+ATOM 11444 CD LYS Z 56 5.803 77.821 -11.620 1.00 73.45 C
+ATOM 11445 CE LYS Z 56 4.710 78.816 -11.932 1.00 75.23 C
+ATOM 11446 NZ LYS Z 56 5.181 80.219 -11.736 1.00 58.03 N
+ATOM 11447 H LYS Z 56 8.224 73.397 -11.669 1.00 0.00 H
+ATOM 11448 HA LYS Z 56 5.482 73.830 -10.534 1.00 0.00 H
+ATOM 11449 1HB LYS Z 56 6.903 75.803 -10.483 1.00 0.00 H
+ATOM 11450 2HB LYS Z 56 7.216 75.658 -12.176 1.00 0.00 H
+ATOM 11451 1HG LYS Z 56 4.922 76.180 -12.701 1.00 0.00 H
+ATOM 11452 2HG LYS Z 56 4.532 76.207 -10.964 1.00 0.00 H
+ATOM 11453 1HD LYS Z 56 6.177 78.024 -10.607 1.00 0.00 H
+ATOM 11454 2HD LYS Z 56 6.622 77.969 -12.325 1.00 0.00 H
+ATOM 11455 1HE LYS Z 56 4.393 78.694 -12.969 1.00 0.00 H
+ATOM 11456 2HE LYS Z 56 3.863 78.632 -11.293 1.00 0.00 H
+ATOM 11457 1HZ LYS Z 56 4.423 80.855 -11.954 1.00 0.00 H
+ATOM 11458 2HZ LYS Z 56 5.488 80.366 -10.770 1.00 0.00 H
+ATOM 11459 3HZ LYS Z 56 5.960 80.402 -12.341 1.00 0.00 H
+ATOM 11460 N VAL Z 57 4.259 73.124 -12.568 1.00 70.72 N
+ATOM 11461 CA VAL Z 57 3.622 72.535 -13.738 1.00 73.56 C
+ATOM 11462 C VAL Z 57 2.502 73.422 -14.284 1.00 75.86 C
+ATOM 11463 O VAL Z 57 1.592 73.843 -13.557 1.00 77.09 O
+ATOM 11464 CB VAL Z 57 3.064 71.137 -13.396 1.00 67.69 C
+ATOM 11465 CG1 VAL Z 57 2.429 70.503 -14.653 1.00 67.16 C
+ATOM 11466 CG2 VAL Z 57 4.180 70.281 -12.826 1.00 69.87 C
+ATOM 11467 H VAL Z 57 3.728 73.290 -11.723 1.00 0.00 H
+ATOM 11468 HA VAL Z 57 4.371 72.415 -14.518 1.00 0.00 H
+ATOM 11469 HB VAL Z 57 2.274 71.235 -12.654 1.00 0.00 H
+ATOM 11470 1HG1 VAL Z 57 2.027 69.524 -14.409 1.00 0.00 H
+ATOM 11471 2HG1 VAL Z 57 1.623 71.136 -15.027 1.00 0.00 H
+ATOM 11472 3HG1 VAL Z 57 3.191 70.396 -15.429 1.00 0.00 H
+ATOM 11473 1HG2 VAL Z 57 3.796 69.298 -12.571 1.00 0.00 H
+ATOM 11474 2HG2 VAL Z 57 4.966 70.192 -13.568 1.00 0.00 H
+ATOM 11475 3HG2 VAL Z 57 4.579 70.753 -11.927 1.00 0.00 H
+ATOM 11476 N ARG Z 58 2.597 73.696 -15.587 1.00 76.96 N
+ATOM 11477 CA ARG Z 58 1.646 74.503 -16.344 1.00 76.26 C
+ATOM 11478 C ARG Z 58 0.937 73.691 -17.421 1.00 75.09 C
+ATOM 11479 O ARG Z 58 1.544 72.843 -18.073 1.00 74.07 O
+ATOM 11480 CB ARG Z 58 2.365 75.646 -17.035 1.00 81.28 C
+ATOM 11481 CG ARG Z 58 2.848 76.751 -16.155 1.00 93.23 C
+ATOM 11482 CD ARG Z 58 3.634 77.739 -16.936 1.00 98.64 C
+ATOM 11483 NE ARG Z 58 3.908 78.934 -16.181 1.00100.26 N
+ATOM 11484 CZ ARG Z 58 4.850 79.843 -16.508 1.00 98.15 C
+ATOM 11485 NH1 ARG Z 58 5.627 79.638 -17.551 1.00 95.68 N
+ATOM 11486 NH2 ARG Z 58 4.990 80.941 -15.787 1.00 96.59 N
+ATOM 11487 H ARG Z 58 3.401 73.324 -16.086 1.00 0.00 H
+ATOM 11488 HA ARG Z 58 0.900 74.903 -15.657 1.00 0.00 H
+ATOM 11489 1HB ARG Z 58 3.233 75.251 -17.547 1.00 0.00 H
+ATOM 11490 2HB ARG Z 58 1.712 76.084 -17.789 1.00 0.00 H
+ATOM 11491 1HG ARG Z 58 1.995 77.258 -15.716 1.00 0.00 H
+ATOM 11492 2HG ARG Z 58 3.482 76.348 -15.363 1.00 0.00 H
+ATOM 11493 1HD ARG Z 58 4.583 77.299 -17.225 1.00 0.00 H
+ATOM 11494 2HD ARG Z 58 3.082 78.023 -17.827 1.00 0.00 H
+ATOM 11495 HE ARG Z 58 3.306 79.120 -15.368 1.00 0.00 H
+ATOM 11496 1HH1 ARG Z 58 5.520 78.798 -18.104 1.00 0.00 H
+ATOM 11497 2HH1 ARG Z 58 6.330 80.318 -17.798 1.00 0.00 H
+ATOM 11498 1HH2 ARG Z 58 4.375 81.110 -15.006 1.00 0.00 H
+ATOM 11499 2HH2 ARG Z 58 5.692 81.624 -16.037 1.00 0.00 H
+ATOM 11500 N GLY Z 59 -0.331 74.000 -17.665 1.00 73.43 N
+ATOM 11501 CA GLY Z 59 -1.082 73.292 -18.699 1.00 72.89 C
+ATOM 11502 C GLY Z 59 -1.822 72.133 -18.063 1.00 74.21 C
+ATOM 11503 O GLY Z 59 -1.593 71.815 -16.894 1.00 73.76 O
+ATOM 11504 H GLY Z 59 -0.793 74.710 -17.109 1.00 0.00 H
+ATOM 11505 1HA GLY Z 59 -1.789 73.964 -19.185 1.00 0.00 H
+ATOM 11506 2HA GLY Z 59 -0.405 72.923 -19.469 1.00 0.00 H
+ATOM 11507 N LYS Z 60 -2.722 71.509 -18.809 1.00 75.05 N
+ATOM 11508 CA LYS Z 60 -3.499 70.427 -18.226 1.00 76.54 C
+ATOM 11509 C LYS Z 60 -2.642 69.174 -18.143 1.00 77.40 C
+ATOM 11510 O LYS Z 60 -2.154 68.684 -19.170 1.00 77.62 O
+ATOM 11511 CB LYS Z 60 -4.755 70.164 -19.046 1.00 81.46 C
+ATOM 11512 CG LYS Z 60 -5.730 69.201 -18.422 1.00 87.11 C
+ATOM 11513 CD LYS Z 60 -6.938 68.989 -19.328 1.00 89.33 C
+ATOM 11514 CE LYS Z 60 -7.902 67.964 -18.760 1.00 91.19 C
+ATOM 11515 NZ LYS Z 60 -9.097 67.792 -19.638 1.00 93.69 N
+ATOM 11516 H LYS Z 60 -2.889 71.802 -19.773 1.00 0.00 H
+ATOM 11517 HA LYS Z 60 -3.787 70.708 -17.224 1.00 0.00 H
+ATOM 11518 1HB LYS Z 60 -5.263 71.106 -19.257 1.00 0.00 H
+ATOM 11519 2HB LYS Z 60 -4.469 69.729 -19.998 1.00 0.00 H
+ATOM 11520 1HG LYS Z 60 -5.247 68.272 -18.230 1.00 0.00 H
+ATOM 11521 2HG LYS Z 60 -6.066 69.614 -17.466 1.00 0.00 H
+ATOM 11522 1HD LYS Z 60 -7.465 69.933 -19.468 1.00 0.00 H
+ATOM 11523 2HD LYS Z 60 -6.590 68.639 -20.302 1.00 0.00 H
+ATOM 11524 1HE LYS Z 60 -7.387 67.009 -18.673 1.00 0.00 H
+ATOM 11525 2HE LYS Z 60 -8.228 68.281 -17.770 1.00 0.00 H
+ATOM 11526 1HZ LYS Z 60 -9.716 67.101 -19.240 1.00 0.00 H
+ATOM 11527 2HZ LYS Z 60 -9.585 68.672 -19.719 1.00 0.00 H
+ATOM 11528 3HZ LYS Z 60 -8.798 67.488 -20.554 1.00 0.00 H
+ATOM 11529 N ALA Z 61 -2.468 68.648 -16.939 1.00 76.36 N
+ATOM 11530 CA ALA Z 61 -1.594 67.488 -16.774 1.00 76.10 C
+ATOM 11531 C ALA Z 61 -1.966 66.646 -15.565 1.00 75.42 C
+ATOM 11532 O ALA Z 61 -2.531 67.144 -14.592 1.00 74.97 O
+ATOM 11533 CB ALA Z 61 -0.152 67.941 -16.658 1.00 67.03 C
+ATOM 11534 H ALA Z 61 -2.933 69.087 -16.141 1.00 0.00 H
+ATOM 11535 HA ALA Z 61 -1.683 66.875 -17.661 1.00 0.00 H
+ATOM 11536 1HB ALA Z 61 0.496 67.069 -16.586 1.00 0.00 H
+ATOM 11537 2HB ALA Z 61 0.096 68.510 -17.539 1.00 0.00 H
+ATOM 11538 3HB ALA Z 61 -0.023 68.559 -15.780 1.00 0.00 H
+ATOM 11539 N TYR Z 62 -1.615 65.366 -15.619 1.00 73.66 N
+ATOM 11540 CA TYR Z 62 -1.848 64.478 -14.488 1.00 72.97 C
+ATOM 11541 C TYR Z 62 -0.533 64.281 -13.757 1.00 71.22 C
+ATOM 11542 O TYR Z 62 0.462 63.888 -14.375 1.00 70.70 O
+ATOM 11543 CB TYR Z 62 -2.412 63.137 -14.962 1.00 76.90 C
+ATOM 11544 CG TYR Z 62 -2.898 62.231 -13.856 1.00 83.10 C
+ATOM 11545 CD1 TYR Z 62 -4.233 62.295 -13.504 1.00 86.94 C
+ATOM 11546 CD2 TYR Z 62 -2.050 61.347 -13.198 1.00 84.63 C
+ATOM 11547 CE1 TYR Z 62 -4.737 61.493 -12.513 1.00 89.00 C
+ATOM 11548 CE2 TYR Z 62 -2.567 60.533 -12.195 1.00 87.65 C
+ATOM 11549 CZ TYR Z 62 -3.907 60.610 -11.860 1.00 89.96 C
+ATOM 11550 OH TYR Z 62 -4.430 59.804 -10.878 1.00 90.49 O
+ATOM 11551 H TYR Z 62 -1.155 65.020 -16.461 1.00 0.00 H
+ATOM 11552 HA TYR Z 62 -2.552 64.945 -13.795 1.00 0.00 H
+ATOM 11553 1HB TYR Z 62 -3.236 63.308 -15.636 1.00 0.00 H
+ATOM 11554 2HB TYR Z 62 -1.653 62.605 -15.516 1.00 0.00 H
+ATOM 11555 HD1 TYR Z 62 -4.897 62.986 -14.024 1.00 0.00 H
+ATOM 11556 HD2 TYR Z 62 -0.995 61.290 -13.468 1.00 0.00 H
+ATOM 11557 HE1 TYR Z 62 -5.794 61.555 -12.251 1.00 0.00 H
+ATOM 11558 HE2 TYR Z 62 -1.927 59.837 -11.675 1.00 0.00 H
+ATOM 11559 HH TYR Z 62 -3.752 59.207 -10.559 1.00 0.00 H
+ATOM 11560 N ILE Z 63 -0.495 64.573 -12.459 1.00 69.10 N
+ATOM 11561 CA ILE Z 63 0.747 64.454 -11.711 1.00 67.65 C
+ATOM 11562 C ILE Z 63 0.664 63.460 -10.544 1.00 67.67 C
+ATOM 11563 O ILE Z 63 -0.216 63.559 -9.683 1.00 68.74 O
+ATOM 11564 CB ILE Z 63 1.190 65.818 -11.153 1.00 63.66 C
+ATOM 11565 CG1 ILE Z 63 1.306 66.856 -12.278 1.00 68.13 C
+ATOM 11566 CG2 ILE Z 63 2.534 65.655 -10.446 1.00 59.76 C
+ATOM 11567 CD1 ILE Z 63 0.054 67.706 -12.456 1.00 66.79 C
+ATOM 11568 H ILE Z 63 -1.325 64.909 -11.978 1.00 0.00 H
+ATOM 11569 HA ILE Z 63 1.511 64.117 -12.391 1.00 0.00 H
+ATOM 11570 HB ILE Z 63 0.453 66.177 -10.463 1.00 0.00 H
+ATOM 11571 1HG1 ILE Z 63 2.140 67.517 -12.063 1.00 0.00 H
+ATOM 11572 2HG1 ILE Z 63 1.504 66.339 -13.209 1.00 0.00 H
+ATOM 11573 1HG2 ILE Z 63 2.847 66.603 -10.045 1.00 0.00 H
+ATOM 11574 2HG2 ILE Z 63 2.429 64.938 -9.644 1.00 0.00 H
+ATOM 11575 3HG2 ILE Z 63 3.278 65.292 -11.148 1.00 0.00 H
+ATOM 11576 1HD1 ILE Z 63 0.202 68.413 -13.268 1.00 0.00 H
+ATOM 11577 2HD1 ILE Z 63 -0.795 67.067 -12.691 1.00 0.00 H
+ATOM 11578 3HD1 ILE Z 63 -0.156 68.251 -11.539 1.00 0.00 H
+ATOM 11579 N GLN Z 64 1.587 62.500 -10.508 1.00 66.33 N
+ATOM 11580 CA GLN Z 64 1.627 61.566 -9.390 1.00 61.89 C
+ATOM 11581 C GLN Z 64 2.795 61.957 -8.504 1.00 61.02 C
+ATOM 11582 O GLN Z 64 3.906 62.186 -9.004 1.00 60.35 O
+ATOM 11583 CB GLN Z 64 1.847 60.123 -9.855 1.00 46.59 C
+ATOM 11584 CG GLN Z 64 0.823 59.604 -10.839 1.00 47.85 C
+ATOM 11585 CD GLN Z 64 1.139 58.210 -11.365 1.00 44.64 C
+ATOM 11586 OE1 GLN Z 64 2.300 57.791 -11.411 1.00 51.63 O
+ATOM 11587 NE2 GLN Z 64 0.085 57.501 -11.764 1.00 45.21 N
+ATOM 11588 H GLN Z 64 2.270 62.443 -11.258 1.00 0.00 H
+ATOM 11589 HA GLN Z 64 0.711 61.643 -8.807 1.00 0.00 H
+ATOM 11590 1HB GLN Z 64 2.831 59.999 -10.233 1.00 0.00 H
+ATOM 11591 2HB GLN Z 64 1.771 59.477 -8.983 1.00 0.00 H
+ATOM 11592 1HG GLN Z 64 -0.133 59.555 -10.353 1.00 0.00 H
+ATOM 11593 2HG GLN Z 64 0.779 60.284 -11.689 1.00 0.00 H
+ATOM 11594 1HE2 GLN Z 64 0.173 56.564 -12.146 1.00 0.00 H
+ATOM 11595 2HE2 GLN Z 64 -0.828 57.887 -11.700 1.00 0.00 H
+ATOM 11596 N THR Z 65 2.561 62.047 -7.202 1.00 60.63 N
+ATOM 11597 CA THR Z 65 3.623 62.386 -6.268 1.00 60.60 C
+ATOM 11598 C THR Z 65 3.571 61.458 -5.067 1.00 61.44 C
+ATOM 11599 O THR Z 65 2.645 60.667 -4.894 1.00 62.09 O
+ATOM 11600 CB THR Z 65 3.536 63.831 -5.720 1.00 64.94 C
+ATOM 11601 OG1 THR Z 65 2.449 63.926 -4.789 1.00 60.39 O
+ATOM 11602 CG2 THR Z 65 3.317 64.838 -6.845 1.00 63.16 C
+ATOM 11603 H THR Z 65 1.625 61.870 -6.840 1.00 0.00 H
+ATOM 11604 HA THR Z 65 4.586 62.251 -6.760 1.00 0.00 H
+ATOM 11605 HB THR Z 65 4.461 64.072 -5.214 1.00 0.00 H
+ATOM 11606 HG1 THR Z 65 2.396 63.110 -4.281 1.00 0.00 H
+ATOM 11607 1HG2 THR Z 65 3.268 65.840 -6.433 1.00 0.00 H
+ATOM 11608 2HG2 THR Z 65 4.140 64.780 -7.554 1.00 0.00 H
+ATOM 11609 3HG2 THR Z 65 2.384 64.614 -7.353 1.00 0.00 H
+ATOM 11610 N ARG Z 66 4.532 61.634 -4.186 1.00 61.47 N
+ATOM 11611 CA ARG Z 66 4.592 60.917 -2.922 1.00 63.65 C
+ATOM 11612 C ARG Z 66 3.366 61.130 -2.034 1.00 64.80 C
+ATOM 11613 O ARG Z 66 3.127 60.340 -1.121 1.00 63.09 O
+ATOM 11614 CB ARG Z 66 5.880 61.295 -2.206 1.00 68.23 C
+ATOM 11615 CG ARG Z 66 6.144 60.705 -0.838 1.00 69.69 C
+ATOM 11616 CD ARG Z 66 7.609 60.864 -0.537 1.00 68.94 C
+ATOM 11617 NE ARG Z 66 8.007 60.514 0.819 1.00 74.84 N
+ATOM 11618 CZ ARG Z 66 8.239 61.437 1.765 1.00 77.09 C
+ATOM 11619 NH1 ARG Z 66 8.631 61.133 2.975 1.00 75.97 N
+ATOM 11620 NH2 ARG Z 66 8.102 62.698 1.468 1.00 71.10 N
+ATOM 11621 H ARG Z 66 5.266 62.290 -4.403 1.00 0.00 H
+ATOM 11622 HA ARG Z 66 4.650 59.851 -3.153 1.00 0.00 H
+ATOM 11623 1HB ARG Z 66 6.735 61.042 -2.837 1.00 0.00 H
+ATOM 11624 2HB ARG Z 66 5.881 62.368 -2.054 1.00 0.00 H
+ATOM 11625 1HG ARG Z 66 5.563 61.257 -0.096 1.00 0.00 H
+ATOM 11626 2HG ARG Z 66 5.876 59.648 -0.813 1.00 0.00 H
+ATOM 11627 1HD ARG Z 66 8.183 60.244 -1.217 1.00 0.00 H
+ATOM 11628 2HD ARG Z 66 7.885 61.908 -0.704 1.00 0.00 H
+ATOM 11629 HE ARG Z 66 8.130 59.539 1.055 1.00 0.00 H
+ATOM 11630 1HH1 ARG Z 66 8.769 60.175 3.253 1.00 0.00 H
+ATOM 11631 2HH1 ARG Z 66 8.832 61.921 3.613 1.00 0.00 H
+ATOM 11632 1HH2 ARG Z 66 7.821 62.980 0.540 1.00 0.00 H
+ATOM 11633 2HH2 ARG Z 66 8.326 63.385 2.188 1.00 0.00 H
+ATOM 11634 N HIS Z 67 2.595 62.206 -2.265 1.00 64.54 N
+ATOM 11635 CA HIS Z 67 1.460 62.469 -1.393 1.00 66.67 C
+ATOM 11636 C HIS Z 67 0.117 62.119 -2.037 1.00 67.38 C
+ATOM 11637 O HIS Z 67 -0.936 62.500 -1.523 1.00 68.17 O
+ATOM 11638 CB HIS Z 67 1.435 63.942 -0.989 1.00 61.99 C
+ATOM 11639 CG HIS Z 67 2.675 64.381 -0.314 1.00 56.21 C
+ATOM 11640 ND1 HIS Z 67 3.303 63.632 0.655 1.00 58.86 N
+ATOM 11641 CD2 HIS Z 67 3.395 65.511 -0.442 1.00 53.38 C
+ATOM 11642 CE1 HIS Z 67 4.371 64.280 1.073 1.00 49.06 C
+ATOM 11643 NE2 HIS Z 67 4.436 65.421 0.427 1.00 59.72 N
+ATOM 11644 H HIS Z 67 2.769 62.830 -3.050 1.00 0.00 H
+ATOM 11645 HA HIS Z 67 1.551 61.871 -0.488 1.00 0.00 H
+ATOM 11646 1HB HIS Z 67 1.282 64.564 -1.873 1.00 0.00 H
+ATOM 11647 2HB HIS Z 67 0.601 64.118 -0.308 1.00 0.00 H
+ATOM 11648 HD2 HIS Z 67 3.187 66.345 -1.102 1.00 0.00 H
+ATOM 11649 HE1 HIS Z 67 5.072 63.935 1.838 1.00 0.00 H
+ATOM 11650 HE2 HIS Z 67 5.136 66.142 0.547 1.00 0.00 H
+ATOM 11651 N GLY Z 68 0.140 61.407 -3.168 1.00 67.66 N
+ATOM 11652 CA GLY Z 68 -1.108 61.084 -3.861 1.00 69.34 C
+ATOM 11653 C GLY Z 68 -1.057 61.593 -5.293 1.00 70.60 C
+ATOM 11654 O GLY Z 68 0.015 61.692 -5.889 1.00 70.16 O
+ATOM 11655 H GLY Z 68 1.024 61.094 -3.565 1.00 0.00 H
+ATOM 11656 1HA GLY Z 68 -1.263 60.003 -3.850 1.00 0.00 H
+ATOM 11657 2HA GLY Z 68 -1.948 61.540 -3.340 1.00 0.00 H
+ATOM 11658 N VAL Z 69 -2.224 61.868 -5.870 1.00 70.64 N
+ATOM 11659 CA VAL Z 69 -2.256 62.354 -7.243 1.00 73.07 C
+ATOM 11660 C VAL Z 69 -2.993 63.672 -7.318 1.00 75.91 C
+ATOM 11661 O VAL Z 69 -3.880 63.949 -6.502 1.00 75.46 O
+ATOM 11662 CB VAL Z 69 -2.934 61.336 -8.167 1.00 74.98 C
+ATOM 11663 CG1 VAL Z 69 -2.143 60.041 -8.177 1.00 71.96 C
+ATOM 11664 CG2 VAL Z 69 -4.353 61.115 -7.690 1.00 76.35 C
+ATOM 11665 H VAL Z 69 -3.083 61.760 -5.350 1.00 0.00 H
+ATOM 11666 HA VAL Z 69 -1.235 62.511 -7.590 1.00 0.00 H
+ATOM 11667 HB VAL Z 69 -2.940 61.732 -9.184 1.00 0.00 H
+ATOM 11668 1HG1 VAL Z 69 -2.615 59.333 -8.852 1.00 0.00 H
+ATOM 11669 2HG1 VAL Z 69 -1.138 60.245 -8.512 1.00 0.00 H
+ATOM 11670 3HG1 VAL Z 69 -2.105 59.616 -7.179 1.00 0.00 H
+ATOM 11671 1HG2 VAL Z 69 -4.851 60.408 -8.347 1.00 0.00 H
+ATOM 11672 2HG2 VAL Z 69 -4.342 60.722 -6.673 1.00 0.00 H
+ATOM 11673 3HG2 VAL Z 69 -4.889 62.066 -7.707 1.00 0.00 H
+ATOM 11674 N ILE Z 70 -2.625 64.482 -8.299 1.00 76.75 N
+ATOM 11675 CA ILE Z 70 -3.235 65.785 -8.480 1.00 79.00 C
+ATOM 11676 C ILE Z 70 -3.252 66.159 -9.961 1.00 80.84 C
+ATOM 11677 O ILE Z 70 -2.361 65.762 -10.707 1.00 81.64 O
+ATOM 11678 CB ILE Z 70 -2.438 66.829 -7.675 1.00 76.50 C
+ATOM 11679 CG1 ILE Z 70 -3.198 68.117 -7.569 1.00 75.60 C
+ATOM 11680 CG2 ILE Z 70 -1.083 67.059 -8.325 1.00 72.67 C
+ATOM 11681 CD1 ILE Z 70 -2.613 69.050 -6.571 1.00 71.29 C
+ATOM 11682 H ILE Z 70 -1.869 64.191 -8.917 1.00 0.00 H
+ATOM 11683 HA ILE Z 70 -4.263 65.747 -8.117 1.00 0.00 H
+ATOM 11684 HB ILE Z 70 -2.283 66.460 -6.659 1.00 0.00 H
+ATOM 11685 1HG1 ILE Z 70 -3.233 68.617 -8.533 1.00 0.00 H
+ATOM 11686 2HG1 ILE Z 70 -4.216 67.885 -7.254 1.00 0.00 H
+ATOM 11687 1HG2 ILE Z 70 -0.517 67.777 -7.748 1.00 0.00 H
+ATOM 11688 2HG2 ILE Z 70 -0.542 66.108 -8.360 1.00 0.00 H
+ATOM 11689 3HG2 ILE Z 70 -1.230 67.439 -9.335 1.00 0.00 H
+ATOM 11690 1HD1 ILE Z 70 -3.230 69.919 -6.522 1.00 0.00 H
+ATOM 11691 2HD1 ILE Z 70 -2.583 68.572 -5.591 1.00 0.00 H
+ATOM 11692 3HD1 ILE Z 70 -1.603 69.321 -6.877 1.00 0.00 H
+ATOM 11693 N GLU Z 71 -4.250 66.920 -10.396 1.00 81.74 N
+ATOM 11694 CA GLU Z 71 -4.221 67.401 -11.775 1.00 80.70 C
+ATOM 11695 C GLU Z 71 -4.008 68.909 -11.822 1.00 80.42 C
+ATOM 11696 O GLU Z 71 -4.543 69.645 -10.986 1.00 79.38 O
+ATOM 11697 CB GLU Z 71 -5.512 67.052 -12.527 1.00 74.85 C
+ATOM 11698 CG GLU Z 71 -5.744 65.570 -12.740 1.00 81.11 C
+ATOM 11699 CD GLU Z 71 -7.011 65.269 -13.520 1.00 85.13 C
+ATOM 11700 OE1 GLU Z 71 -7.733 66.186 -13.829 1.00 87.23 O
+ATOM 11701 OE2 GLU Z 71 -7.249 64.118 -13.807 1.00 75.28 O
+ATOM 11702 H GLU Z 71 -4.996 67.191 -9.771 1.00 0.00 H
+ATOM 11703 HA GLU Z 71 -3.389 66.931 -12.293 1.00 0.00 H
+ATOM 11704 1HB GLU Z 71 -6.368 67.469 -12.003 1.00 0.00 H
+ATOM 11705 2HB GLU Z 71 -5.476 67.515 -13.517 1.00 0.00 H
+ATOM 11706 1HG GLU Z 71 -4.898 65.181 -13.292 1.00 0.00 H
+ATOM 11707 2HG GLU Z 71 -5.782 65.067 -11.777 1.00 0.00 H
+ATOM 11708 N SER Z 72 -3.243 69.353 -12.822 1.00 81.54 N
+ATOM 11709 CA SER Z 72 -2.997 70.775 -13.069 1.00 82.48 C
+ATOM 11710 C SER Z 72 -3.873 71.250 -14.215 1.00 82.41 C
+ATOM 11711 O SER Z 72 -4.344 70.424 -15.004 1.00 79.69 O
+ATOM 11712 CB SER Z 72 -1.540 71.014 -13.416 1.00 80.35 C
+ATOM 11713 OG SER Z 72 -1.213 70.411 -14.631 1.00 78.03 O
+ATOM 11714 H SER Z 72 -2.844 68.662 -13.453 1.00 0.00 H
+ATOM 11715 HA SER Z 72 -3.253 71.348 -12.177 1.00 0.00 H
+ATOM 11716 1HB SER Z 72 -1.332 72.086 -13.464 1.00 0.00 H
+ATOM 11717 2HB SER Z 72 -0.917 70.596 -12.633 1.00 0.00 H
+ATOM 11718 HG SER Z 72 -1.487 71.030 -15.345 1.00 0.00 H
+ATOM 11719 N GLU Z 73 -4.059 72.569 -14.314 1.00 84.04 N
+ATOM 11720 CA GLU Z 73 -4.841 73.182 -15.392 1.00 87.55 C
+ATOM 11721 C GLU Z 73 -4.127 74.410 -15.972 1.00 88.53 C
+ATOM 11722 O GLU Z 73 -3.255 74.994 -15.331 1.00 89.47 O
+ATOM 11723 CB GLU Z 73 -6.241 73.574 -14.886 1.00 93.55 C
+ATOM 11724 CG GLU Z 73 -7.081 72.414 -14.363 1.00 94.59 C
+ATOM 11725 CD GLU Z 73 -8.456 72.831 -13.899 1.00 96.15 C
+ATOM 11726 OE1 GLU Z 73 -9.184 71.990 -13.431 1.00 97.84 O
+ATOM 11727 OE2 GLU Z 73 -8.770 73.991 -14.002 1.00 98.71 O
+ATOM 11728 H GLU Z 73 -3.638 73.173 -13.613 1.00 0.00 H
+ATOM 11729 HA GLU Z 73 -4.958 72.458 -16.194 1.00 0.00 H
+ATOM 11730 1HB GLU Z 73 -6.156 74.291 -14.091 1.00 0.00 H
+ATOM 11731 2HB GLU Z 73 -6.797 74.049 -15.695 1.00 0.00 H
+ATOM 11732 1HG GLU Z 73 -7.175 71.664 -15.146 1.00 0.00 H
+ATOM 11733 2HG GLU Z 73 -6.559 71.958 -13.524 1.00 0.00 H
+ATOM 11734 N GLY Z 74 -4.489 74.790 -17.194 1.00 90.20 N
+ATOM 11735 CA GLY Z 74 -3.927 75.987 -17.810 1.00 91.65 C
+ATOM 11736 C GLY Z 74 -4.904 76.615 -18.794 1.00 93.23 C
+ATOM 11737 O GLY Z 74 -4.524 77.473 -19.588 1.00 93.88 O
+ATOM 11738 OXT GLY Z 74 -6.104 76.368 -18.690 1.00 0.00 O
+ATOM 11739 H GLY Z 74 -5.188 74.256 -17.691 1.00 0.00 H
+ATOM 11740 1HA GLY Z 74 -3.677 76.711 -17.034 1.00 0.00 H
+ATOM 11741 2HA GLY Z 74 -3.001 75.740 -18.323 1.00 0.00 H
+TER
+ATOM 11743 N GLU H 1 8.731 109.618 5.227 1.00 32.18 N
+ATOM 11744 CA GLU H 1 8.190 109.171 6.505 1.00 32.48 C
+ATOM 11745 C GLU H 1 6.795 108.613 6.336 1.00 31.92 C
+ATOM 11746 O GLU H 1 5.945 109.214 5.673 1.00 32.22 O
+ATOM 11747 CB GLU H 1 8.174 110.315 7.527 1.00 33.04 C
+ATOM 11748 CG GLU H 1 7.726 109.897 8.939 1.00 35.19 C
+ATOM 11749 CD GLU H 1 7.755 111.031 9.940 1.00 39.72 C
+ATOM 11750 OE1 GLU H 1 7.606 110.778 11.113 1.00 40.25 O
+ATOM 11751 OE2 GLU H 1 7.917 112.148 9.528 1.00 42.30 O
+ATOM 11752 1H GLU H 1 9.645 110.021 5.369 1.00 0.00 H
+ATOM 11753 2H GLU H 1 8.805 108.827 4.602 1.00 0.00 H
+ATOM 11754 3H GLU H 1 8.115 110.309 4.823 1.00 0.00 H
+ATOM 11755 HA GLU H 1 8.826 108.373 6.887 1.00 0.00 H
+ATOM 11756 1HB GLU H 1 9.171 110.746 7.605 1.00 0.00 H
+ATOM 11757 2HB GLU H 1 7.503 111.097 7.181 1.00 0.00 H
+ATOM 11758 1HG GLU H 1 6.706 109.515 8.886 1.00 0.00 H
+ATOM 11759 2HG GLU H 1 8.368 109.094 9.281 1.00 0.00 H
+ATOM 11760 N VAL H 2 6.558 107.453 6.926 1.00 30.85 N
+ATOM 11761 CA VAL H 2 5.264 106.795 6.857 1.00 30.21 C
+ATOM 11762 C VAL H 2 4.155 107.611 7.476 1.00 29.76 C
+ATOM 11763 O VAL H 2 4.293 108.139 8.585 1.00 30.01 O
+ATOM 11764 CB VAL H 2 5.330 105.425 7.513 1.00 30.36 C
+ATOM 11765 CG1 VAL H 2 3.942 104.823 7.629 1.00 30.19 C
+ATOM 11766 CG2 VAL H 2 6.226 104.563 6.686 1.00 30.21 C
+ATOM 11767 H VAL H 2 7.298 107.005 7.454 1.00 0.00 H
+ATOM 11768 HA VAL H 2 5.020 106.645 5.807 1.00 0.00 H
+ATOM 11769 HB VAL H 2 5.731 105.518 8.481 1.00 0.00 H
+ATOM 11770 1HG1 VAL H 2 4.001 103.852 8.092 1.00 0.00 H
+ATOM 11771 2HG1 VAL H 2 3.314 105.468 8.242 1.00 0.00 H
+ATOM 11772 3HG1 VAL H 2 3.518 104.740 6.652 1.00 0.00 H
+ATOM 11773 1HG2 VAL H 2 6.306 103.592 7.142 1.00 0.00 H
+ATOM 11774 2HG2 VAL H 2 5.810 104.468 5.681 1.00 0.00 H
+ATOM 11775 3HG2 VAL H 2 7.211 105.021 6.631 1.00 0.00 H
+ATOM 11776 N GLN H 3 3.051 107.706 6.757 1.00 28.62 N
+ATOM 11777 CA GLN H 3 1.921 108.499 7.176 1.00 27.16 C
+ATOM 11778 C GLN H 3 0.595 107.818 6.867 1.00 25.79 C
+ATOM 11779 O GLN H 3 0.356 107.349 5.749 1.00 24.79 O
+ATOM 11780 CB GLN H 3 1.970 109.868 6.495 1.00 27.74 C
+ATOM 11781 CG GLN H 3 0.884 110.861 6.912 1.00 29.34 C
+ATOM 11782 CD GLN H 3 1.187 111.528 8.247 1.00 31.63 C
+ATOM 11783 OE1 GLN H 3 0.384 111.529 9.183 1.00 32.01 O
+ATOM 11784 NE2 GLN H 3 2.375 112.116 8.335 1.00 30.72 N
+ATOM 11785 H GLN H 3 3.029 107.236 5.848 1.00 0.00 H
+ATOM 11786 HA GLN H 3 1.978 108.637 8.264 1.00 0.00 H
+ATOM 11787 1HB GLN H 3 2.937 110.329 6.702 1.00 0.00 H
+ATOM 11788 2HB GLN H 3 1.907 109.733 5.419 1.00 0.00 H
+ATOM 11789 1HG GLN H 3 0.791 111.634 6.152 1.00 0.00 H
+ATOM 11790 2HG GLN H 3 -0.054 110.327 7.014 1.00 0.00 H
+ATOM 11791 1HE2 GLN H 3 2.644 112.576 9.180 1.00 0.00 H
+ATOM 11792 2HE2 GLN H 3 3.003 112.099 7.555 1.00 0.00 H
+ATOM 11793 N LEU H 4 -0.249 107.729 7.881 1.00 24.41 N
+ATOM 11794 CA LEU H 4 -1.599 107.209 7.753 1.00 23.26 C
+ATOM 11795 C LEU H 4 -2.552 108.365 7.969 1.00 23.19 C
+ATOM 11796 O LEU H 4 -2.446 109.066 8.978 1.00 23.32 O
+ATOM 11797 CB LEU H 4 -1.831 106.102 8.790 1.00 22.89 C
+ATOM 11798 CG LEU H 4 -0.936 104.867 8.644 1.00 22.07 C
+ATOM 11799 CD1 LEU H 4 -1.173 103.922 9.784 1.00 23.31 C
+ATOM 11800 CD2 LEU H 4 -1.252 104.190 7.337 1.00 19.85 C
+ATOM 11801 H LEU H 4 0.042 108.102 8.774 1.00 0.00 H
+ATOM 11802 HA LEU H 4 -1.747 106.807 6.750 1.00 0.00 H
+ATOM 11803 1HB LEU H 4 -1.653 106.518 9.780 1.00 0.00 H
+ATOM 11804 2HB LEU H 4 -2.860 105.789 8.740 1.00 0.00 H
+ATOM 11805 HG LEU H 4 0.114 105.168 8.666 1.00 0.00 H
+ATOM 11806 1HD1 LEU H 4 -0.531 103.048 9.673 1.00 0.00 H
+ATOM 11807 2HD1 LEU H 4 -0.944 104.427 10.726 1.00 0.00 H
+ATOM 11808 3HD1 LEU H 4 -2.214 103.611 9.783 1.00 0.00 H
+ATOM 11809 1HD2 LEU H 4 -0.628 103.329 7.243 1.00 0.00 H
+ATOM 11810 2HD2 LEU H 4 -2.297 103.884 7.327 1.00 0.00 H
+ATOM 11811 3HD2 LEU H 4 -1.069 104.876 6.510 1.00 0.00 H
+ATOM 11812 N VAL H 5 -3.450 108.611 7.024 1.00 22.80 N
+ATOM 11813 CA VAL H 5 -4.326 109.761 7.159 1.00 22.27 C
+ATOM 11814 C VAL H 5 -5.788 109.397 7.257 1.00 21.60 C
+ATOM 11815 O VAL H 5 -6.403 108.974 6.273 1.00 20.95 O
+ATOM 11816 CB VAL H 5 -4.152 110.691 5.957 1.00 22.45 C
+ATOM 11817 CG1 VAL H 5 -5.061 111.906 6.109 1.00 22.87 C
+ATOM 11818 CG2 VAL H 5 -2.683 111.076 5.833 1.00 22.92 C
+ATOM 11819 H VAL H 5 -3.503 108.010 6.202 1.00 0.00 H
+ATOM 11820 HA VAL H 5 -4.059 110.295 8.068 1.00 0.00 H
+ATOM 11821 HB VAL H 5 -4.458 110.176 5.064 1.00 0.00 H
+ATOM 11822 1HG1 VAL H 5 -4.950 112.560 5.243 1.00 0.00 H
+ATOM 11823 2HG1 VAL H 5 -6.103 111.578 6.188 1.00 0.00 H
+ATOM 11824 3HG1 VAL H 5 -4.790 112.451 7.011 1.00 0.00 H
+ATOM 11825 1HG2 VAL H 5 -2.549 111.723 4.972 1.00 0.00 H
+ATOM 11826 2HG2 VAL H 5 -2.364 111.594 6.739 1.00 0.00 H
+ATOM 11827 3HG2 VAL H 5 -2.085 110.169 5.701 1.00 0.00 H
+ATOM 11828 N GLU H 6 -6.345 109.558 8.453 1.00 21.17 N
+ATOM 11829 CA GLU H 6 -7.737 109.184 8.661 1.00 20.70 C
+ATOM 11830 C GLU H 6 -8.676 110.292 8.194 1.00 20.16 C
+ATOM 11831 O GLU H 6 -8.358 111.480 8.317 1.00 19.81 O
+ATOM 11832 CB GLU H 6 -8.054 108.844 10.126 1.00 21.01 C
+ATOM 11833 CG GLU H 6 -7.315 107.686 10.727 1.00 22.63 C
+ATOM 11834 CD GLU H 6 -6.174 108.149 11.550 1.00 25.73 C
+ATOM 11835 OE1 GLU H 6 -5.607 107.370 12.266 1.00 22.91 O
+ATOM 11836 OE2 GLU H 6 -5.883 109.305 11.509 1.00 27.25 O
+ATOM 11837 H GLU H 6 -5.796 109.938 9.214 1.00 0.00 H
+ATOM 11838 HA GLU H 6 -7.932 108.303 8.075 1.00 0.00 H
+ATOM 11839 1HB GLU H 6 -7.804 109.706 10.744 1.00 0.00 H
+ATOM 11840 2HB GLU H 6 -9.124 108.650 10.238 1.00 0.00 H
+ATOM 11841 1HG GLU H 6 -7.999 107.107 11.348 1.00 0.00 H
+ATOM 11842 2HG GLU H 6 -6.958 107.048 9.920 1.00 0.00 H
+ATOM 11843 N SER H 7 -9.866 109.899 7.740 1.00 19.46 N
+ATOM 11844 CA SER H 7 -10.908 110.878 7.422 1.00 19.36 C
+ATOM 11845 C SER H 7 -12.309 110.259 7.419 1.00 18.64 C
+ATOM 11846 O SER H 7 -12.473 109.038 7.436 1.00 18.84 O
+ATOM 11847 CB SER H 7 -10.626 111.561 6.085 1.00 19.39 C
+ATOM 11848 OG SER H 7 -10.745 110.671 5.017 1.00 20.60 O
+ATOM 11849 H SER H 7 -10.025 108.905 7.615 1.00 0.00 H
+ATOM 11850 HA SER H 7 -10.886 111.643 8.196 1.00 0.00 H
+ATOM 11851 1HB SER H 7 -11.324 112.389 5.953 1.00 0.00 H
+ATOM 11852 2HB SER H 7 -9.622 111.992 6.088 1.00 0.00 H
+ATOM 11853 HG SER H 7 -9.986 110.085 5.081 1.00 0.00 H
+ATOM 11854 N GLY H 9 -13.335 111.114 7.380 1.00 18.00 N
+ATOM 11855 CA GLY H 9 -14.716 110.629 7.320 1.00 17.99 C
+ATOM 11856 C GLY H 9 -15.413 110.565 8.678 1.00 18.34 C
+ATOM 11857 O GLY H 9 -16.357 109.808 8.856 1.00 18.95 O
+ATOM 11858 H GLY H 9 -13.147 112.107 7.368 1.00 0.00 H
+ATOM 11859 1HA GLY H 9 -15.286 111.282 6.662 1.00 0.00 H
+ATOM 11860 2HA GLY H 9 -14.736 109.638 6.865 1.00 0.00 H
+ATOM 11861 N GLY H 10 -14.946 111.346 9.640 1.00 18.10 N
+ATOM 11862 CA GLY H 10 -15.568 111.351 10.961 1.00 17.45 C
+ATOM 11863 C GLY H 10 -16.788 112.255 10.984 1.00 17.13 C
+ATOM 11864 O GLY H 10 -17.325 112.611 9.933 1.00 17.74 O
+ATOM 11865 H GLY H 10 -14.158 111.947 9.458 1.00 0.00 H
+ATOM 11866 1HA GLY H 10 -15.840 110.340 11.248 1.00 0.00 H
+ATOM 11867 2HA GLY H 10 -14.863 111.714 11.701 1.00 0.00 H
+ATOM 11868 N GLY H 11 -17.217 112.636 12.183 1.00 16.81 N
+ATOM 11869 CA GLY H 11 -18.395 113.486 12.308 1.00 15.80 C
+ATOM 11870 C GLY H 11 -19.543 112.861 13.089 1.00 15.05 C
+ATOM 11871 O GLY H 11 -19.387 111.829 13.755 1.00 15.57 O
+ATOM 11872 H GLY H 11 -16.711 112.329 13.011 1.00 0.00 H
+ATOM 11873 1HA GLY H 11 -18.103 114.422 12.786 1.00 0.00 H
+ATOM 11874 2HA GLY H 11 -18.749 113.753 11.313 1.00 0.00 H
+ATOM 11875 N LEU H 12 -20.688 113.536 13.031 1.00 14.22 N
+ATOM 11876 CA LEU H 12 -21.893 113.178 13.774 1.00 13.40 C
+ATOM 11877 C LEU H 12 -22.800 112.194 13.054 1.00 13.79 C
+ATOM 11878 O LEU H 12 -23.190 112.404 11.901 1.00 14.37 O
+ATOM 11879 CB LEU H 12 -22.697 114.428 14.120 1.00 12.73 C
+ATOM 11880 CG LEU H 12 -24.028 114.162 14.831 1.00 10.89 C
+ATOM 11881 CD1 LEU H 12 -23.761 113.541 16.193 1.00 8.45 C
+ATOM 11882 CD2 LEU H 12 -24.791 115.468 14.967 1.00 8.53 C
+ATOM 11883 H LEU H 12 -20.723 114.358 12.443 1.00 0.00 H
+ATOM 11884 HA LEU H 12 -21.581 112.706 14.700 1.00 0.00 H
+ATOM 11885 1HB LEU H 12 -22.094 115.062 14.768 1.00 0.00 H
+ATOM 11886 2HB LEU H 12 -22.908 114.972 13.201 1.00 0.00 H
+ATOM 11887 HG LEU H 12 -24.621 113.456 14.251 1.00 0.00 H
+ATOM 11888 1HD1 LEU H 12 -24.714 113.342 16.682 1.00 0.00 H
+ATOM 11889 2HD1 LEU H 12 -23.223 112.607 16.072 1.00 0.00 H
+ATOM 11890 3HD1 LEU H 12 -23.172 114.224 16.798 1.00 0.00 H
+ATOM 11891 1HD2 LEU H 12 -25.741 115.279 15.469 1.00 0.00 H
+ATOM 11892 2HD2 LEU H 12 -24.201 116.174 15.551 1.00 0.00 H
+ATOM 11893 3HD2 LEU H 12 -24.977 115.881 13.974 1.00 0.00 H
+ATOM 11894 N VAL H 13 -23.130 111.123 13.763 1.00 13.34 N
+ATOM 11895 CA VAL H 13 -23.968 110.048 13.291 1.00 12.94 C
+ATOM 11896 C VAL H 13 -25.276 109.901 14.067 1.00 12.61 C
+ATOM 11897 O VAL H 13 -25.281 109.890 15.299 1.00 12.72 O
+ATOM 11898 CB VAL H 13 -23.181 108.745 13.436 1.00 12.98 C
+ATOM 11899 CG1 VAL H 13 -24.023 107.569 13.029 1.00 14.32 C
+ATOM 11900 CG2 VAL H 13 -21.916 108.828 12.625 1.00 13.81 C
+ATOM 11901 H VAL H 13 -22.730 111.042 14.695 1.00 0.00 H
+ATOM 11902 HA VAL H 13 -24.197 110.225 12.240 1.00 0.00 H
+ATOM 11903 HB VAL H 13 -22.919 108.622 14.465 1.00 0.00 H
+ATOM 11904 1HG1 VAL H 13 -23.473 106.687 13.166 1.00 0.00 H
+ATOM 11905 2HG1 VAL H 13 -24.899 107.520 13.648 1.00 0.00 H
+ATOM 11906 3HG1 VAL H 13 -24.313 107.661 11.980 1.00 0.00 H
+ATOM 11907 1HG2 VAL H 13 -21.349 107.910 12.756 1.00 0.00 H
+ATOM 11908 2HG2 VAL H 13 -22.167 108.955 11.572 1.00 0.00 H
+ATOM 11909 3HG2 VAL H 13 -21.315 109.672 12.964 1.00 0.00 H
+ATOM 11910 N GLN H 14 -26.391 109.776 13.348 1.00 12.95 N
+ATOM 11911 CA GLN H 14 -27.674 109.516 13.995 1.00 13.50 C
+ATOM 11912 C GLN H 14 -27.651 108.065 14.481 1.00 13.26 C
+ATOM 11913 O GLN H 14 -27.308 107.194 13.677 1.00 12.69 O
+ATOM 11914 CB GLN H 14 -28.831 109.709 13.006 1.00 13.60 C
+ATOM 11915 CG GLN H 14 -30.215 109.559 13.617 1.00 16.24 C
+ATOM 11916 CD GLN H 14 -31.315 109.806 12.603 1.00 19.23 C
+ATOM 11917 OE1 GLN H 14 -31.099 110.483 11.595 1.00 19.33 O
+ATOM 11918 NE2 GLN H 14 -32.495 109.261 12.856 1.00 19.16 N
+ATOM 11919 H GLN H 14 -26.335 109.835 12.339 1.00 0.00 H
+ATOM 11920 HA GLN H 14 -27.796 110.214 14.820 1.00 0.00 H
+ATOM 11921 1HB GLN H 14 -28.764 110.697 12.557 1.00 0.00 H
+ATOM 11922 2HB GLN H 14 -28.749 108.972 12.208 1.00 0.00 H
+ATOM 11923 1HG GLN H 14 -30.332 108.546 14.011 1.00 0.00 H
+ATOM 11924 2HG GLN H 14 -30.329 110.289 14.422 1.00 0.00 H
+ATOM 11925 1HE2 GLN H 14 -33.254 109.387 12.219 1.00 0.00 H
+ATOM 11926 2HE2 GLN H 14 -32.624 108.718 13.685 1.00 0.00 H
+ATOM 11927 N PRO H 15 -28.048 107.749 15.724 1.00 13.44 N
+ATOM 11928 CA PRO H 15 -28.082 106.405 16.269 1.00 13.45 C
+ATOM 11929 C PRO H 15 -28.822 105.472 15.343 1.00 12.95 C
+ATOM 11930 O PRO H 15 -29.896 105.791 14.841 1.00 12.99 O
+ATOM 11931 CB PRO H 15 -28.849 106.622 17.582 1.00 13.75 C
+ATOM 11932 CG PRO H 15 -28.502 108.030 17.982 1.00 13.80 C
+ATOM 11933 CD PRO H 15 -28.404 108.802 16.686 1.00 13.48 C
+ATOM 11934 HA PRO H 15 -27.055 106.053 16.453 1.00 0.00 H
+ATOM 11935 1HB PRO H 15 -29.932 106.494 17.398 1.00 0.00 H
+ATOM 11936 2HB PRO H 15 -28.560 105.873 18.324 1.00 0.00 H
+ATOM 11937 1HG PRO H 15 -29.281 108.440 18.639 1.00 0.00 H
+ATOM 11938 2HG PRO H 15 -27.578 108.052 18.571 1.00 0.00 H
+ATOM 11939 1HD PRO H 15 -29.345 109.310 16.439 1.00 0.00 H
+ATOM 11940 2HD PRO H 15 -27.569 109.490 16.788 1.00 0.00 H
+ATOM 11941 N GLY H 16 -28.226 104.297 15.114 1.00 12.59 N
+ATOM 11942 CA GLY H 16 -28.766 103.285 14.231 1.00 12.92 C
+ATOM 11943 C GLY H 16 -28.303 103.477 12.785 1.00 13.25 C
+ATOM 11944 O GLY H 16 -28.519 102.613 11.935 1.00 12.17 O
+ATOM 11945 H GLY H 16 -27.335 104.102 15.572 1.00 0.00 H
+ATOM 11946 1HA GLY H 16 -28.466 102.300 14.586 1.00 0.00 H
+ATOM 11947 2HA GLY H 16 -29.856 103.316 14.264 1.00 0.00 H
+ATOM 11948 N GLY H 17 -27.639 104.608 12.520 1.00 13.90 N
+ATOM 11949 CA GLY H 17 -27.161 104.929 11.182 1.00 15.12 C
+ATOM 11950 C GLY H 17 -25.778 104.373 10.901 1.00 15.83 C
+ATOM 11951 O GLY H 17 -25.270 103.511 11.633 1.00 16.05 O
+ATOM 11952 H GLY H 17 -27.490 105.297 13.247 1.00 0.00 H
+ATOM 11953 1HA GLY H 17 -27.865 104.551 10.441 1.00 0.00 H
+ATOM 11954 2HA GLY H 17 -27.141 106.015 11.068 1.00 0.00 H
+ATOM 11955 N SER H 18 -25.158 104.877 9.840 1.00 16.46 N
+ATOM 11956 CA SER H 18 -23.858 104.366 9.434 1.00 17.32 C
+ATOM 11957 C SER H 18 -22.837 105.458 9.134 1.00 17.55 C
+ATOM 11958 O SER H 18 -23.196 106.594 8.816 1.00 17.70 O
+ATOM 11959 CB SER H 18 -24.016 103.503 8.198 1.00 17.52 C
+ATOM 11960 OG SER H 18 -24.886 102.434 8.434 1.00 21.40 O
+ATOM 11961 H SER H 18 -25.605 105.598 9.292 1.00 0.00 H
+ATOM 11962 HA SER H 18 -23.468 103.758 10.248 1.00 0.00 H
+ATOM 11963 1HB SER H 18 -24.378 104.100 7.363 1.00 0.00 H
+ATOM 11964 2HB SER H 18 -23.036 103.114 7.926 1.00 0.00 H
+ATOM 11965 HG SER H 18 -24.526 101.688 7.928 1.00 0.00 H
+ATOM 11966 N LEU H 19 -21.558 105.085 9.201 1.00 17.74 N
+ATOM 11967 CA LEU H 19 -20.461 105.987 8.856 1.00 17.62 C
+ATOM 11968 C LEU H 19 -19.257 105.215 8.322 1.00 17.64 C
+ATOM 11969 O LEU H 19 -18.879 104.189 8.889 1.00 17.17 O
+ATOM 11970 CB LEU H 19 -20.021 106.788 10.074 1.00 17.98 C
+ATOM 11971 CG LEU H 19 -18.964 107.837 9.809 1.00 19.03 C
+ATOM 11972 CD1 LEU H 19 -19.592 108.934 8.965 1.00 18.91 C
+ATOM 11973 CD2 LEU H 19 -18.450 108.363 11.091 1.00 17.21 C
+ATOM 11974 H LEU H 19 -21.362 104.133 9.504 1.00 0.00 H
+ATOM 11975 HA LEU H 19 -20.806 106.675 8.083 1.00 0.00 H
+ATOM 11976 1HB LEU H 19 -20.883 107.273 10.490 1.00 0.00 H
+ATOM 11977 2HB LEU H 19 -19.619 106.103 10.811 1.00 0.00 H
+ATOM 11978 HG LEU H 19 -18.135 107.403 9.246 1.00 0.00 H
+ATOM 11979 1HD1 LEU H 19 -18.851 109.701 8.752 1.00 0.00 H
+ATOM 11980 2HD1 LEU H 19 -19.955 108.512 8.027 1.00 0.00 H
+ATOM 11981 3HD1 LEU H 19 -20.426 109.374 9.510 1.00 0.00 H
+ATOM 11982 1HD2 LEU H 19 -17.703 109.112 10.891 1.00 0.00 H
+ATOM 11983 2HD2 LEU H 19 -19.260 108.804 11.651 1.00 0.00 H
+ATOM 11984 3HD2 LEU H 19 -18.010 107.545 11.649 1.00 0.00 H
+ATOM 11985 N ARG H 20 -18.657 105.702 7.232 1.00 17.51 N
+ATOM 11986 CA ARG H 20 -17.482 105.037 6.674 1.00 17.31 C
+ATOM 11987 C ARG H 20 -16.215 105.872 6.884 1.00 16.58 C
+ATOM 11988 O ARG H 20 -16.173 107.039 6.500 1.00 16.78 O
+ATOM 11989 CB ARG H 20 -17.657 104.789 5.184 1.00 17.44 C
+ATOM 11990 CG ARG H 20 -16.603 103.890 4.535 1.00 18.83 C
+ATOM 11991 CD ARG H 20 -16.837 103.731 3.060 1.00 22.67 C
+ATOM 11992 NE ARG H 20 -15.970 102.715 2.454 1.00 26.25 N
+ATOM 11993 CZ ARG H 20 -15.708 102.613 1.129 1.00 26.34 C
+ATOM 11994 NH1 ARG H 20 -16.216 103.484 0.287 1.00 26.10 N
+ATOM 11995 NH2 ARG H 20 -14.948 101.634 0.675 1.00 26.09 N
+ATOM 11996 H ARG H 20 -19.010 106.545 6.807 1.00 0.00 H
+ATOM 11997 HA ARG H 20 -17.348 104.089 7.178 1.00 0.00 H
+ATOM 11998 1HB ARG H 20 -18.627 104.329 5.021 1.00 0.00 H
+ATOM 11999 2HB ARG H 20 -17.655 105.736 4.647 1.00 0.00 H
+ATOM 12000 1HG ARG H 20 -15.613 104.317 4.688 1.00 0.00 H
+ATOM 12001 2HG ARG H 20 -16.644 102.900 4.999 1.00 0.00 H
+ATOM 12002 1HD ARG H 20 -17.872 103.453 2.871 1.00 0.00 H
+ATOM 12003 2HD ARG H 20 -16.623 104.685 2.576 1.00 0.00 H
+ATOM 12004 HE ARG H 20 -15.559 102.024 3.066 1.00 0.00 H
+ATOM 12005 1HH1 ARG H 20 -16.801 104.234 0.627 1.00 0.00 H
+ATOM 12006 2HH1 ARG H 20 -16.023 103.402 -0.701 1.00 0.00 H
+ATOM 12007 1HH2 ARG H 20 -14.572 100.946 1.314 1.00 0.00 H
+ATOM 12008 2HH2 ARG H 20 -14.761 101.558 -0.312 1.00 0.00 H
+ATOM 12009 N LEU H 21 -15.188 105.256 7.458 1.00 16.15 N
+ATOM 12010 CA LEU H 21 -13.916 105.923 7.694 1.00 15.52 C
+ATOM 12011 C LEU H 21 -12.913 105.522 6.621 1.00 15.22 C
+ATOM 12012 O LEU H 21 -12.933 104.389 6.138 1.00 14.58 O
+ATOM 12013 CB LEU H 21 -13.359 105.591 9.076 1.00 15.52 C
+ATOM 12014 CG LEU H 21 -14.263 105.930 10.218 1.00 15.79 C
+ATOM 12015 CD1 LEU H 21 -13.622 105.476 11.511 1.00 15.22 C
+ATOM 12016 CD2 LEU H 21 -14.538 107.410 10.212 1.00 17.09 C
+ATOM 12017 H LEU H 21 -15.293 104.287 7.751 1.00 0.00 H
+ATOM 12018 HA LEU H 21 -14.066 106.995 7.630 1.00 0.00 H
+ATOM 12019 1HB LEU H 21 -13.130 104.537 9.120 1.00 0.00 H
+ATOM 12020 2HB LEU H 21 -12.437 106.156 9.224 1.00 0.00 H
+ATOM 12021 HG LEU H 21 -15.191 105.400 10.096 1.00 0.00 H
+ATOM 12022 1HD1 LEU H 21 -14.272 105.698 12.349 1.00 0.00 H
+ATOM 12023 2HD1 LEU H 21 -13.448 104.405 11.469 1.00 0.00 H
+ATOM 12024 3HD1 LEU H 21 -12.682 105.995 11.637 1.00 0.00 H
+ATOM 12025 1HD2 LEU H 21 -15.205 107.659 11.020 1.00 0.00 H
+ATOM 12026 2HD2 LEU H 21 -13.602 107.952 10.325 1.00 0.00 H
+ATOM 12027 3HD2 LEU H 21 -15.004 107.682 9.263 1.00 0.00 H
+ATOM 12028 N SER H 22 -12.014 106.434 6.298 1.00 15.36 N
+ATOM 12029 CA SER H 22 -10.947 106.218 5.331 1.00 16.27 C
+ATOM 12030 C SER H 22 -9.583 106.344 6.003 1.00 16.10 C
+ATOM 12031 O SER H 22 -9.462 107.052 7.017 1.00 17.07 O
+ATOM 12032 CB SER H 22 -11.093 107.218 4.198 1.00 16.02 C
+ATOM 12033 OG SER H 22 -10.043 107.123 3.302 1.00 18.88 O
+ATOM 12034 H SER H 22 -12.078 107.349 6.743 1.00 0.00 H
+ATOM 12035 HA SER H 22 -11.044 105.199 4.921 1.00 0.00 H
+ATOM 12036 1HB SER H 22 -12.032 107.062 3.662 1.00 0.00 H
+ATOM 12037 2HB SER H 22 -11.129 108.216 4.614 1.00 0.00 H
+ATOM 12038 HG SER H 22 -9.243 107.157 3.812 1.00 0.00 H
+ATOM 12039 N CYS H 23 -8.583 105.691 5.467 1.00 16.32 N
+ATOM 12040 CA CYS H 23 -7.182 105.760 5.889 1.00 16.78 C
+ATOM 12041 C CYS H 23 -6.210 105.669 4.791 1.00 16.53 C
+ATOM 12042 O CYS H 23 -5.777 104.593 4.363 1.00 16.37 O
+ATOM 12043 CB CYS H 23 -6.873 104.659 6.936 1.00 17.62 C
+ATOM 12044 SG CYS H 23 -5.174 104.747 7.504 1.00 22.12 S
+ATOM 12045 H CYS H 23 -8.775 105.066 4.626 1.00 0.00 H
+ATOM 12046 HA CYS H 23 -7.067 106.706 6.424 1.00 0.00 H
+ATOM 12047 1HB CYS H 23 -7.513 104.763 7.806 1.00 0.00 H
+ATOM 12048 2HB CYS H 23 -7.040 103.678 6.510 1.00 0.00 H
+ATOM 12049 N ALA H 24 -5.839 106.846 4.216 1.00 15.72 N
+ATOM 12050 CA ALA H 24 -4.906 106.863 3.113 1.00 14.70 C
+ATOM 12051 C ALA H 24 -3.528 106.535 3.634 1.00 14.88 C
+ATOM 12052 O ALA H 24 -3.164 106.971 4.724 1.00 15.80 O
+ATOM 12053 CB ALA H 24 -4.921 108.206 2.418 1.00 14.86 C
+ATOM 12054 H ALA H 24 -6.203 107.724 4.618 1.00 0.00 H
+ATOM 12055 HA ALA H 24 -5.169 106.092 2.396 1.00 0.00 H
+ATOM 12056 1HB ALA H 24 -4.212 108.205 1.597 1.00 0.00 H
+ATOM 12057 2HB ALA H 24 -5.931 108.405 2.034 1.00 0.00 H
+ATOM 12058 3HB ALA H 24 -4.640 108.956 3.138 1.00 0.00 H
+ATOM 12059 N ALA H 25 -2.746 105.787 2.868 1.00 14.43 N
+ATOM 12060 CA ALA H 25 -1.379 105.504 3.289 1.00 13.76 C
+ATOM 12061 C ALA H 25 -0.378 106.184 2.378 1.00 13.58 C
+ATOM 12062 O ALA H 25 -0.601 106.324 1.171 1.00 13.15 O
+ATOM 12063 CB ALA H 25 -1.133 104.011 3.303 1.00 13.82 C
+ATOM 12064 H ALA H 25 -3.088 105.389 1.992 1.00 0.00 H
+ATOM 12065 HA ALA H 25 -1.226 105.889 4.296 1.00 0.00 H
+ATOM 12066 1HB ALA H 25 -0.125 103.816 3.630 1.00 0.00 H
+ATOM 12067 2HB ALA H 25 -1.836 103.535 3.985 1.00 0.00 H
+ATOM 12068 3HB ALA H 25 -1.269 103.620 2.302 1.00 0.00 H
+ATOM 12069 N SER H 26 0.764 106.552 2.962 1.00 13.26 N
+ATOM 12070 CA SER H 26 1.880 107.111 2.232 1.00 13.90 C
+ATOM 12071 C SER H 26 3.210 106.655 2.828 1.00 14.07 C
+ATOM 12072 O SER H 26 3.354 106.485 4.041 1.00 14.37 O
+ATOM 12073 CB SER H 26 1.802 108.628 2.222 1.00 13.95 C
+ATOM 12074 OG SER H 26 2.910 109.177 1.572 1.00 15.75 O
+ATOM 12075 H SER H 26 0.833 106.464 3.970 1.00 0.00 H
+ATOM 12076 HA SER H 26 1.830 106.752 1.211 1.00 0.00 H
+ATOM 12077 1HB SER H 26 0.886 108.944 1.716 1.00 0.00 H
+ATOM 12078 2HB SER H 26 1.758 108.993 3.242 1.00 0.00 H
+ATOM 12079 HG SER H 26 3.670 108.945 2.119 1.00 0.00 H
+ATOM 12080 N GLY H 27 4.183 106.424 1.947 1.00 15.25 N
+ATOM 12081 CA GLY H 27 5.519 105.969 2.341 1.00 15.33 C
+ATOM 12082 C GLY H 27 5.674 104.452 2.200 1.00 15.54 C
+ATOM 12083 O GLY H 27 6.784 103.927 2.253 1.00 15.68 O
+ATOM 12084 H GLY H 27 3.994 106.581 0.961 1.00 0.00 H
+ATOM 12085 1HA GLY H 27 6.263 106.470 1.724 1.00 0.00 H
+ATOM 12086 2HA GLY H 27 5.725 106.264 3.371 1.00 0.00 H
+ATOM 12087 N PHE H 28 4.556 103.750 2.024 1.00 14.69 N
+ATOM 12088 CA PHE H 28 4.584 102.303 1.853 1.00 14.61 C
+ATOM 12089 C PHE H 28 3.335 101.879 1.091 1.00 15.11 C
+ATOM 12090 O PHE H 28 2.360 102.634 1.046 1.00 15.84 O
+ATOM 12091 CB PHE H 28 4.647 101.630 3.225 1.00 14.42 C
+ATOM 12092 CG PHE H 28 3.364 101.696 4.041 1.00 13.48 C
+ATOM 12093 CD1 PHE H 28 2.533 100.588 4.113 1.00 13.56 C
+ATOM 12094 CD2 PHE H 28 2.961 102.853 4.688 1.00 13.15 C
+ATOM 12095 CE1 PHE H 28 1.364 100.613 4.831 1.00 14.07 C
+ATOM 12096 CE2 PHE H 28 1.773 102.875 5.408 1.00 13.58 C
+ATOM 12097 CZ PHE H 28 0.984 101.739 5.474 1.00 16.31 C
+ATOM 12098 H PHE H 28 3.674 104.236 2.000 1.00 0.00 H
+ATOM 12099 HA PHE H 28 5.464 102.025 1.268 1.00 0.00 H
+ATOM 12100 1HB PHE H 28 4.906 100.580 3.092 1.00 0.00 H
+ATOM 12101 2HB PHE H 28 5.445 102.088 3.812 1.00 0.00 H
+ATOM 12102 HD1 PHE H 28 2.831 99.674 3.602 1.00 0.00 H
+ATOM 12103 HD2 PHE H 28 3.585 103.747 4.626 1.00 0.00 H
+ATOM 12104 HE1 PHE H 28 0.742 99.727 4.884 1.00 0.00 H
+ATOM 12105 HE2 PHE H 28 1.460 103.787 5.920 1.00 0.00 H
+ATOM 12106 HZ PHE H 28 0.058 101.738 6.029 1.00 0.00 H
+ATOM 12107 N ASN H 29 3.334 100.676 0.530 1.00 15.27 N
+ATOM 12108 CA ASN H 29 2.123 100.175 -0.109 1.00 15.62 C
+ATOM 12109 C ASN H 29 1.307 99.461 0.961 1.00 16.23 C
+ATOM 12110 O ASN H 29 1.855 98.655 1.710 1.00 16.15 O
+ATOM 12111 CB ASN H 29 2.457 99.227 -1.235 1.00 15.29 C
+ATOM 12112 CG ASN H 29 3.296 99.832 -2.308 1.00 15.43 C
+ATOM 12113 OD1 ASN H 29 2.906 100.759 -3.029 1.00 15.66 O
+ATOM 12114 ND2 ASN H 29 4.489 99.300 -2.418 1.00 15.15 N
+ATOM 12115 H ASN H 29 4.162 100.091 0.559 1.00 0.00 H
+ATOM 12116 HA ASN H 29 1.537 101.010 -0.489 1.00 0.00 H
+ATOM 12117 1HB ASN H 29 2.958 98.350 -0.850 1.00 0.00 H
+ATOM 12118 2HB ASN H 29 1.527 98.908 -1.690 1.00 0.00 H
+ATOM 12119 1HD2 ASN H 29 5.130 99.637 -3.107 1.00 0.00 H
+ATOM 12120 2HD2 ASN H 29 4.760 98.540 -1.782 1.00 0.00 H
+ATOM 12121 N ILE H 30 0.002 99.675 1.022 1.00 16.49 N
+ATOM 12122 CA ILE H 30 -0.753 98.988 2.072 1.00 17.14 C
+ATOM 12123 C ILE H 30 -0.748 97.481 1.865 1.00 18.22 C
+ATOM 12124 O ILE H 30 -0.842 96.731 2.827 1.00 18.92 O
+ATOM 12125 CB ILE H 30 -2.203 99.505 2.216 1.00 17.28 C
+ATOM 12126 CG1 ILE H 30 -3.026 99.235 0.956 1.00 16.27 C
+ATOM 12127 CG2 ILE H 30 -2.189 100.950 2.542 1.00 16.70 C
+ATOM 12128 CD1 ILE H 30 -4.497 99.559 1.117 1.00 14.65 C
+ATOM 12129 H ILE H 30 -0.440 100.332 0.390 1.00 0.00 H
+ATOM 12130 HA ILE H 30 -0.266 99.185 3.018 1.00 0.00 H
+ATOM 12131 HB ILE H 30 -2.684 98.992 3.031 1.00 0.00 H
+ATOM 12132 1HG1 ILE H 30 -2.633 99.816 0.152 1.00 0.00 H
+ATOM 12133 2HG1 ILE H 30 -2.947 98.190 0.693 1.00 0.00 H
+ATOM 12134 1HG2 ILE H 30 -3.207 101.315 2.674 1.00 0.00 H
+ATOM 12135 2HG2 ILE H 30 -1.623 101.097 3.464 1.00 0.00 H
+ATOM 12136 3HG2 ILE H 30 -1.715 101.485 1.737 1.00 0.00 H
+ATOM 12137 1HD1 ILE H 30 -5.021 99.345 0.188 1.00 0.00 H
+ATOM 12138 2HD1 ILE H 30 -4.912 98.957 1.916 1.00 0.00 H
+ATOM 12139 3HD1 ILE H 30 -4.611 100.605 1.363 1.00 0.00 H
+ATOM 12140 N LYS H 37 -0.544 97.027 0.632 1.00 18.46 N
+ATOM 12141 CA LYS H 37 -0.473 95.592 0.352 1.00 18.97 C
+ATOM 12142 C LYS H 37 0.719 94.925 1.055 1.00 19.22 C
+ATOM 12143 O LYS H 37 0.729 93.710 1.238 1.00 20.46 O
+ATOM 12144 CB LYS H 37 -0.359 95.330 -1.153 1.00 19.34 C
+ATOM 12145 CG LYS H 37 0.987 95.721 -1.757 1.00 0.00 C
+ATOM 12146 CD LYS H 37 1.051 95.466 -3.246 1.00 0.00 C
+ATOM 12147 CE LYS H 37 2.378 95.976 -3.866 1.00 0.00 C
+ATOM 12148 NZ LYS H 37 3.604 95.241 -3.361 1.00 0.00 N
+ATOM 12149 H LYS H 37 -0.456 97.687 -0.124 1.00 0.00 H
+ATOM 12150 HA LYS H 37 -1.379 95.120 0.721 1.00 0.00 H
+ATOM 12151 1HB LYS H 37 -0.513 94.264 -1.348 1.00 0.00 H
+ATOM 12152 2HB LYS H 37 -1.136 95.877 -1.674 1.00 0.00 H
+ATOM 12153 1HG LYS H 37 1.184 96.749 -1.556 1.00 0.00 H
+ATOM 12154 2HG LYS H 37 1.768 95.129 -1.286 1.00 0.00 H
+ATOM 12155 1HD LYS H 37 0.955 94.395 -3.427 1.00 0.00 H
+ATOM 12156 2HD LYS H 37 0.220 95.975 -3.731 1.00 0.00 H
+ATOM 12157 1HE LYS H 37 2.319 95.854 -4.945 1.00 0.00 H
+ATOM 12158 2HE LYS H 37 2.491 97.035 -3.637 1.00 0.00 H
+ATOM 12159 1HZ LYS H 37 4.425 95.618 -3.804 1.00 0.00 H
+ATOM 12160 2HZ LYS H 37 3.708 95.352 -2.339 1.00 0.00 H
+ATOM 12161 3HZ LYS H 37 3.533 94.263 -3.571 1.00 0.00 H
+ATOM 12162 N ASP H 38 1.722 95.703 1.436 1.00 18.44 N
+ATOM 12163 CA ASP H 38 2.915 95.133 2.031 1.00 18.00 C
+ATOM 12164 C ASP H 38 2.787 95.006 3.550 1.00 17.11 C
+ATOM 12165 O ASP H 38 3.698 94.533 4.230 1.00 17.01 O
+ATOM 12166 CB ASP H 38 4.123 96.028 1.713 1.00 18.32 C
+ATOM 12167 CG ASP H 38 4.418 96.192 0.192 1.00 21.24 C
+ATOM 12168 OD1 ASP H 38 4.031 95.344 -0.585 1.00 21.88 O
+ATOM 12169 OD2 ASP H 38 5.022 97.191 -0.169 1.00 22.31 O
+ATOM 12170 H ASP H 38 1.671 96.714 1.328 1.00 0.00 H
+ATOM 12171 HA ASP H 38 3.068 94.134 1.608 1.00 0.00 H
+ATOM 12172 1HB ASP H 38 3.937 97.016 2.140 1.00 0.00 H
+ATOM 12173 2HB ASP H 38 5.010 95.615 2.191 1.00 0.00 H
+ATOM 12174 N THR H 39 1.715 95.553 4.116 1.00 16.36 N
+ATOM 12175 CA THR H 39 1.554 95.530 5.562 1.00 15.83 C
+ATOM 12176 C THR H 39 0.114 95.183 6.008 1.00 14.35 C
+ATOM 12177 O THR H 39 -0.769 94.943 5.187 1.00 14.47 O
+ATOM 12178 CB THR H 39 2.174 96.846 6.102 1.00 16.72 C
+ATOM 12179 OG1 THR H 39 3.628 96.755 5.879 1.00 17.24 O
+ATOM 12180 CG2 THR H 39 1.904 97.190 7.516 1.00 16.71 C
+ATOM 12181 H THR H 39 0.982 95.960 3.543 1.00 0.00 H
+ATOM 12182 HA THR H 39 2.180 94.738 5.961 1.00 0.00 H
+ATOM 12183 HB THR H 39 1.797 97.653 5.488 1.00 0.00 H
+ATOM 12184 HG1 THR H 39 3.812 95.975 5.300 1.00 0.00 H
+ATOM 12185 1HG2 THR H 39 2.394 98.099 7.739 1.00 0.00 H
+ATOM 12186 2HG2 THR H 39 0.849 97.325 7.689 1.00 0.00 H
+ATOM 12187 3HG2 THR H 39 2.290 96.417 8.135 1.00 0.00 H
+ATOM 12188 N TYR H 40 -0.106 95.154 7.311 1.00 12.45 N
+ATOM 12189 CA TYR H 40 -1.401 94.868 7.912 1.00 11.26 C
+ATOM 12190 C TYR H 40 -1.951 96.137 8.574 1.00 12.11 C
+ATOM 12191 O TYR H 40 -1.241 96.791 9.348 1.00 11.68 O
+ATOM 12192 CB TYR H 40 -1.193 93.748 8.931 1.00 10.32 C
+ATOM 12193 CG TYR H 40 -0.746 92.475 8.255 1.00 7.81 C
+ATOM 12194 CD1 TYR H 40 0.575 92.358 7.798 1.00 6.26 C
+ATOM 12195 CD2 TYR H 40 -1.605 91.415 8.105 1.00 6.14 C
+ATOM 12196 CE1 TYR H 40 0.998 91.211 7.176 1.00 5.28 C
+ATOM 12197 CE2 TYR H 40 -1.152 90.271 7.496 1.00 6.83 C
+ATOM 12198 CZ TYR H 40 0.136 90.171 7.028 1.00 8.03 C
+ATOM 12199 OH TYR H 40 0.569 89.018 6.430 1.00 9.83 O
+ATOM 12200 H TYR H 40 0.678 95.345 7.926 1.00 0.00 H
+ATOM 12201 HA TYR H 40 -2.095 94.544 7.128 1.00 0.00 H
+ATOM 12202 1HB TYR H 40 -0.440 94.043 9.653 1.00 0.00 H
+ATOM 12203 2HB TYR H 40 -2.112 93.540 9.470 1.00 0.00 H
+ATOM 12204 HD1 TYR H 40 1.287 93.187 7.919 1.00 0.00 H
+ATOM 12205 HD2 TYR H 40 -2.627 91.470 8.469 1.00 0.00 H
+ATOM 12206 HE1 TYR H 40 2.023 91.134 6.816 1.00 0.00 H
+ATOM 12207 HE2 TYR H 40 -1.806 89.435 7.380 1.00 0.00 H
+ATOM 12208 HH TYR H 40 -0.163 88.389 6.388 1.00 0.00 H
+ATOM 12209 N ILE H 41 -3.211 96.481 8.264 1.00 12.04 N
+ATOM 12210 CA ILE H 41 -3.814 97.722 8.776 1.00 11.71 C
+ATOM 12211 C ILE H 41 -4.872 97.449 9.836 1.00 12.46 C
+ATOM 12212 O ILE H 41 -5.789 96.644 9.648 1.00 13.47 O
+ATOM 12213 CB ILE H 41 -4.424 98.565 7.635 1.00 10.86 C
+ATOM 12214 CG1 ILE H 41 -3.352 98.817 6.523 1.00 9.95 C
+ATOM 12215 CG2 ILE H 41 -4.941 99.913 8.196 1.00 10.69 C
+ATOM 12216 CD1 ILE H 41 -2.099 99.544 7.003 1.00 7.37 C
+ATOM 12217 H ILE H 41 -3.766 95.878 7.663 1.00 0.00 H
+ATOM 12218 HA ILE H 41 -3.033 98.316 9.235 1.00 0.00 H
+ATOM 12219 HB ILE H 41 -5.246 98.026 7.183 1.00 0.00 H
+ATOM 12220 1HG1 ILE H 41 -3.053 97.851 6.099 1.00 0.00 H
+ATOM 12221 2HG1 ILE H 41 -3.802 99.414 5.728 1.00 0.00 H
+ATOM 12222 1HG2 ILE H 41 -5.372 100.500 7.396 1.00 0.00 H
+ATOM 12223 2HG2 ILE H 41 -5.705 99.742 8.958 1.00 0.00 H
+ATOM 12224 3HG2 ILE H 41 -4.112 100.466 8.642 1.00 0.00 H
+ATOM 12225 1HD1 ILE H 41 -1.420 99.668 6.163 1.00 0.00 H
+ATOM 12226 2HD1 ILE H 41 -2.366 100.524 7.407 1.00 0.00 H
+ATOM 12227 3HD1 ILE H 41 -1.612 98.953 7.779 1.00 0.00 H
+ATOM 12228 N HIS H 42 -4.737 98.143 10.961 1.00 12.35 N
+ATOM 12229 CA HIS H 42 -5.597 97.988 12.117 1.00 12.47 C
+ATOM 12230 C HIS H 42 -6.380 99.250 12.416 1.00 12.92 C
+ATOM 12231 O HIS H 42 -5.890 100.364 12.215 1.00 13.71 O
+ATOM 12232 CB HIS H 42 -4.758 97.710 13.366 1.00 12.03 C
+ATOM 12233 CG HIS H 42 -3.926 96.477 13.325 1.00 11.18 C
+ATOM 12234 ND1 HIS H 42 -4.275 95.322 13.989 1.00 11.19 N
+ATOM 12235 CD2 HIS H 42 -2.755 96.216 12.701 1.00 7.88 C
+ATOM 12236 CE1 HIS H 42 -3.343 94.406 13.779 1.00 10.90 C
+ATOM 12237 NE2 HIS H 42 -2.420 94.926 12.997 1.00 12.10 N
+ATOM 12238 H HIS H 42 -3.968 98.806 11.024 1.00 0.00 H
+ATOM 12239 HA HIS H 42 -6.305 97.177 11.965 1.00 0.00 H
+ATOM 12240 1HB HIS H 42 -4.102 98.559 13.537 1.00 0.00 H
+ATOM 12241 2HB HIS H 42 -5.422 97.655 14.241 1.00 0.00 H
+ATOM 12242 HD2 HIS H 42 -2.186 96.902 12.080 1.00 0.00 H
+ATOM 12243 HE1 HIS H 42 -3.344 93.387 14.180 1.00 0.00 H
+ATOM 12244 HE2 HIS H 42 -1.591 94.456 12.669 1.00 0.00 H
+ATOM 12245 N TRP H 43 -7.574 99.059 12.955 1.00 12.99 N
+ATOM 12246 CA TRP H 43 -8.343 100.149 13.517 1.00 12.45 C
+ATOM 12247 C TRP H 43 -8.451 99.939 15.016 1.00 12.56 C
+ATOM 12248 O TRP H 43 -8.822 98.853 15.478 1.00 13.25 O
+ATOM 12249 CB TRP H 43 -9.721 100.250 12.861 1.00 11.75 C
+ATOM 12250 CG TRP H 43 -9.651 100.770 11.465 1.00 13.27 C
+ATOM 12251 CD1 TRP H 43 -9.465 100.046 10.337 1.00 13.55 C
+ATOM 12252 CD2 TRP H 43 -9.768 102.151 11.040 1.00 12.89 C
+ATOM 12253 NE1 TRP H 43 -9.470 100.872 9.235 1.00 14.29 N
+ATOM 12254 CE2 TRP H 43 -9.647 102.161 9.644 1.00 13.28 C
+ATOM 12255 CE3 TRP H 43 -9.961 103.356 11.718 1.00 10.15 C
+ATOM 12256 CZ2 TRP H 43 -9.714 103.348 8.895 1.00 15.10 C
+ATOM 12257 CZ3 TRP H 43 -10.020 104.548 10.982 1.00 16.07 C
+ATOM 12258 CH2 TRP H 43 -9.906 104.547 9.601 1.00 14.75 C
+ATOM 12259 H TRP H 43 -7.942 98.120 13.011 1.00 0.00 H
+ATOM 12260 HA TRP H 43 -7.819 101.081 13.332 1.00 0.00 H
+ATOM 12261 1HB TRP H 43 -10.199 99.270 12.814 1.00 0.00 H
+ATOM 12262 2HB TRP H 43 -10.365 100.910 13.463 1.00 0.00 H
+ATOM 12263 HD1 TRP H 43 -9.338 98.979 10.315 1.00 0.00 H
+ATOM 12264 HE1 TRP H 43 -9.360 100.583 8.281 1.00 0.00 H
+ATOM 12265 HE3 TRP H 43 -10.051 103.367 12.806 1.00 0.00 H
+ATOM 12266 HZ2 TRP H 43 -9.611 103.366 7.799 1.00 0.00 H
+ATOM 12267 HZ3 TRP H 43 -10.149 105.482 11.533 1.00 0.00 H
+ATOM 12268 HH2 TRP H 43 -9.966 105.503 9.042 1.00 0.00 H
+ATOM 12269 N VAL H 44 -8.119 101.000 15.746 1.00 12.43 N
+ATOM 12270 CA VAL H 44 -8.132 101.084 17.208 1.00 12.88 C
+ATOM 12271 C VAL H 44 -8.958 102.294 17.595 1.00 13.06 C
+ATOM 12272 O VAL H 44 -8.852 103.330 16.950 1.00 12.95 O
+ATOM 12273 CB VAL H 44 -6.694 101.230 17.776 1.00 13.50 C
+ATOM 12274 CG1 VAL H 44 -6.735 101.397 19.305 1.00 14.48 C
+ATOM 12275 CG2 VAL H 44 -5.847 100.000 17.401 1.00 12.43 C
+ATOM 12276 H VAL H 44 -7.819 101.829 15.234 1.00 0.00 H
+ATOM 12277 HA VAL H 44 -8.596 100.192 17.619 1.00 0.00 H
+ATOM 12278 HB VAL H 44 -6.243 102.124 17.356 1.00 0.00 H
+ATOM 12279 1HG1 VAL H 44 -5.724 101.517 19.684 1.00 0.00 H
+ATOM 12280 2HG1 VAL H 44 -7.319 102.275 19.564 1.00 0.00 H
+ATOM 12281 3HG1 VAL H 44 -7.186 100.517 19.757 1.00 0.00 H
+ATOM 12282 1HG2 VAL H 44 -4.840 100.125 17.793 1.00 0.00 H
+ATOM 12283 2HG2 VAL H 44 -6.291 99.102 17.825 1.00 0.00 H
+ATOM 12284 3HG2 VAL H 44 -5.799 99.902 16.315 1.00 0.00 H
+ATOM 12285 N ARG H 45 -9.804 102.194 18.601 1.00 12.86 N
+ATOM 12286 CA ARG H 45 -10.587 103.366 18.944 1.00 12.91 C
+ATOM 12287 C ARG H 45 -10.443 103.749 20.400 1.00 13.49 C
+ATOM 12288 O ARG H 45 -10.086 102.934 21.254 1.00 14.04 O
+ATOM 12289 CB ARG H 45 -12.049 103.156 18.633 1.00 13.20 C
+ATOM 12290 CG ARG H 45 -12.741 102.151 19.504 1.00 12.66 C
+ATOM 12291 CD ARG H 45 -14.150 101.975 19.108 1.00 11.20 C
+ATOM 12292 NE ARG H 45 -14.835 101.050 19.966 1.00 12.97 N
+ATOM 12293 CZ ARG H 45 -16.121 100.699 19.832 1.00 12.81 C
+ATOM 12294 NH1 ARG H 45 -16.856 101.192 18.860 1.00 14.41 N
+ATOM 12295 NH2 ARG H 45 -16.634 99.854 20.698 1.00 9.49 N
+ATOM 12296 H ARG H 45 -9.897 101.333 19.121 1.00 0.00 H
+ATOM 12297 HA ARG H 45 -10.228 104.189 18.347 1.00 0.00 H
+ATOM 12298 1HB ARG H 45 -12.571 104.097 18.699 1.00 0.00 H
+ATOM 12299 2HB ARG H 45 -12.136 102.817 17.610 1.00 0.00 H
+ATOM 12300 1HG ARG H 45 -12.225 101.189 19.456 1.00 0.00 H
+ATOM 12301 2HG ARG H 45 -12.726 102.510 20.532 1.00 0.00 H
+ATOM 12302 1HD ARG H 45 -14.661 102.932 19.169 1.00 0.00 H
+ATOM 12303 2HD ARG H 45 -14.213 101.602 18.093 1.00 0.00 H
+ATOM 12304 HE ARG H 45 -14.319 100.619 20.747 1.00 0.00 H
+ATOM 12305 1HH1 ARG H 45 -16.473 101.851 18.186 1.00 0.00 H
+ATOM 12306 2HH1 ARG H 45 -17.842 100.926 18.785 1.00 0.00 H
+ATOM 12307 1HH2 ARG H 45 -16.028 99.498 21.448 1.00 0.00 H
+ATOM 12308 2HH2 ARG H 45 -17.601 99.569 20.631 1.00 0.00 H
+ATOM 12309 N GLN H 46 -10.719 105.012 20.691 1.00 13.31 N
+ATOM 12310 CA GLN H 46 -10.632 105.505 22.049 1.00 12.63 C
+ATOM 12311 C GLN H 46 -11.797 106.401 22.447 1.00 12.40 C
+ATOM 12312 O GLN H 46 -11.909 107.540 21.980 1.00 12.14 O
+ATOM 12313 CB GLN H 46 -9.324 106.260 22.165 1.00 11.87 C
+ATOM 12314 CG GLN H 46 -8.990 106.748 23.500 1.00 13.38 C
+ATOM 12315 CD GLN H 46 -7.583 107.225 23.522 1.00 16.40 C
+ATOM 12316 OE1 GLN H 46 -7.041 107.694 22.494 1.00 18.28 O
+ATOM 12317 NE2 GLN H 46 -6.951 107.097 24.681 1.00 13.42 N
+ATOM 12318 H GLN H 46 -10.966 105.643 19.937 1.00 0.00 H
+ATOM 12319 HA GLN H 46 -10.618 104.656 22.732 1.00 0.00 H
+ATOM 12320 1HB GLN H 46 -8.524 105.622 21.827 1.00 0.00 H
+ATOM 12321 2HB GLN H 46 -9.360 107.122 21.504 1.00 0.00 H
+ATOM 12322 1HG GLN H 46 -9.653 107.568 23.785 1.00 0.00 H
+ATOM 12323 2HG GLN H 46 -9.089 105.932 24.213 1.00 0.00 H
+ATOM 12324 1HE2 GLN H 46 -5.972 107.370 24.766 1.00 0.00 H
+ATOM 12325 2HE2 GLN H 46 -7.462 106.723 25.489 1.00 0.00 H
+ATOM 12326 N ALA H 47 -12.679 105.894 23.298 1.00 12.43 N
+ATOM 12327 CA ALA H 47 -13.822 106.672 23.732 1.00 12.89 C
+ATOM 12328 C ALA H 47 -13.261 107.822 24.560 1.00 14.25 C
+ATOM 12329 O ALA H 47 -12.241 107.622 25.222 1.00 15.21 O
+ATOM 12330 CB ALA H 47 -14.811 105.810 24.500 1.00 11.37 C
+ATOM 12331 H ALA H 47 -12.537 104.951 23.654 1.00 0.00 H
+ATOM 12332 HA ALA H 47 -14.324 107.054 22.866 1.00 0.00 H
+ATOM 12333 1HB ALA H 47 -15.660 106.401 24.812 1.00 0.00 H
+ATOM 12334 2HB ALA H 47 -15.153 105.002 23.846 1.00 0.00 H
+ATOM 12335 3HB ALA H 47 -14.323 105.391 25.354 1.00 0.00 H
+ATOM 12336 N PRO H 48 -13.878 109.008 24.582 1.00 15.30 N
+ATOM 12337 CA PRO H 48 -13.398 110.134 25.364 1.00 16.10 C
+ATOM 12338 C PRO H 48 -13.223 109.702 26.821 1.00 17.47 C
+ATOM 12339 O PRO H 48 -14.123 109.120 27.417 1.00 17.46 O
+ATOM 12340 CB PRO H 48 -14.562 111.124 25.216 1.00 15.84 C
+ATOM 12341 CG PRO H 48 -15.175 110.789 23.871 1.00 15.09 C
+ATOM 12342 CD PRO H 48 -15.102 109.278 23.793 1.00 15.56 C
+ATOM 12343 HA PRO H 48 -12.474 110.533 24.945 1.00 0.00 H
+ATOM 12344 1HB PRO H 48 -15.257 111.035 26.064 1.00 0.00 H
+ATOM 12345 2HB PRO H 48 -14.154 112.154 25.246 1.00 0.00 H
+ATOM 12346 1HG PRO H 48 -16.214 111.160 23.835 1.00 0.00 H
+ATOM 12347 2HG PRO H 48 -14.633 111.283 23.051 1.00 0.00 H
+ATOM 12348 1HD PRO H 48 -15.970 108.806 24.263 1.00 0.00 H
+ATOM 12349 2HD PRO H 48 -14.994 109.007 22.743 1.00 0.00 H
+ATOM 12350 N GLY H 49 -12.057 109.996 27.384 1.00 19.43 N
+ATOM 12351 CA GLY H 49 -11.759 109.663 28.772 1.00 20.52 C
+ATOM 12352 C GLY H 49 -11.350 108.203 29.003 1.00 21.55 C
+ATOM 12353 O GLY H 49 -11.081 107.807 30.145 1.00 22.32 O
+ATOM 12354 H GLY H 49 -11.341 110.460 26.836 1.00 0.00 H
+ATOM 12355 1HA GLY H 49 -10.966 110.316 29.138 1.00 0.00 H
+ATOM 12356 2HA GLY H 49 -12.638 109.880 29.374 1.00 0.00 H
+ATOM 12357 N LYS H 50 -11.311 107.397 27.943 1.00 21.12 N
+ATOM 12358 CA LYS H 50 -11.004 105.973 28.060 1.00 20.31 C
+ATOM 12359 C LYS H 50 -9.674 105.571 27.422 1.00 20.01 C
+ATOM 12360 O LYS H 50 -9.005 106.379 26.773 1.00 20.52 O
+ATOM 12361 CB LYS H 50 -12.134 105.142 27.464 1.00 20.70 C
+ATOM 12362 CG LYS H 50 -13.507 105.429 28.074 1.00 22.22 C
+ATOM 12363 CD LYS H 50 -13.579 105.090 29.555 1.00 26.33 C
+ATOM 12364 CE LYS H 50 -14.990 105.329 30.093 1.00 28.54 C
+ATOM 12365 NZ LYS H 50 -15.106 105.052 31.558 1.00 30.10 N
+ATOM 12366 H LYS H 50 -11.543 107.759 27.018 1.00 0.00 H
+ATOM 12367 HA LYS H 50 -10.941 105.733 29.122 1.00 0.00 H
+ATOM 12368 1HB LYS H 50 -12.185 105.338 26.395 1.00 0.00 H
+ATOM 12369 2HB LYS H 50 -11.919 104.083 27.587 1.00 0.00 H
+ATOM 12370 1HG LYS H 50 -13.748 106.482 27.924 1.00 0.00 H
+ATOM 12371 2HG LYS H 50 -14.255 104.829 27.566 1.00 0.00 H
+ATOM 12372 1HD LYS H 50 -13.306 104.048 29.709 1.00 0.00 H
+ATOM 12373 2HD LYS H 50 -12.879 105.722 30.105 1.00 0.00 H
+ATOM 12374 1HE LYS H 50 -15.257 106.368 29.910 1.00 0.00 H
+ATOM 12375 2HE LYS H 50 -15.684 104.684 29.555 1.00 0.00 H
+ATOM 12376 1HZ LYS H 50 -16.053 105.229 31.861 1.00 0.00 H
+ATOM 12377 2HZ LYS H 50 -14.869 104.089 31.739 1.00 0.00 H
+ATOM 12378 3HZ LYS H 50 -14.478 105.651 32.066 1.00 0.00 H
+ATOM 12379 N GLY H 51 -9.296 104.311 27.636 1.00 18.62 N
+ATOM 12380 CA GLY H 51 -8.078 103.766 27.047 1.00 17.34 C
+ATOM 12381 C GLY H 51 -8.335 103.276 25.632 1.00 17.14 C
+ATOM 12382 O GLY H 51 -9.392 103.530 25.056 1.00 17.13 O
+ATOM 12383 H GLY H 51 -9.873 103.709 28.202 1.00 0.00 H
+ATOM 12384 1HA GLY H 51 -7.308 104.534 27.032 1.00 0.00 H
+ATOM 12385 2HA GLY H 51 -7.707 102.947 27.664 1.00 0.00 H
+ATOM 12386 N LEU H 52 -7.368 102.565 25.072 1.00 16.72 N
+ATOM 12387 CA LEU H 52 -7.445 102.105 23.696 1.00 15.95 C
+ATOM 12388 C LEU H 52 -8.188 100.778 23.565 1.00 15.69 C
+ATOM 12389 O LEU H 52 -8.016 99.885 24.397 1.00 15.68 O
+ATOM 12390 CB LEU H 52 -6.018 101.934 23.192 1.00 14.82 C
+ATOM 12391 CG LEU H 52 -5.181 103.187 23.227 1.00 16.51 C
+ATOM 12392 CD1 LEU H 52 -3.768 102.832 22.882 1.00 17.64 C
+ATOM 12393 CD2 LEU H 52 -5.759 104.208 22.268 1.00 15.94 C
+ATOM 12394 H LEU H 52 -6.538 102.364 25.611 1.00 0.00 H
+ATOM 12395 HA LEU H 52 -7.967 102.853 23.097 1.00 0.00 H
+ATOM 12396 1HB LEU H 52 -5.524 101.208 23.821 1.00 0.00 H
+ATOM 12397 2HB LEU H 52 -6.040 101.560 22.175 1.00 0.00 H
+ATOM 12398 HG LEU H 52 -5.192 103.597 24.230 1.00 0.00 H
+ATOM 12399 1HD1 LEU H 52 -3.153 103.715 22.935 1.00 0.00 H
+ATOM 12400 2HD1 LEU H 52 -3.404 102.104 23.603 1.00 0.00 H
+ATOM 12401 3HD1 LEU H 52 -3.728 102.411 21.881 1.00 0.00 H
+ATOM 12402 1HD2 LEU H 52 -5.169 105.123 22.301 1.00 0.00 H
+ATOM 12403 2HD2 LEU H 52 -5.756 103.809 21.254 1.00 0.00 H
+ATOM 12404 3HD2 LEU H 52 -6.776 104.426 22.569 1.00 0.00 H
+ATOM 12405 N GLU H 53 -8.960 100.635 22.499 1.00 15.90 N
+ATOM 12406 CA GLU H 53 -9.669 99.392 22.222 1.00 15.67 C
+ATOM 12407 C GLU H 53 -9.519 98.985 20.763 1.00 15.21 C
+ATOM 12408 O GLU H 53 -9.778 99.764 19.854 1.00 14.90 O
+ATOM 12409 CB GLU H 53 -11.148 99.566 22.583 1.00 15.88 C
+ATOM 12410 CG GLU H 53 -12.012 98.340 22.374 1.00 18.95 C
+ATOM 12411 CD GLU H 53 -13.441 98.532 22.843 1.00 22.13 C
+ATOM 12412 OE1 GLU H 53 -14.132 99.375 22.296 1.00 24.92 O
+ATOM 12413 OE2 GLU H 53 -13.838 97.841 23.755 1.00 19.16 O
+ATOM 12414 H GLU H 53 -9.101 101.426 21.876 1.00 0.00 H
+ATOM 12415 HA GLU H 53 -9.241 98.603 22.842 1.00 0.00 H
+ATOM 12416 1HB GLU H 53 -11.229 99.855 23.631 1.00 0.00 H
+ATOM 12417 2HB GLU H 53 -11.568 100.380 21.990 1.00 0.00 H
+ATOM 12418 1HG GLU H 53 -12.021 98.089 21.311 1.00 0.00 H
+ATOM 12419 2HG GLU H 53 -11.563 97.509 22.914 1.00 0.00 H
+ATOM 12420 N TRP H 54 -9.095 97.760 20.520 1.00 14.74 N
+ATOM 12421 CA TRP H 54 -8.936 97.312 19.142 1.00 15.49 C
+ATOM 12422 C TRP H 54 -10.314 97.104 18.514 1.00 16.63 C
+ATOM 12423 O TRP H 54 -11.214 96.576 19.167 1.00 17.11 O
+ATOM 12424 CB TRP H 54 -8.113 96.037 19.117 1.00 15.04 C
+ATOM 12425 CG TRP H 54 -7.748 95.551 17.771 1.00 15.02 C
+ATOM 12426 CD1 TRP H 54 -6.652 95.915 17.045 1.00 14.04 C
+ATOM 12427 CD2 TRP H 54 -8.442 94.572 16.989 1.00 14.21 C
+ATOM 12428 NE1 TRP H 54 -6.607 95.214 15.879 1.00 12.57 N
+ATOM 12429 CE2 TRP H 54 -7.704 94.380 15.833 1.00 13.17 C
+ATOM 12430 CE3 TRP H 54 -9.597 93.850 17.182 1.00 13.57 C
+ATOM 12431 CZ2 TRP H 54 -8.077 93.489 14.898 1.00 14.64 C
+ATOM 12432 CZ3 TRP H 54 -9.975 92.943 16.214 1.00 16.02 C
+ATOM 12433 CH2 TRP H 54 -9.225 92.774 15.101 1.00 13.85 C
+ATOM 12434 H TRP H 54 -8.887 97.133 21.282 1.00 0.00 H
+ATOM 12435 HA TRP H 54 -8.412 98.078 18.576 1.00 0.00 H
+ATOM 12436 1HB TRP H 54 -7.192 96.181 19.686 1.00 0.00 H
+ATOM 12437 2HB TRP H 54 -8.674 95.246 19.610 1.00 0.00 H
+ATOM 12438 HD1 TRP H 54 -5.911 96.636 17.361 1.00 0.00 H
+ATOM 12439 HE1 TRP H 54 -5.861 95.293 15.166 1.00 0.00 H
+ATOM 12440 HE3 TRP H 54 -10.180 94.002 18.093 1.00 0.00 H
+ATOM 12441 HZ2 TRP H 54 -7.505 93.338 14.030 1.00 0.00 H
+ATOM 12442 HZ3 TRP H 54 -10.875 92.372 16.373 1.00 0.00 H
+ATOM 12443 HH2 TRP H 54 -9.524 92.065 14.355 1.00 0.00 H
+ATOM 12444 N VAL H 55 -10.473 97.511 17.257 1.00 17.15 N
+ATOM 12445 CA VAL H 55 -11.745 97.386 16.547 1.00 17.57 C
+ATOM 12446 C VAL H 55 -11.750 96.357 15.425 1.00 16.42 C
+ATOM 12447 O VAL H 55 -12.652 95.519 15.355 1.00 17.18 O
+ATOM 12448 CB VAL H 55 -12.111 98.744 15.923 1.00 17.51 C
+ATOM 12449 CG1 VAL H 55 -13.372 98.639 15.128 1.00 18.88 C
+ATOM 12450 CG2 VAL H 55 -12.258 99.752 16.998 1.00 20.25 C
+ATOM 12451 H VAL H 55 -9.698 97.943 16.771 1.00 0.00 H
+ATOM 12452 HA VAL H 55 -12.511 97.105 17.267 1.00 0.00 H
+ATOM 12453 HB VAL H 55 -11.325 99.045 15.243 1.00 0.00 H
+ATOM 12454 1HG1 VAL H 55 -13.589 99.603 14.688 1.00 0.00 H
+ATOM 12455 2HG1 VAL H 55 -13.254 97.904 14.340 1.00 0.00 H
+ATOM 12456 3HG1 VAL H 55 -14.176 98.342 15.789 1.00 0.00 H
+ATOM 12457 1HG2 VAL H 55 -12.499 100.708 16.552 1.00 0.00 H
+ATOM 12458 2HG2 VAL H 55 -13.056 99.443 17.674 1.00 0.00 H
+ATOM 12459 3HG2 VAL H 55 -11.324 99.834 17.550 1.00 0.00 H
+ATOM 12460 N ALA H 56 -10.814 96.473 14.491 1.00 15.74 N
+ATOM 12461 CA ALA H 56 -10.834 95.603 13.307 1.00 15.19 C
+ATOM 12462 C ALA H 56 -9.521 95.631 12.550 1.00 15.00 C
+ATOM 12463 O ALA H 56 -8.710 96.541 12.727 1.00 16.39 O
+ATOM 12464 CB ALA H 56 -11.961 96.031 12.363 1.00 14.61 C
+ATOM 12465 H ALA H 56 -10.084 97.173 14.615 1.00 0.00 H
+ATOM 12466 HA ALA H 56 -11.004 94.584 13.647 1.00 0.00 H
+ATOM 12467 1HB ALA H 56 -11.983 95.369 11.492 1.00 0.00 H
+ATOM 12468 2HB ALA H 56 -12.926 95.978 12.872 1.00 0.00 H
+ATOM 12469 3HB ALA H 56 -11.781 97.049 12.023 1.00 0.00 H
+ATOM 12470 N ARG H 57 -9.298 94.644 11.686 1.00 13.78 N
+ATOM 12471 CA ARG H 57 -8.120 94.743 10.829 1.00 12.51 C
+ATOM 12472 C ARG H 57 -8.316 94.067 9.487 1.00 11.99 C
+ATOM 12473 O ARG H 57 -9.193 93.223 9.300 1.00 12.58 O
+ATOM 12474 CB ARG H 57 -6.854 94.164 11.432 1.00 12.29 C
+ATOM 12475 CG ARG H 57 -6.778 92.654 11.485 1.00 9.73 C
+ATOM 12476 CD ARG H 57 -5.488 92.258 11.990 1.00 6.39 C
+ATOM 12477 NE ARG H 57 -5.169 90.825 11.787 1.00 12.08 N
+ATOM 12478 CZ ARG H 57 -3.906 90.322 11.818 1.00 9.14 C
+ATOM 12479 NH1 ARG H 57 -2.897 91.099 12.121 1.00 11.34 N
+ATOM 12480 NH2 ARG H 57 -3.680 89.036 11.615 1.00 8.35 N
+ATOM 12481 H ARG H 57 -9.980 93.898 11.589 1.00 0.00 H
+ATOM 12482 HA ARG H 57 -7.921 95.785 10.635 1.00 0.00 H
+ATOM 12483 1HB ARG H 57 -6.007 94.473 10.835 1.00 0.00 H
+ATOM 12484 2HB ARG H 57 -6.714 94.574 12.415 1.00 0.00 H
+ATOM 12485 1HG ARG H 57 -7.532 92.227 12.154 1.00 0.00 H
+ATOM 12486 2HG ARG H 57 -6.872 92.223 10.484 1.00 0.00 H
+ATOM 12487 1HD ARG H 57 -4.725 92.792 11.508 1.00 0.00 H
+ATOM 12488 2HD ARG H 57 -5.478 92.468 13.063 1.00 0.00 H
+ATOM 12489 HE ARG H 57 -5.922 90.176 11.543 1.00 0.00 H
+ATOM 12490 1HH1 ARG H 57 -2.277 90.306 11.938 1.00 0.00 H
+ATOM 12491 2HH1 ARG H 57 -1.930 91.217 12.295 1.00 0.00 H
+ATOM 12492 1HH2 ARG H 57 -4.432 88.377 11.353 1.00 0.00 H
+ATOM 12493 2HH2 ARG H 57 -2.769 88.682 11.649 1.00 0.00 H
+ATOM 12494 N ILE H 58 -7.448 94.453 8.561 1.00 11.18 N
+ATOM 12495 CA ILE H 58 -7.428 93.908 7.220 1.00 11.21 C
+ATOM 12496 C ILE H 58 -6.026 93.768 6.653 1.00 11.43 C
+ATOM 12497 O ILE H 58 -5.145 94.592 6.905 1.00 12.83 O
+ATOM 12498 CB ILE H 58 -8.263 94.772 6.277 1.00 10.35 C
+ATOM 12499 CG1 ILE H 58 -8.382 94.094 4.924 1.00 10.24 C
+ATOM 12500 CG2 ILE H 58 -7.636 96.143 6.135 1.00 11.19 C
+ATOM 12501 CD1 ILE H 58 -9.436 94.659 4.111 1.00 7.08 C
+ATOM 12502 H ILE H 58 -6.768 95.169 8.812 1.00 0.00 H
+ATOM 12503 HA ILE H 58 -7.881 92.914 7.255 1.00 0.00 H
+ATOM 12504 HB ILE H 58 -9.264 94.868 6.675 1.00 0.00 H
+ATOM 12505 1HG1 ILE H 58 -7.456 94.226 4.377 1.00 0.00 H
+ATOM 12506 2HG1 ILE H 58 -8.562 93.032 5.056 1.00 0.00 H
+ATOM 12507 1HG2 ILE H 58 -8.241 96.762 5.472 1.00 0.00 H
+ATOM 12508 2HG2 ILE H 58 -7.581 96.612 7.120 1.00 0.00 H
+ATOM 12509 3HG2 ILE H 58 -6.634 96.042 5.726 1.00 0.00 H
+ATOM 12510 1HD1 ILE H 58 -9.473 94.149 3.152 1.00 0.00 H
+ATOM 12511 2HD1 ILE H 58 -10.388 94.533 4.632 1.00 0.00 H
+ATOM 12512 3HD1 ILE H 58 -9.231 95.705 3.965 1.00 0.00 H
+ATOM 12513 N TYR H 59 -5.848 92.731 5.838 1.00 11.16 N
+ATOM 12514 CA TYR H 59 -4.625 92.537 5.059 1.00 11.23 C
+ATOM 12515 C TYR H 59 -4.944 92.758 3.580 1.00 10.88 C
+ATOM 12516 O TYR H 59 -5.293 91.790 2.894 1.00 10.72 O
+ATOM 12517 CB TYR H 59 -4.091 91.124 5.221 1.00 11.20 C
+ATOM 12518 CG TYR H 59 -2.738 90.944 4.579 1.00 14.23 C
+ATOM 12519 CD1 TYR H 59 -1.917 92.037 4.375 1.00 16.15 C
+ATOM 12520 CD2 TYR H 59 -2.315 89.693 4.211 1.00 15.83 C
+ATOM 12521 CE1 TYR H 59 -0.683 91.878 3.797 1.00 18.01 C
+ATOM 12522 CE2 TYR H 59 -1.085 89.522 3.632 1.00 16.72 C
+ATOM 12523 CZ TYR H 59 -0.264 90.612 3.427 1.00 16.44 C
+ATOM 12524 OH TYR H 59 0.968 90.430 2.850 1.00 16.77 O
+ATOM 12525 H TYR H 59 -6.613 92.069 5.738 1.00 0.00 H
+ATOM 12526 HA TYR H 59 -3.862 93.234 5.397 1.00 0.00 H
+ATOM 12527 1HB TYR H 59 -4.017 90.861 6.276 1.00 0.00 H
+ATOM 12528 2HB TYR H 59 -4.788 90.423 4.757 1.00 0.00 H
+ATOM 12529 HD1 TYR H 59 -2.246 93.022 4.673 1.00 0.00 H
+ATOM 12530 HD2 TYR H 59 -2.963 88.835 4.387 1.00 0.00 H
+ATOM 12531 HE1 TYR H 59 -0.038 92.749 3.635 1.00 0.00 H
+ATOM 12532 HE2 TYR H 59 -0.757 88.526 3.341 1.00 0.00 H
+ATOM 12533 HH TYR H 59 1.086 89.505 2.636 1.00 0.00 H
+ATOM 12534 N PRO H 60 -4.815 93.991 3.033 1.00 11.01 N
+ATOM 12535 CA PRO H 60 -5.266 94.418 1.721 1.00 11.14 C
+ATOM 12536 C PRO H 60 -4.854 93.487 0.582 1.00 11.82 C
+ATOM 12537 O PRO H 60 -5.548 93.390 -0.430 1.00 11.53 O
+ATOM 12538 CB PRO H 60 -4.597 95.790 1.577 1.00 11.52 C
+ATOM 12539 CG PRO H 60 -4.429 96.274 2.996 1.00 10.55 C
+ATOM 12540 CD PRO H 60 -4.072 95.047 3.770 1.00 10.55 C
+ATOM 12541 HA PRO H 60 -6.365 94.525 1.751 1.00 0.00 H
+ATOM 12542 1HB PRO H 60 -3.651 95.697 1.031 1.00 0.00 H
+ATOM 12543 2HB PRO H 60 -5.243 96.455 0.988 1.00 0.00 H
+ATOM 12544 1HG PRO H 60 -3.638 97.014 3.047 1.00 0.00 H
+ATOM 12545 2HG PRO H 60 -5.346 96.761 3.362 1.00 0.00 H
+ATOM 12546 1HD PRO H 60 -2.980 94.906 3.723 1.00 0.00 H
+ATOM 12547 2HD PRO H 60 -4.427 95.202 4.770 1.00 0.00 H
+ATOM 12548 N THR H 61 -3.732 92.790 0.747 1.00 12.45 N
+ATOM 12549 CA THR H 61 -3.209 91.862 -0.247 1.00 13.02 C
+ATOM 12550 C THR H 61 -4.193 90.770 -0.602 1.00 12.99 C
+ATOM 12551 O THR H 61 -4.244 90.320 -1.751 1.00 13.07 O
+ATOM 12552 CB THR H 61 -1.929 91.188 0.247 1.00 13.14 C
+ATOM 12553 OG1 THR H 61 -0.945 92.172 0.471 1.00 15.77 O
+ATOM 12554 CG2 THR H 61 -1.435 90.216 -0.742 1.00 14.37 C
+ATOM 12555 H THR H 61 -3.207 92.907 1.606 1.00 0.00 H
+ATOM 12556 HA THR H 61 -2.979 92.421 -1.156 1.00 0.00 H
+ATOM 12557 HB THR H 61 -2.141 90.665 1.171 1.00 0.00 H
+ATOM 12558 HG1 THR H 61 -1.025 92.521 1.359 1.00 0.00 H
+ATOM 12559 1HG2 THR H 61 -0.534 89.761 -0.349 1.00 0.00 H
+ATOM 12560 2HG2 THR H 61 -2.198 89.465 -0.899 1.00 0.00 H
+ATOM 12561 3HG2 THR H 61 -1.198 90.714 -1.687 1.00 0.00 H
+ATOM 12562 N ASN H 65 -4.921 90.274 0.389 1.00 12.51 N
+ATOM 12563 CA ASN H 65 -5.853 89.188 0.130 1.00 12.77 C
+ATOM 12564 C ASN H 65 -7.237 89.463 0.684 1.00 12.77 C
+ATOM 12565 O ASN H 65 -8.170 88.688 0.454 1.00 12.76 O
+ATOM 12566 CB ASN H 65 -5.283 87.900 0.662 1.00 12.65 C
+ATOM 12567 CG ASN H 65 -5.033 87.929 2.135 1.00 13.85 C
+ATOM 12568 OD1 ASN H 65 -5.675 88.636 2.926 1.00 14.46 O
+ATOM 12569 ND2 ASN H 65 -4.058 87.151 2.529 1.00 11.80 N
+ATOM 12570 H ASN H 65 -4.850 90.687 1.316 1.00 0.00 H
+ATOM 12571 HA ASN H 65 -5.959 89.096 -0.955 1.00 0.00 H
+ATOM 12572 1HB ASN H 65 -5.956 87.075 0.437 1.00 0.00 H
+ATOM 12573 2HB ASN H 65 -4.339 87.694 0.159 1.00 0.00 H
+ATOM 12574 1HD2 ASN H 65 -3.818 87.097 3.495 1.00 0.00 H
+ATOM 12575 2HD2 ASN H 65 -3.564 86.591 1.871 1.00 0.00 H
+ATOM 12576 N GLY H 66 -7.397 90.587 1.378 1.00 12.96 N
+ATOM 12577 CA GLY H 66 -8.686 90.991 1.906 1.00 13.54 C
+ATOM 12578 C GLY H 66 -9.147 90.178 3.121 1.00 13.54 C
+ATOM 12579 O GLY H 66 -10.337 90.165 3.425 1.00 13.70 O
+ATOM 12580 H GLY H 66 -6.593 91.174 1.576 1.00 0.00 H
+ATOM 12581 1HA GLY H 66 -8.626 92.047 2.182 1.00 0.00 H
+ATOM 12582 2HA GLY H 66 -9.440 90.923 1.123 1.00 0.00 H
+ATOM 12583 N TYR H 67 -8.244 89.486 3.808 1.00 13.18 N
+ATOM 12584 CA TYR H 67 -8.688 88.712 4.965 1.00 13.39 C
+ATOM 12585 C TYR H 67 -8.941 89.706 6.078 1.00 13.26 C
+ATOM 12586 O TYR H 67 -8.195 90.684 6.232 1.00 12.88 O
+ATOM 12587 CB TYR H 67 -7.690 87.630 5.377 1.00 13.22 C
+ATOM 12588 CG TYR H 67 -7.497 86.547 4.320 1.00 11.99 C
+ATOM 12589 CD1 TYR H 67 -6.473 85.653 4.457 1.00 10.02 C
+ATOM 12590 CD2 TYR H 67 -8.321 86.486 3.192 1.00 11.95 C
+ATOM 12591 CE1 TYR H 67 -6.235 84.682 3.503 1.00 8.57 C
+ATOM 12592 CE2 TYR H 67 -8.075 85.508 2.222 1.00 10.98 C
+ATOM 12593 CZ TYR H 67 -7.029 84.613 2.386 1.00 8.84 C
+ATOM 12594 OH TYR H 67 -6.777 83.648 1.430 1.00 6.70 O
+ATOM 12595 H TYR H 67 -7.277 89.491 3.524 1.00 0.00 H
+ATOM 12596 HA TYR H 67 -9.650 88.216 4.744 1.00 0.00 H
+ATOM 12597 1HB TYR H 67 -6.723 88.075 5.594 1.00 0.00 H
+ATOM 12598 2HB TYR H 67 -8.046 87.144 6.283 1.00 0.00 H
+ATOM 12599 HD1 TYR H 67 -5.845 85.707 5.332 1.00 0.00 H
+ATOM 12600 HD2 TYR H 67 -9.133 87.195 3.064 1.00 0.00 H
+ATOM 12601 HE1 TYR H 67 -5.415 83.984 3.638 1.00 0.00 H
+ATOM 12602 HE2 TYR H 67 -8.707 85.451 1.326 1.00 0.00 H
+ATOM 12603 HH TYR H 67 -7.564 83.488 0.906 1.00 0.00 H
+ATOM 12604 N THR H 68 -10.022 89.511 6.804 1.00 13.10 N
+ATOM 12605 CA THR H 68 -10.451 90.443 7.833 1.00 13.47 C
+ATOM 12606 C THR H 68 -10.880 89.866 9.184 1.00 13.49 C
+ATOM 12607 O THR H 68 -11.401 88.723 9.263 1.00 14.45 O
+ATOM 12608 CB THR H 68 -11.625 91.295 7.305 1.00 13.86 C
+ATOM 12609 OG1 THR H 68 -12.735 90.426 6.982 1.00 14.14 O
+ATOM 12610 CG2 THR H 68 -11.246 92.052 6.101 1.00 14.05 C
+ATOM 12611 H THR H 68 -10.573 88.679 6.635 1.00 0.00 H
+ATOM 12612 HA THR H 68 -9.610 91.135 8.043 1.00 0.00 H
+ATOM 12613 HB THR H 68 -11.917 91.986 8.059 1.00 0.00 H
+ATOM 12614 HG1 THR H 68 -12.489 89.845 6.246 1.00 0.00 H
+ATOM 12615 1HG2 THR H 68 -12.076 92.656 5.771 1.00 0.00 H
+ATOM 12616 2HG2 THR H 68 -10.415 92.679 6.370 1.00 0.00 H
+ATOM 12617 3HG2 THR H 68 -10.963 91.388 5.321 1.00 0.00 H
+ATOM 12618 N ARG H 69 -10.811 90.708 10.200 1.00 13.05 N
+ATOM 12619 CA ARG H 69 -11.432 90.520 11.504 1.00 13.10 C
+ATOM 12620 C ARG H 69 -12.059 91.730 12.135 1.00 13.62 C
+ATOM 12621 O ARG H 69 -11.707 92.882 11.826 1.00 14.83 O
+ATOM 12622 CB ARG H 69 -10.564 89.987 12.593 1.00 12.26 C
+ATOM 12623 CG ARG H 69 -10.503 88.558 12.827 1.00 11.97 C
+ATOM 12624 CD ARG H 69 -10.355 88.552 14.280 1.00 7.68 C
+ATOM 12625 NE ARG H 69 -10.677 87.381 14.945 1.00 8.39 N
+ATOM 12626 CZ ARG H 69 -11.141 87.488 16.235 1.00 11.90 C
+ATOM 12627 NH1 ARG H 69 -10.291 88.316 16.765 1.00 12.80 N
+ATOM 12628 NH2 ARG H 69 -12.319 87.993 16.634 1.00 10.07 N
+ATOM 12629 H ARG H 69 -10.321 91.592 10.018 1.00 0.00 H
+ATOM 12630 HA ARG H 69 -12.233 89.805 11.360 1.00 0.00 H
+ATOM 12631 1HB ARG H 69 -9.554 90.316 12.371 1.00 0.00 H
+ATOM 12632 2HB ARG H 69 -10.843 90.443 13.505 1.00 0.00 H
+ATOM 12633 1HG ARG H 69 -9.628 88.158 12.343 1.00 0.00 H
+ATOM 12634 2HG ARG H 69 -11.422 88.023 12.498 1.00 0.00 H
+ATOM 12635 1HD ARG H 69 -9.310 88.752 14.529 1.00 0.00 H
+ATOM 12636 2HD ARG H 69 -10.992 89.364 14.670 1.00 0.00 H
+ATOM 12637 HE ARG H 69 -11.397 87.013 14.363 1.00 0.00 H
+ATOM 12638 1HH1 ARG H 69 -11.003 88.506 17.475 1.00 0.00 H
+ATOM 12639 2HH1 ARG H 69 -10.070 89.009 17.471 1.00 0.00 H
+ATOM 12640 1HH2 ARG H 69 -12.586 88.889 16.241 1.00 0.00 H
+ATOM 12641 2HH2 ARG H 69 -12.341 88.279 17.584 1.00 0.00 H
+ATOM 12642 N TYR H 70 -12.927 91.445 13.088 1.00 13.71 N
+ATOM 12643 CA TYR H 70 -13.592 92.428 13.934 1.00 13.88 C
+ATOM 12644 C TYR H 70 -13.533 92.051 15.422 1.00 15.18 C
+ATOM 12645 O TYR H 70 -13.546 90.852 15.783 1.00 15.77 O
+ATOM 12646 CB TYR H 70 -15.050 92.522 13.484 1.00 12.22 C
+ATOM 12647 CG TYR H 70 -15.106 92.721 12.034 1.00 11.17 C
+ATOM 12648 CD1 TYR H 70 -15.098 93.967 11.497 1.00 11.48 C
+ATOM 12649 CD2 TYR H 70 -15.139 91.603 11.217 1.00 11.07 C
+ATOM 12650 CE1 TYR H 70 -15.101 94.101 10.141 1.00 8.97 C
+ATOM 12651 CE2 TYR H 70 -15.146 91.714 9.867 1.00 8.93 C
+ATOM 12652 CZ TYR H 70 -15.118 92.949 9.309 1.00 10.65 C
+ATOM 12653 OH TYR H 70 -15.125 93.069 7.946 1.00 11.93 O
+ATOM 12654 H TYR H 70 -13.151 90.468 13.236 1.00 0.00 H
+ATOM 12655 HA TYR H 70 -13.104 93.398 13.795 1.00 0.00 H
+ATOM 12656 1HB TYR H 70 -15.591 91.604 13.715 1.00 0.00 H
+ATOM 12657 2HB TYR H 70 -15.520 93.345 13.967 1.00 0.00 H
+ATOM 12658 HD1 TYR H 70 -15.074 94.846 12.138 1.00 0.00 H
+ATOM 12659 HD2 TYR H 70 -15.151 90.612 11.679 1.00 0.00 H
+ATOM 12660 HE1 TYR H 70 -15.083 95.094 9.729 1.00 0.00 H
+ATOM 12661 HE2 TYR H 70 -15.162 90.826 9.247 1.00 0.00 H
+ATOM 12662 HH TYR H 70 -14.990 92.195 7.556 1.00 0.00 H
+ATOM 12663 N ALA H 71 -13.498 93.050 16.295 1.00 15.05 N
+ATOM 12664 CA ALA H 71 -13.615 92.857 17.729 1.00 15.00 C
+ATOM 12665 C ALA H 71 -15.002 92.312 18.026 1.00 15.29 C
+ATOM 12666 O ALA H 71 -15.954 92.704 17.353 1.00 15.59 O
+ATOM 12667 CB ALA H 71 -13.356 94.144 18.503 1.00 15.00 C
+ATOM 12668 H ALA H 71 -13.418 94.002 15.930 1.00 0.00 H
+ATOM 12669 HA ALA H 71 -12.879 92.118 18.036 1.00 0.00 H
+ATOM 12670 1HB ALA H 71 -13.433 93.968 19.573 1.00 0.00 H
+ATOM 12671 2HB ALA H 71 -12.344 94.503 18.268 1.00 0.00 H
+ATOM 12672 3HB ALA H 71 -14.067 94.905 18.225 1.00 0.00 H
+ATOM 12673 N ASP H 72 -15.145 91.499 19.067 1.00 16.19 N
+ATOM 12674 CA ASP H 72 -16.458 90.943 19.417 1.00 16.08 C
+ATOM 12675 C ASP H 72 -17.542 92.017 19.611 1.00 16.14 C
+ATOM 12676 O ASP H 72 -18.709 91.771 19.331 1.00 17.17 O
+ATOM 12677 CB ASP H 72 -16.392 90.101 20.691 1.00 16.34 C
+ATOM 12678 CG ASP H 72 -15.691 88.745 20.528 1.00 18.65 C
+ATOM 12679 OD1 ASP H 72 -15.382 88.140 21.530 1.00 17.90 O
+ATOM 12680 OD2 ASP H 72 -15.484 88.328 19.418 1.00 20.19 O
+ATOM 12681 H ASP H 72 -14.331 91.221 19.609 1.00 0.00 H
+ATOM 12682 HA ASP H 72 -16.775 90.306 18.590 1.00 0.00 H
+ATOM 12683 1HB ASP H 72 -15.878 90.662 21.466 1.00 0.00 H
+ATOM 12684 2HB ASP H 72 -17.409 89.912 21.055 1.00 0.00 H
+ATOM 12685 N SER H 73 -17.150 93.190 20.105 1.00 15.96 N
+ATOM 12686 CA SER H 73 -18.132 94.241 20.360 1.00 15.25 C
+ATOM 12687 C SER H 73 -18.642 94.952 19.099 1.00 15.47 C
+ATOM 12688 O SER H 73 -19.612 95.704 19.174 1.00 15.14 O
+ATOM 12689 CB SER H 73 -17.548 95.284 21.297 1.00 15.40 C
+ATOM 12690 OG SER H 73 -16.520 96.005 20.686 1.00 15.23 O
+ATOM 12691 H SER H 73 -16.182 93.347 20.307 1.00 0.00 H
+ATOM 12692 HA SER H 73 -18.984 93.787 20.859 1.00 0.00 H
+ATOM 12693 1HB SER H 73 -18.345 95.967 21.598 1.00 0.00 H
+ATOM 12694 2HB SER H 73 -17.177 94.802 22.196 1.00 0.00 H
+ATOM 12695 HG SER H 73 -15.783 95.399 20.599 1.00 0.00 H
+ATOM 12696 N VAL H 74 -17.977 94.750 17.955 1.00 15.57 N
+ATOM 12697 CA VAL H 74 -18.415 95.429 16.735 1.00 15.93 C
+ATOM 12698 C VAL H 74 -18.705 94.419 15.621 1.00 16.68 C
+ATOM 12699 O VAL H 74 -19.278 94.768 14.580 1.00 16.62 O
+ATOM 12700 CB VAL H 74 -17.364 96.439 16.262 1.00 16.00 C
+ATOM 12701 CG1 VAL H 74 -17.118 97.492 17.361 1.00 15.70 C
+ATOM 12702 CG2 VAL H 74 -16.098 95.723 15.843 1.00 16.22 C
+ATOM 12703 H VAL H 74 -17.191 94.116 17.916 1.00 0.00 H
+ATOM 12704 HA VAL H 74 -19.336 95.970 16.942 1.00 0.00 H
+ATOM 12705 HB VAL H 74 -17.761 96.957 15.436 1.00 0.00 H
+ATOM 12706 1HG1 VAL H 74 -16.403 98.232 17.021 1.00 0.00 H
+ATOM 12707 2HG1 VAL H 74 -18.059 97.995 17.607 1.00 0.00 H
+ATOM 12708 3HG1 VAL H 74 -16.726 97.008 18.249 1.00 0.00 H
+ATOM 12709 1HG2 VAL H 74 -15.370 96.436 15.486 1.00 0.00 H
+ATOM 12710 2HG2 VAL H 74 -15.695 95.182 16.681 1.00 0.00 H
+ATOM 12711 3HG2 VAL H 74 -16.336 95.037 15.051 1.00 0.00 H
+ATOM 12712 N LYS H 75 -18.312 93.173 15.853 1.00 18.16 N
+ATOM 12713 CA LYS H 75 -18.523 92.110 14.891 1.00 19.24 C
+ATOM 12714 C LYS H 75 -20.009 91.955 14.607 1.00 18.46 C
+ATOM 12715 O LYS H 75 -20.831 91.952 15.519 1.00 18.63 O
+ATOM 12716 CB LYS H 75 -17.934 90.795 15.393 1.00 20.66 C
+ATOM 12717 CG LYS H 75 -18.040 89.665 14.401 1.00 24.17 C
+ATOM 12718 CD LYS H 75 -17.351 88.421 14.906 1.00 28.10 C
+ATOM 12719 CE LYS H 75 -17.520 87.273 13.929 1.00 32.19 C
+ATOM 12720 NZ LYS H 75 -16.971 86.011 14.462 1.00 32.73 N
+ATOM 12721 H LYS H 75 -17.821 92.951 16.714 1.00 0.00 H
+ATOM 12722 HA LYS H 75 -18.027 92.391 13.959 1.00 0.00 H
+ATOM 12723 1HB LYS H 75 -16.878 90.927 15.645 1.00 0.00 H
+ATOM 12724 2HB LYS H 75 -18.444 90.495 16.306 1.00 0.00 H
+ATOM 12725 1HG LYS H 75 -19.094 89.436 14.236 1.00 0.00 H
+ATOM 12726 2HG LYS H 75 -17.594 89.972 13.454 1.00 0.00 H
+ATOM 12727 1HD LYS H 75 -16.282 88.631 15.019 1.00 0.00 H
+ATOM 12728 2HD LYS H 75 -17.752 88.145 15.880 1.00 0.00 H
+ATOM 12729 1HE LYS H 75 -18.577 87.136 13.719 1.00 0.00 H
+ATOM 12730 2HE LYS H 75 -17.001 87.513 13.002 1.00 0.00 H
+ATOM 12731 1HZ LYS H 75 -17.106 85.275 13.785 1.00 0.00 H
+ATOM 12732 2HZ LYS H 75 -15.991 86.120 14.650 1.00 0.00 H
+ATOM 12733 3HZ LYS H 75 -17.452 85.775 15.316 1.00 0.00 H
+ATOM 12734 N GLY H 76 -20.349 91.863 13.332 1.00 17.61 N
+ATOM 12735 CA GLY H 76 -21.739 91.740 12.899 1.00 16.37 C
+ATOM 12736 C GLY H 76 -22.320 93.104 12.521 1.00 16.10 C
+ATOM 12737 O GLY H 76 -23.378 93.176 11.894 1.00 15.42 O
+ATOM 12738 H GLY H 76 -19.622 91.871 12.634 1.00 0.00 H
+ATOM 12739 1HA GLY H 76 -21.796 91.066 12.047 1.00 0.00 H
+ATOM 12740 2HA GLY H 76 -22.334 91.301 13.697 1.00 0.00 H
+ATOM 12741 N ARG H 77 -21.620 94.175 12.882 1.00 16.05 N
+ATOM 12742 CA ARG H 77 -22.063 95.526 12.556 1.00 15.90 C
+ATOM 12743 C ARG H 77 -21.042 96.238 11.666 1.00 16.27 C
+ATOM 12744 O ARG H 77 -21.405 97.024 10.796 1.00 16.99 O
+ATOM 12745 CB ARG H 77 -22.252 96.346 13.814 1.00 15.64 C
+ATOM 12746 CG ARG H 77 -23.380 95.921 14.721 1.00 14.36 C
+ATOM 12747 CD ARG H 77 -23.565 96.926 15.793 1.00 14.12 C
+ATOM 12748 NE ARG H 77 -22.429 96.966 16.695 1.00 15.67 N
+ATOM 12749 CZ ARG H 77 -21.916 98.100 17.217 1.00 15.01 C
+ATOM 12750 NH1 ARG H 77 -22.440 99.272 16.923 1.00 10.45 N
+ATOM 12751 NH2 ARG H 77 -20.870 98.053 18.028 1.00 11.54 N
+ATOM 12752 H ARG H 77 -20.766 94.067 13.419 1.00 0.00 H
+ATOM 12753 HA ARG H 77 -23.016 95.476 12.028 1.00 0.00 H
+ATOM 12754 1HB ARG H 77 -21.341 96.306 14.405 1.00 0.00 H
+ATOM 12755 2HB ARG H 77 -22.411 97.381 13.549 1.00 0.00 H
+ATOM 12756 1HG ARG H 77 -24.304 95.839 14.149 1.00 0.00 H
+ATOM 12757 2HG ARG H 77 -23.139 94.960 15.179 1.00 0.00 H
+ATOM 12758 1HD ARG H 77 -23.673 97.915 15.344 1.00 0.00 H
+ATOM 12759 2HD ARG H 77 -24.457 96.688 16.367 1.00 0.00 H
+ATOM 12760 HE ARG H 77 -21.993 96.088 16.951 1.00 0.00 H
+ATOM 12761 1HH1 ARG H 77 -23.258 99.368 16.310 1.00 0.00 H
+ATOM 12762 2HH1 ARG H 77 -22.024 100.112 17.324 1.00 0.00 H
+ATOM 12763 1HH2 ARG H 77 -20.442 97.153 18.286 1.00 0.00 H
+ATOM 12764 2HH2 ARG H 77 -20.474 98.930 18.398 1.00 0.00 H
+ATOM 12765 N PHE H 78 -19.756 95.957 11.906 1.00 16.93 N
+ATOM 12766 CA PHE H 78 -18.712 96.625 11.117 1.00 16.85 C
+ATOM 12767 C PHE H 78 -18.211 95.740 9.971 1.00 16.89 C
+ATOM 12768 O PHE H 78 -18.124 94.521 10.090 1.00 16.80 O
+ATOM 12769 CB PHE H 78 -17.503 97.006 11.991 1.00 16.45 C
+ATOM 12770 CG PHE H 78 -17.721 98.105 13.010 1.00 16.18 C
+ATOM 12771 CD1 PHE H 78 -18.987 98.565 13.357 1.00 15.58 C
+ATOM 12772 CD2 PHE H 78 -16.628 98.678 13.642 1.00 16.04 C
+ATOM 12773 CE1 PHE H 78 -19.155 99.541 14.308 1.00 17.19 C
+ATOM 12774 CE2 PHE H 78 -16.795 99.668 14.593 1.00 17.01 C
+ATOM 12775 CZ PHE H 78 -18.061 100.095 14.928 1.00 17.15 C
+ATOM 12776 H PHE H 78 -19.506 95.332 12.655 1.00 0.00 H
+ATOM 12777 HA PHE H 78 -19.130 97.519 10.682 1.00 0.00 H
+ATOM 12778 1HB PHE H 78 -17.166 96.130 12.530 1.00 0.00 H
+ATOM 12779 2HB PHE H 78 -16.688 97.313 11.336 1.00 0.00 H
+ATOM 12780 HD1 PHE H 78 -19.845 98.151 12.885 1.00 0.00 H
+ATOM 12781 HD2 PHE H 78 -15.632 98.328 13.384 1.00 0.00 H
+ATOM 12782 HE1 PHE H 78 -20.161 99.877 14.566 1.00 0.00 H
+ATOM 12783 HE2 PHE H 78 -15.930 100.101 15.081 1.00 0.00 H
+ATOM 12784 HZ PHE H 78 -18.197 100.874 15.679 1.00 0.00 H
+ATOM 12785 N THR H 79 -17.865 96.410 8.871 1.00 16.70 N
+ATOM 12786 CA THR H 79 -17.201 95.770 7.724 1.00 16.68 C
+ATOM 12787 C THR H 79 -15.911 96.544 7.397 1.00 16.34 C
+ATOM 12788 O THR H 79 -15.924 97.762 7.255 1.00 16.06 O
+ATOM 12789 CB THR H 79 -18.139 95.729 6.500 1.00 16.20 C
+ATOM 12790 OG1 THR H 79 -19.315 94.958 6.812 1.00 16.84 O
+ATOM 12791 CG2 THR H 79 -17.417 95.104 5.317 1.00 16.33 C
+ATOM 12792 H THR H 79 -18.026 97.408 8.840 1.00 0.00 H
+ATOM 12793 HA THR H 79 -16.950 94.751 7.985 1.00 0.00 H
+ATOM 12794 HB THR H 79 -18.442 96.733 6.242 1.00 0.00 H
+ATOM 12795 HG1 THR H 79 -19.062 94.113 7.185 1.00 0.00 H
+ATOM 12796 1HG2 THR H 79 -18.081 95.072 4.459 1.00 0.00 H
+ATOM 12797 2HG2 THR H 79 -16.521 95.683 5.063 1.00 0.00 H
+ATOM 12798 3HG2 THR H 79 -17.126 94.095 5.591 1.00 0.00 H
+ATOM 12799 N ILE H 80 -14.796 95.832 7.239 1.00 15.88 N
+ATOM 12800 CA ILE H 80 -13.541 96.507 6.945 1.00 16.44 C
+ATOM 12801 C ILE H 80 -13.079 96.095 5.549 1.00 17.26 C
+ATOM 12802 O ILE H 80 -13.288 94.962 5.134 1.00 17.90 O
+ATOM 12803 CB ILE H 80 -12.475 96.175 8.014 1.00 15.83 C
+ATOM 12804 CG1 ILE H 80 -11.277 97.027 7.818 1.00 14.24 C
+ATOM 12805 CG2 ILE H 80 -12.048 94.775 7.925 1.00 17.72 C
+ATOM 12806 CD1 ILE H 80 -10.357 96.946 8.912 1.00 9.69 C
+ATOM 12807 H ILE H 80 -14.828 94.836 7.352 1.00 0.00 H
+ATOM 12808 HA ILE H 80 -13.694 97.578 6.946 1.00 0.00 H
+ATOM 12809 HB ILE H 80 -12.884 96.369 9.008 1.00 0.00 H
+ATOM 12810 1HG1 ILE H 80 -10.768 96.731 6.914 1.00 0.00 H
+ATOM 12811 2HG1 ILE H 80 -11.580 98.052 7.726 1.00 0.00 H
+ATOM 12812 1HG2 ILE H 80 -11.304 94.568 8.688 1.00 0.00 H
+ATOM 12813 2HG2 ILE H 80 -12.890 94.125 8.064 1.00 0.00 H
+ATOM 12814 3HG2 ILE H 80 -11.623 94.618 6.945 1.00 0.00 H
+ATOM 12815 1HD1 ILE H 80 -9.501 97.585 8.698 1.00 0.00 H
+ATOM 12816 2HD1 ILE H 80 -10.849 97.265 9.817 1.00 0.00 H
+ATOM 12817 3HD1 ILE H 80 -10.045 95.942 9.010 1.00 0.00 H
+ATOM 12818 N SER H 81 -12.507 97.047 4.815 1.00 18.40 N
+ATOM 12819 CA SER H 81 -12.082 96.791 3.439 1.00 19.49 C
+ATOM 12820 C SER H 81 -10.887 97.658 3.063 1.00 19.98 C
+ATOM 12821 O SER H 81 -10.417 98.465 3.855 1.00 20.15 O
+ATOM 12822 CB SER H 81 -13.245 97.011 2.494 1.00 19.41 C
+ATOM 12823 OG SER H 81 -13.622 98.358 2.453 1.00 19.80 O
+ATOM 12824 H SER H 81 -12.360 97.968 5.223 1.00 0.00 H
+ATOM 12825 HA SER H 81 -11.800 95.746 3.356 1.00 0.00 H
+ATOM 12826 1HB SER H 81 -12.975 96.672 1.492 1.00 0.00 H
+ATOM 12827 2HB SER H 81 -14.084 96.410 2.825 1.00 0.00 H
+ATOM 12828 HG SER H 81 -13.876 98.584 3.355 1.00 0.00 H
+ATOM 12829 N ALA H 82 -10.354 97.444 1.856 1.00 21.08 N
+ATOM 12830 CA ALA H 82 -9.221 98.242 1.410 1.00 21.24 C
+ATOM 12831 C ALA H 82 -9.139 98.290 -0.102 1.00 21.71 C
+ATOM 12832 O ALA H 82 -9.579 97.354 -0.790 1.00 22.22 O
+ATOM 12833 CB ALA H 82 -7.923 97.689 1.976 1.00 21.29 C
+ATOM 12834 H ALA H 82 -10.760 96.752 1.248 1.00 0.00 H
+ATOM 12835 HA ALA H 82 -9.356 99.261 1.762 1.00 0.00 H
+ATOM 12836 1HB ALA H 82 -7.110 98.312 1.642 1.00 0.00 H
+ATOM 12837 2HB ALA H 82 -7.964 97.689 3.063 1.00 0.00 H
+ATOM 12838 3HB ALA H 82 -7.783 96.671 1.620 1.00 0.00 H
+ATOM 12839 N ASP H 83 -8.549 99.356 -0.624 1.00 21.71 N
+ATOM 12840 CA ASP H 83 -8.319 99.525 -2.048 1.00 21.25 C
+ATOM 12841 C ASP H 83 -6.832 99.703 -2.349 1.00 21.38 C
+ATOM 12842 O ASP H 83 -6.259 100.776 -2.137 1.00 21.55 O
+ATOM 12843 CB ASP H 83 -9.148 100.683 -2.603 1.00 20.84 C
+ATOM 12844 CG ASP H 83 -8.975 100.916 -4.108 1.00 21.05 C
+ATOM 12845 OD1 ASP H 83 -7.917 100.591 -4.632 1.00 19.86 O
+ATOM 12846 OD2 ASP H 83 -9.897 101.438 -4.727 1.00 21.18 O
+ATOM 12847 H ASP H 83 -8.230 100.091 0.014 1.00 0.00 H
+ATOM 12848 HA ASP H 83 -8.645 98.616 -2.556 1.00 0.00 H
+ATOM 12849 1HB ASP H 83 -10.202 100.504 -2.393 1.00 0.00 H
+ATOM 12850 2HB ASP H 83 -8.864 101.594 -2.079 1.00 0.00 H
+ATOM 12851 N THR H 84 -6.230 98.630 -2.844 1.00 21.51 N
+ATOM 12852 CA THR H 84 -4.794 98.588 -3.116 1.00 21.38 C
+ATOM 12853 C THR H 84 -4.373 99.666 -4.114 1.00 21.07 C
+ATOM 12854 O THR H 84 -3.318 100.282 -3.951 1.00 20.99 O
+ATOM 12855 CB THR H 84 -4.385 97.215 -3.669 1.00 21.68 C
+ATOM 12856 OG1 THR H 84 -4.691 96.198 -2.717 1.00 22.15 O
+ATOM 12857 CG2 THR H 84 -2.884 97.195 -3.958 1.00 23.09 C
+ATOM 12858 H THR H 84 -6.778 97.801 -3.016 1.00 0.00 H
+ATOM 12859 HA THR H 84 -4.265 98.763 -2.182 1.00 0.00 H
+ATOM 12860 HB THR H 84 -4.933 97.011 -4.590 1.00 0.00 H
+ATOM 12861 HG1 THR H 84 -4.212 96.362 -1.905 1.00 0.00 H
+ATOM 12862 1HG2 THR H 84 -2.604 96.212 -4.341 1.00 0.00 H
+ATOM 12863 2HG2 THR H 84 -2.632 97.960 -4.698 1.00 0.00 H
+ATOM 12864 3HG2 THR H 84 -2.338 97.395 -3.037 1.00 0.00 H
+ATOM 12865 N SER H 85 -5.163 99.858 -5.178 1.00 20.18 N
+ATOM 12866 CA SER H 85 -4.797 100.805 -6.231 1.00 19.46 C
+ATOM 12867 C SER H 85 -4.880 102.253 -5.753 1.00 18.91 C
+ATOM 12868 O SER H 85 -4.148 103.118 -6.239 1.00 19.30 O
+ATOM 12869 CB SER H 85 -5.682 100.600 -7.449 1.00 19.67 C
+ATOM 12870 OG SER H 85 -7.000 101.021 -7.209 1.00 20.42 O
+ATOM 12871 H SER H 85 -6.043 99.357 -5.243 1.00 0.00 H
+ATOM 12872 HA SER H 85 -3.767 100.603 -6.525 1.00 0.00 H
+ATOM 12873 1HB SER H 85 -5.278 101.134 -8.301 1.00 0.00 H
+ATOM 12874 2HB SER H 85 -5.684 99.538 -7.699 1.00 0.00 H
+ATOM 12875 HG SER H 85 -7.234 100.752 -6.293 1.00 0.00 H
+ATOM 12876 N LYS H 86 -5.720 102.508 -4.744 1.00 17.60 N
+ATOM 12877 CA LYS H 86 -5.800 103.837 -4.146 1.00 16.76 C
+ATOM 12878 C LYS H 86 -4.827 103.943 -2.974 1.00 16.27 C
+ATOM 12879 O LYS H 86 -4.469 105.038 -2.536 1.00 16.41 O
+ATOM 12880 CB LYS H 86 -7.211 104.156 -3.665 1.00 16.44 C
+ATOM 12881 CG LYS H 86 -8.241 104.268 -4.775 1.00 15.41 C
+ATOM 12882 CD LYS H 86 -9.605 104.662 -4.216 1.00 14.58 C
+ATOM 12883 CE LYS H 86 -10.656 104.693 -5.297 1.00 13.20 C
+ATOM 12884 NZ LYS H 86 -11.105 103.315 -5.650 1.00 11.10 N
+ATOM 12885 H LYS H 86 -6.346 101.760 -4.429 1.00 0.00 H
+ATOM 12886 HA LYS H 86 -5.513 104.577 -4.891 1.00 0.00 H
+ATOM 12887 1HB LYS H 86 -7.536 103.380 -2.975 1.00 0.00 H
+ATOM 12888 2HB LYS H 86 -7.201 105.095 -3.118 1.00 0.00 H
+ATOM 12889 1HG LYS H 86 -7.918 105.027 -5.486 1.00 0.00 H
+ATOM 12890 2HG LYS H 86 -8.317 103.320 -5.306 1.00 0.00 H
+ATOM 12891 1HD LYS H 86 -9.908 103.914 -3.480 1.00 0.00 H
+ATOM 12892 2HD LYS H 86 -9.551 105.634 -3.725 1.00 0.00 H
+ATOM 12893 1HE LYS H 86 -11.512 105.272 -4.957 1.00 0.00 H
+ATOM 12894 2HE LYS H 86 -10.236 105.165 -6.188 1.00 0.00 H
+ATOM 12895 1HZ LYS H 86 -11.801 103.349 -6.372 1.00 0.00 H
+ATOM 12896 2HZ LYS H 86 -10.310 102.745 -5.961 1.00 0.00 H
+ATOM 12897 3HZ LYS H 86 -11.485 102.861 -4.832 1.00 0.00 H
+ATOM 12898 N ASN H 87 -4.392 102.782 -2.490 1.00 15.81 N
+ATOM 12899 CA ASN H 87 -3.505 102.639 -1.350 1.00 15.26 C
+ATOM 12900 C ASN H 87 -4.182 103.219 -0.109 1.00 15.26 C
+ATOM 12901 O ASN H 87 -3.551 103.951 0.665 1.00 15.11 O
+ATOM 12902 CB ASN H 87 -2.171 103.315 -1.618 1.00 14.65 C
+ATOM 12903 CG ASN H 87 -1.069 102.691 -0.849 1.00 13.69 C
+ATOM 12904 OD1 ASN H 87 -1.099 101.466 -0.728 1.00 10.37 O
+ATOM 12905 ND2 ASN H 87 -0.124 103.456 -0.365 1.00 10.61 N
+ATOM 12906 H ASN H 87 -4.745 101.928 -2.907 1.00 0.00 H
+ATOM 12907 HA ASN H 87 -3.341 101.576 -1.176 1.00 0.00 H
+ATOM 12908 1HB ASN H 87 -1.940 103.273 -2.683 1.00 0.00 H
+ATOM 12909 2HB ASN H 87 -2.231 104.365 -1.330 1.00 0.00 H
+ATOM 12910 1HD2 ASN H 87 0.658 103.063 0.151 1.00 0.00 H
+ATOM 12911 2HD2 ASN H 87 -0.165 104.447 -0.518 1.00 0.00 H
+ATOM 12912 N THR H 88 -5.481 102.925 0.031 1.00 15.25 N
+ATOM 12913 CA THR H 88 -6.305 103.405 1.141 1.00 15.66 C
+ATOM 12914 C THR H 88 -7.081 102.285 1.845 1.00 14.94 C
+ATOM 12915 O THR H 88 -7.673 101.420 1.195 1.00 14.87 O
+ATOM 12916 CB THR H 88 -7.309 104.467 0.637 1.00 15.97 C
+ATOM 12917 OG1 THR H 88 -6.601 105.562 0.044 1.00 17.65 O
+ATOM 12918 CG2 THR H 88 -8.175 104.987 1.770 1.00 17.16 C
+ATOM 12919 H THR H 88 -5.897 102.309 -0.673 1.00 0.00 H
+ATOM 12920 HA THR H 88 -5.646 103.861 1.881 1.00 0.00 H
+ATOM 12921 HB THR H 88 -7.949 104.020 -0.117 1.00 0.00 H
+ATOM 12922 HG1 THR H 88 -5.847 105.798 0.583 1.00 0.00 H
+ATOM 12923 1HG2 THR H 88 -8.868 105.727 1.382 1.00 0.00 H
+ATOM 12924 2HG2 THR H 88 -8.737 104.179 2.213 1.00 0.00 H
+ATOM 12925 3HG2 THR H 88 -7.559 105.439 2.512 1.00 0.00 H
+ATOM 12926 N ALA H 89 -7.092 102.302 3.177 1.00 14.45 N
+ATOM 12927 CA ALA H 89 -7.895 101.346 3.943 1.00 14.15 C
+ATOM 12928 C ALA H 89 -9.208 102.002 4.377 1.00 14.30 C
+ATOM 12929 O ALA H 89 -9.270 103.225 4.553 1.00 13.73 O
+ATOM 12930 CB ALA H 89 -7.124 100.823 5.140 1.00 13.90 C
+ATOM 12931 H ALA H 89 -6.562 103.023 3.667 1.00 0.00 H
+ATOM 12932 HA ALA H 89 -8.142 100.503 3.299 1.00 0.00 H
+ATOM 12933 1HB ALA H 89 -7.744 100.102 5.678 1.00 0.00 H
+ATOM 12934 2HB ALA H 89 -6.212 100.335 4.796 1.00 0.00 H
+ATOM 12935 3HB ALA H 89 -6.866 101.640 5.803 1.00 0.00 H
+ATOM 12936 N TYR H 90 -10.263 101.206 4.540 1.00 13.94 N
+ATOM 12937 CA TYR H 90 -11.555 101.748 4.959 1.00 14.16 C
+ATOM 12938 C TYR H 90 -12.226 100.945 6.084 1.00 14.06 C
+ATOM 12939 O TYR H 90 -12.103 99.721 6.153 1.00 14.25 O
+ATOM 12940 CB TYR H 90 -12.515 101.761 3.772 1.00 14.02 C
+ATOM 12941 CG TYR H 90 -12.023 102.490 2.556 1.00 16.37 C
+ATOM 12942 CD1 TYR H 90 -12.326 103.822 2.344 1.00 19.30 C
+ATOM 12943 CD2 TYR H 90 -11.273 101.790 1.633 1.00 17.63 C
+ATOM 12944 CE1 TYR H 90 -11.879 104.446 1.195 1.00 18.81 C
+ATOM 12945 CE2 TYR H 90 -10.826 102.402 0.501 1.00 17.22 C
+ATOM 12946 CZ TYR H 90 -11.126 103.723 0.271 1.00 18.51 C
+ATOM 12947 OH TYR H 90 -10.680 104.322 -0.878 1.00 22.24 O
+ATOM 12948 H TYR H 90 -10.183 100.211 4.360 1.00 0.00 H
+ATOM 12949 HA TYR H 90 -11.392 102.761 5.321 1.00 0.00 H
+ATOM 12950 1HB TYR H 90 -12.735 100.733 3.477 1.00 0.00 H
+ATOM 12951 2HB TYR H 90 -13.455 102.218 4.079 1.00 0.00 H
+ATOM 12952 HD1 TYR H 90 -12.920 104.371 3.076 1.00 0.00 H
+ATOM 12953 HD2 TYR H 90 -11.046 100.742 1.812 1.00 0.00 H
+ATOM 12954 HE1 TYR H 90 -12.117 105.495 1.016 1.00 0.00 H
+ATOM 12955 HE2 TYR H 90 -10.240 101.841 -0.217 1.00 0.00 H
+ATOM 12956 HH TYR H 90 -9.949 103.805 -1.226 1.00 0.00 H
+ATOM 12957 N LEU H 91 -13.016 101.629 6.912 1.00 13.42 N
+ATOM 12958 CA LEU H 91 -13.834 100.945 7.924 1.00 12.91 C
+ATOM 12959 C LEU H 91 -15.290 101.404 7.806 1.00 13.41 C
+ATOM 12960 O LEU H 91 -15.599 102.581 7.965 1.00 14.05 O
+ATOM 12961 CB LEU H 91 -13.314 101.216 9.356 1.00 12.88 C
+ATOM 12962 CG LEU H 91 -14.135 100.572 10.503 1.00 11.07 C
+ATOM 12963 CD1 LEU H 91 -14.050 99.047 10.388 1.00 10.36 C
+ATOM 12964 CD2 LEU H 91 -13.618 101.064 11.860 1.00 10.97 C
+ATOM 12965 H LEU H 91 -13.064 102.638 6.799 1.00 0.00 H
+ATOM 12966 HA LEU H 91 -13.801 99.872 7.741 1.00 0.00 H
+ATOM 12967 1HB LEU H 91 -12.306 100.829 9.434 1.00 0.00 H
+ATOM 12968 2HB LEU H 91 -13.284 102.285 9.535 1.00 0.00 H
+ATOM 12969 HG LEU H 91 -15.174 100.851 10.397 1.00 0.00 H
+ATOM 12970 1HD1 LEU H 91 -14.639 98.589 11.177 1.00 0.00 H
+ATOM 12971 2HD1 LEU H 91 -14.440 98.737 9.418 1.00 0.00 H
+ATOM 12972 3HD1 LEU H 91 -13.012 98.735 10.481 1.00 0.00 H
+ATOM 12973 1HD2 LEU H 91 -14.213 100.616 12.651 1.00 0.00 H
+ATOM 12974 2HD2 LEU H 91 -12.579 100.780 11.980 1.00 0.00 H
+ATOM 12975 3HD2 LEU H 91 -13.706 102.145 11.916 1.00 0.00 H
+ATOM 12976 N GLN H 92 -16.184 100.471 7.499 1.00 13.46 N
+ATOM 12977 CA GLN H 92 -17.602 100.775 7.314 1.00 13.62 C
+ATOM 12978 C GLN H 92 -18.396 100.351 8.530 1.00 13.43 C
+ATOM 12979 O GLN H 92 -18.522 99.167 8.831 1.00 13.93 O
+ATOM 12980 CB GLN H 92 -18.157 100.055 6.083 1.00 13.75 C
+ATOM 12981 CG GLN H 92 -19.651 100.277 5.859 1.00 15.32 C
+ATOM 12982 CD GLN H 92 -20.000 101.677 5.344 1.00 18.72 C
+ATOM 12983 OE1 GLN H 92 -19.636 102.042 4.218 1.00 19.65 O
+ATOM 12984 NE2 GLN H 92 -20.695 102.462 6.163 1.00 20.46 N
+ATOM 12985 H GLN H 92 -15.890 99.512 7.394 1.00 0.00 H
+ATOM 12986 HA GLN H 92 -17.728 101.846 7.193 1.00 0.00 H
+ATOM 12987 1HB GLN H 92 -17.631 100.393 5.196 1.00 0.00 H
+ATOM 12988 2HB GLN H 92 -17.974 98.989 6.182 1.00 0.00 H
+ATOM 12989 1HG GLN H 92 -20.013 99.543 5.138 1.00 0.00 H
+ATOM 12990 2HG GLN H 92 -20.162 100.135 6.814 1.00 0.00 H
+ATOM 12991 1HE2 GLN H 92 -20.951 103.387 5.882 1.00 0.00 H
+ATOM 12992 2HE2 GLN H 92 -20.942 102.124 7.076 1.00 0.00 H
+ATOM 12993 N MET H 93 -18.913 101.319 9.256 1.00 13.09 N
+ATOM 12994 CA MET H 93 -19.597 100.989 10.484 1.00 13.14 C
+ATOM 12995 C MET H 93 -21.099 101.151 10.362 1.00 12.96 C
+ATOM 12996 O MET H 93 -21.579 102.258 10.103 1.00 12.79 O
+ATOM 12997 CB MET H 93 -19.042 101.881 11.560 1.00 13.43 C
+ATOM 12998 CG MET H 93 -17.548 101.800 11.682 1.00 15.37 C
+ATOM 12999 SD MET H 93 -16.894 102.833 12.964 1.00 19.30 S
+ATOM 13000 CE MET H 93 -17.175 104.404 12.238 1.00 19.08 C
+ATOM 13001 H MET H 93 -18.810 102.296 8.986 1.00 0.00 H
+ATOM 13002 HA MET H 93 -19.392 99.950 10.736 1.00 0.00 H
+ATOM 13003 1HB MET H 93 -19.308 102.914 11.358 1.00 0.00 H
+ATOM 13004 2HB MET H 93 -19.474 101.593 12.487 1.00 0.00 H
+ATOM 13005 1HG MET H 93 -17.252 100.783 11.859 1.00 0.00 H
+ATOM 13006 2HG MET H 93 -17.107 102.124 10.735 1.00 0.00 H
+ATOM 13007 1HE MET H 93 -16.801 105.168 12.894 1.00 0.00 H
+ATOM 13008 2HE MET H 93 -16.670 104.445 11.293 1.00 0.00 H
+ATOM 13009 3HE MET H 93 -18.235 104.548 12.075 1.00 0.00 H
+ATOM 13010 N ASN H 94 -21.845 100.054 10.532 1.00 13.17 N
+ATOM 13011 CA ASN H 94 -23.301 100.099 10.447 1.00 13.34 C
+ATOM 13012 C ASN H 94 -23.923 99.998 11.833 1.00 13.71 C
+ATOM 13013 O ASN H 94 -23.289 99.513 12.765 1.00 14.14 O
+ATOM 13014 CB ASN H 94 -23.831 98.997 9.540 1.00 13.42 C
+ATOM 13015 CG ASN H 94 -23.453 99.169 8.063 1.00 13.75 C
+ATOM 13016 OD1 ASN H 94 -23.571 100.259 7.473 1.00 14.10 O
+ATOM 13017 ND2 ASN H 94 -23.003 98.095 7.457 1.00 11.58 N
+ATOM 13018 H ASN H 94 -21.413 99.149 10.712 1.00 0.00 H
+ATOM 13019 HA ASN H 94 -23.600 101.060 10.043 1.00 0.00 H
+ATOM 13020 1HB ASN H 94 -23.460 98.037 9.887 1.00 0.00 H
+ATOM 13021 2HB ASN H 94 -24.918 98.963 9.618 1.00 0.00 H
+ATOM 13022 1HD2 ASN H 94 -22.739 98.134 6.494 1.00 0.00 H
+ATOM 13023 2HD2 ASN H 94 -22.923 97.229 7.956 1.00 0.00 H
+ATOM 13024 N SER H 95 -25.162 100.467 11.956 1.00 14.78 N
+ATOM 13025 CA SER H 95 -25.908 100.378 13.207 1.00 15.08 C
+ATOM 13026 C SER H 95 -25.107 100.935 14.380 1.00 15.15 C
+ATOM 13027 O SER H 95 -24.943 100.267 15.409 1.00 15.45 O
+ATOM 13028 CB SER H 95 -26.306 98.944 13.477 1.00 14.99 C
+ATOM 13029 OG SER H 95 -27.330 98.887 14.429 1.00 14.82 O
+ATOM 13030 H SER H 95 -25.610 100.896 11.159 1.00 0.00 H
+ATOM 13031 HA SER H 95 -26.814 100.972 13.102 1.00 0.00 H
+ATOM 13032 1HB SER H 95 -26.637 98.473 12.553 1.00 0.00 H
+ATOM 13033 2HB SER H 95 -25.444 98.393 13.831 1.00 0.00 H
+ATOM 13034 HG SER H 95 -27.048 99.454 15.149 1.00 0.00 H
+ATOM 13035 N LEU H 96 -24.604 102.153 14.209 1.00 15.39 N
+ATOM 13036 CA LEU H 96 -23.818 102.839 15.230 1.00 15.51 C
+ATOM 13037 C LEU H 96 -24.626 103.194 16.476 1.00 15.52 C
+ATOM 13038 O LEU H 96 -25.788 103.611 16.407 1.00 15.99 O
+ATOM 13039 CB LEU H 96 -23.123 104.043 14.596 1.00 15.44 C
+ATOM 13040 CG LEU H 96 -21.931 103.663 13.682 1.00 15.46 C
+ATOM 13041 CD1 LEU H 96 -21.451 104.842 12.878 1.00 17.08 C
+ATOM 13042 CD2 LEU H 96 -20.812 103.196 14.602 1.00 15.74 C
+ATOM 13043 H LEU H 96 -24.792 102.623 13.322 1.00 0.00 H
+ATOM 13044 HA LEU H 96 -23.028 102.158 15.549 1.00 0.00 H
+ATOM 13045 1HB LEU H 96 -23.851 104.590 14.005 1.00 0.00 H
+ATOM 13046 2HB LEU H 96 -22.747 104.677 15.374 1.00 0.00 H
+ATOM 13047 HG LEU H 96 -22.220 102.865 12.988 1.00 0.00 H
+ATOM 13048 1HD1 LEU H 96 -20.613 104.544 12.277 1.00 0.00 H
+ATOM 13049 2HD1 LEU H 96 -22.247 105.174 12.222 1.00 0.00 H
+ATOM 13050 3HD1 LEU H 96 -21.154 105.645 13.548 1.00 0.00 H
+ATOM 13051 1HD2 LEU H 96 -19.949 102.928 14.042 1.00 0.00 H
+ATOM 13052 2HD2 LEU H 96 -20.548 104.003 15.283 1.00 0.00 H
+ATOM 13053 3HD2 LEU H 96 -21.151 102.332 15.179 1.00 0.00 H
+ATOM 13054 N ARG H 97 -24.007 103.002 17.634 1.00 15.39 N
+ATOM 13055 CA ARG H 97 -24.649 103.237 18.927 1.00 15.46 C
+ATOM 13056 C ARG H 97 -23.937 104.334 19.706 1.00 15.12 C
+ATOM 13057 O ARG H 97 -22.806 104.685 19.394 1.00 14.98 O
+ATOM 13058 CB ARG H 97 -24.625 101.962 19.752 1.00 15.98 C
+ATOM 13059 CG ARG H 97 -25.224 100.731 19.065 1.00 18.92 C
+ATOM 13060 CD ARG H 97 -26.691 100.818 18.890 1.00 24.74 C
+ATOM 13061 NE ARG H 97 -27.230 99.591 18.314 1.00 27.69 N
+ATOM 13062 CZ ARG H 97 -28.520 99.395 17.988 1.00 28.60 C
+ATOM 13063 NH1 ARG H 97 -29.403 100.349 18.181 1.00 27.14 N
+ATOM 13064 NH2 ARG H 97 -28.898 98.240 17.473 1.00 28.22 N
+ATOM 13065 H ARG H 97 -23.047 102.645 17.626 1.00 0.00 H
+ATOM 13066 HA ARG H 97 -25.684 103.538 18.757 1.00 0.00 H
+ATOM 13067 1HB ARG H 97 -23.590 101.727 20.013 1.00 0.00 H
+ATOM 13068 2HB ARG H 97 -25.172 102.116 20.680 1.00 0.00 H
+ATOM 13069 1HG ARG H 97 -24.777 100.625 18.073 1.00 0.00 H
+ATOM 13070 2HG ARG H 97 -25.000 99.840 19.656 1.00 0.00 H
+ATOM 13071 1HD ARG H 97 -27.169 100.984 19.856 1.00 0.00 H
+ATOM 13072 2HD ARG H 97 -26.929 101.644 18.218 1.00 0.00 H
+ATOM 13073 HE ARG H 97 -26.585 98.828 18.150 1.00 0.00 H
+ATOM 13074 1HH1 ARG H 97 -29.110 101.232 18.574 1.00 0.00 H
+ATOM 13075 2HH1 ARG H 97 -30.370 100.201 17.934 1.00 0.00 H
+ATOM 13076 1HH2 ARG H 97 -28.218 97.510 17.322 1.00 0.00 H
+ATOM 13077 2HH2 ARG H 97 -29.862 98.088 17.225 1.00 0.00 H
+ATOM 13078 N ALA H 98 -24.557 104.844 20.768 1.00 14.55 N
+ATOM 13079 CA ALA H 98 -23.902 105.857 21.610 1.00 14.76 C
+ATOM 13080 C ALA H 98 -22.570 105.333 22.155 1.00 14.98 C
+ATOM 13081 O ALA H 98 -21.603 106.077 22.328 1.00 14.74 O
+ATOM 13082 CB ALA H 98 -24.807 106.245 22.759 1.00 14.48 C
+ATOM 13083 H ALA H 98 -25.493 104.538 20.997 1.00 0.00 H
+ATOM 13084 HA ALA H 98 -23.701 106.737 21.003 1.00 0.00 H
+ATOM 13085 1HB ALA H 98 -24.314 107.006 23.363 1.00 0.00 H
+ATOM 13086 2HB ALA H 98 -25.745 106.638 22.369 1.00 0.00 H
+ATOM 13087 3HB ALA H 98 -25.008 105.367 23.374 1.00 0.00 H
+ATOM 13088 N GLU H 99 -22.520 104.027 22.377 1.00 15.15 N
+ATOM 13089 CA GLU H 99 -21.362 103.319 22.899 1.00 15.76 C
+ATOM 13090 C GLU H 99 -20.152 103.413 21.964 1.00 14.85 C
+ATOM 13091 O GLU H 99 -19.020 103.173 22.380 1.00 15.12 O
+ATOM 13092 CB GLU H 99 -21.716 101.851 23.135 1.00 16.93 C
+ATOM 13093 CG GLU H 99 -22.730 101.629 24.245 1.00 21.20 C
+ATOM 13094 CD GLU H 99 -23.067 100.172 24.474 1.00 29.31 C
+ATOM 13095 OE1 GLU H 99 -22.682 99.358 23.669 1.00 31.90 O
+ATOM 13096 OE2 GLU H 99 -23.696 99.877 25.463 1.00 30.71 O
+ATOM 13097 H GLU H 99 -23.353 103.490 22.186 1.00 0.00 H
+ATOM 13098 HA GLU H 99 -21.088 103.772 23.855 1.00 0.00 H
+ATOM 13099 1HB GLU H 99 -22.111 101.419 22.212 1.00 0.00 H
+ATOM 13100 2HB GLU H 99 -20.816 101.299 23.395 1.00 0.00 H
+ATOM 13101 1HG GLU H 99 -22.335 102.051 25.165 1.00 0.00 H
+ATOM 13102 2HG GLU H 99 -23.642 102.171 23.988 1.00 0.00 H
+ATOM 13103 N ASP H 100 -20.403 103.719 20.690 1.00 13.69 N
+ATOM 13104 CA ASP H 100 -19.356 103.777 19.688 1.00 12.75 C
+ATOM 13105 C ASP H 100 -18.721 105.164 19.563 1.00 12.87 C
+ATOM 13106 O ASP H 100 -17.820 105.346 18.742 1.00 12.55 O
+ATOM 13107 CB ASP H 100 -19.922 103.374 18.320 1.00 12.53 C
+ATOM 13108 CG ASP H 100 -20.388 101.897 18.223 1.00 14.21 C
+ATOM 13109 OD1 ASP H 100 -21.505 101.695 17.783 1.00 17.17 O
+ATOM 13110 OD2 ASP H 100 -19.639 100.976 18.537 1.00 13.42 O
+ATOM 13111 H ASP H 100 -21.348 103.945 20.401 1.00 0.00 H
+ATOM 13112 HA ASP H 100 -18.575 103.080 19.975 1.00 0.00 H
+ATOM 13113 1HB ASP H 100 -20.764 104.021 18.077 1.00 0.00 H
+ATOM 13114 2HB ASP H 100 -19.157 103.545 17.558 1.00 0.00 H
+ATOM 13115 N THR H 101 -19.166 106.155 20.351 1.00 12.69 N
+ATOM 13116 CA THR H 101 -18.479 107.443 20.240 1.00 12.66 C
+ATOM 13117 C THR H 101 -17.014 107.246 20.622 1.00 12.77 C
+ATOM 13118 O THR H 101 -16.706 106.771 21.720 1.00 12.97 O
+ATOM 13119 CB THR H 101 -19.108 108.539 21.132 1.00 12.38 C
+ATOM 13120 OG1 THR H 101 -20.489 108.788 20.736 1.00 14.62 O
+ATOM 13121 CG2 THR H 101 -18.267 109.832 21.080 1.00 11.97 C
+ATOM 13122 H THR H 101 -19.929 106.018 21.015 1.00 0.00 H
+ATOM 13123 HA THR H 101 -18.524 107.773 19.205 1.00 0.00 H
+ATOM 13124 HB THR H 101 -19.117 108.183 22.160 1.00 0.00 H
+ATOM 13125 HG1 THR H 101 -20.510 109.072 19.828 1.00 0.00 H
+ATOM 13126 1HG2 THR H 101 -18.708 110.580 21.734 1.00 0.00 H
+ATOM 13127 2HG2 THR H 101 -17.257 109.610 21.415 1.00 0.00 H
+ATOM 13128 3HG2 THR H 101 -18.222 110.220 20.080 1.00 0.00 H
+ATOM 13129 N ALA H 102 -16.112 107.603 19.714 1.00 12.51 N
+ATOM 13130 CA ALA H 102 -14.694 107.389 19.956 1.00 12.95 C
+ATOM 13131 C ALA H 102 -13.820 108.036 18.914 1.00 13.01 C
+ATOM 13132 O ALA H 102 -14.250 108.304 17.788 1.00 12.70 O
+ATOM 13133 CB ALA H 102 -14.386 105.897 19.995 1.00 13.08 C
+ATOM 13134 H ALA H 102 -16.432 108.023 18.844 1.00 0.00 H
+ATOM 13135 HA ALA H 102 -14.442 107.845 20.902 1.00 0.00 H
+ATOM 13136 1HB ALA H 102 -13.339 105.762 20.192 1.00 0.00 H
+ATOM 13137 2HB ALA H 102 -14.961 105.401 20.768 1.00 0.00 H
+ATOM 13138 3HB ALA H 102 -14.633 105.463 19.031 1.00 0.00 H
+ATOM 13139 N VAL H 103 -12.561 108.230 19.261 1.00 12.29 N
+ATOM 13140 CA VAL H 103 -11.601 108.611 18.252 1.00 11.30 C
+ATOM 13141 C VAL H 103 -11.071 107.346 17.633 1.00 11.70 C
+ATOM 13142 O VAL H 103 -10.649 106.443 18.347 1.00 12.47 O
+ATOM 13143 CB VAL H 103 -10.451 109.433 18.838 1.00 11.15 C
+ATOM 13144 CG1 VAL H 103 -9.427 109.742 17.743 1.00 7.34 C
+ATOM 13145 CG2 VAL H 103 -11.013 110.711 19.422 1.00 8.91 C
+ATOM 13146 H VAL H 103 -12.260 108.057 20.220 1.00 0.00 H
+ATOM 13147 HA VAL H 103 -12.096 109.194 17.486 1.00 0.00 H
+ATOM 13148 HB VAL H 103 -9.949 108.855 19.615 1.00 0.00 H
+ATOM 13149 1HG1 VAL H 103 -8.604 110.323 18.156 1.00 0.00 H
+ATOM 13150 2HG1 VAL H 103 -9.034 108.812 17.325 1.00 0.00 H
+ATOM 13151 3HG1 VAL H 103 -9.913 110.311 16.960 1.00 0.00 H
+ATOM 13152 1HG2 VAL H 103 -10.204 111.303 19.847 1.00 0.00 H
+ATOM 13153 2HG2 VAL H 103 -11.505 111.279 18.634 1.00 0.00 H
+ATOM 13154 3HG2 VAL H 103 -11.736 110.469 20.204 1.00 0.00 H
+ATOM 13155 N TYR H 104 -11.141 107.249 16.327 1.00 11.25 N
+ATOM 13156 CA TYR H 104 -10.670 106.077 15.626 1.00 11.88 C
+ATOM 13157 C TYR H 104 -9.302 106.339 15.065 1.00 12.82 C
+ATOM 13158 O TYR H 104 -9.046 107.402 14.494 1.00 13.52 O
+ATOM 13159 CB TYR H 104 -11.668 105.680 14.539 1.00 10.33 C
+ATOM 13160 CG TYR H 104 -12.918 104.963 15.059 1.00 7.95 C
+ATOM 13161 CD1 TYR H 104 -13.955 105.669 15.647 1.00 8.25 C
+ATOM 13162 CD2 TYR H 104 -13.027 103.582 14.898 1.00 5.63 C
+ATOM 13163 CE1 TYR H 104 -15.082 104.994 16.099 1.00 9.03 C
+ATOM 13164 CE2 TYR H 104 -14.155 102.919 15.340 1.00 5.44 C
+ATOM 13165 CZ TYR H 104 -15.175 103.620 15.944 1.00 7.51 C
+ATOM 13166 OH TYR H 104 -16.300 102.954 16.380 1.00 8.14 O
+ATOM 13167 H TYR H 104 -11.520 108.026 15.799 1.00 0.00 H
+ATOM 13168 HA TYR H 104 -10.580 105.252 16.332 1.00 0.00 H
+ATOM 13169 1HB TYR H 104 -11.988 106.581 14.008 1.00 0.00 H
+ATOM 13170 2HB TYR H 104 -11.180 105.040 13.827 1.00 0.00 H
+ATOM 13171 HD1 TYR H 104 -13.882 106.752 15.765 1.00 0.00 H
+ATOM 13172 HD2 TYR H 104 -12.222 103.022 14.419 1.00 0.00 H
+ATOM 13173 HE1 TYR H 104 -15.896 105.544 16.574 1.00 0.00 H
+ATOM 13174 HE2 TYR H 104 -14.242 101.843 15.211 1.00 0.00 H
+ATOM 13175 HH TYR H 104 -16.301 102.066 16.011 1.00 0.00 H
+ATOM 13176 N TYR H 105 -8.420 105.374 15.209 1.00 13.74 N
+ATOM 13177 CA TYR H 105 -7.086 105.510 14.695 1.00 14.66 C
+ATOM 13178 C TYR H 105 -6.802 104.401 13.733 1.00 15.88 C
+ATOM 13179 O TYR H 105 -7.157 103.243 13.964 1.00 16.30 O
+ATOM 13180 CB TYR H 105 -6.042 105.396 15.803 1.00 13.80 C
+ATOM 13181 CG TYR H 105 -6.144 106.388 16.934 1.00 12.55 C
+ATOM 13182 CD1 TYR H 105 -5.421 107.581 16.910 1.00 13.65 C
+ATOM 13183 CD2 TYR H 105 -6.952 106.086 18.025 1.00 8.70 C
+ATOM 13184 CE1 TYR H 105 -5.522 108.457 17.978 1.00 13.39 C
+ATOM 13185 CE2 TYR H 105 -7.044 106.956 19.074 1.00 11.08 C
+ATOM 13186 CZ TYR H 105 -6.343 108.130 19.062 1.00 14.02 C
+ATOM 13187 OH TYR H 105 -6.447 108.983 20.132 1.00 15.41 O
+ATOM 13188 H TYR H 105 -8.671 104.532 15.707 1.00 0.00 H
+ATOM 13189 HA TYR H 105 -6.985 106.457 14.165 1.00 0.00 H
+ATOM 13190 1HB TYR H 105 -6.077 104.388 16.224 1.00 0.00 H
+ATOM 13191 2HB TYR H 105 -5.061 105.514 15.341 1.00 0.00 H
+ATOM 13192 HD1 TYR H 105 -4.773 107.827 16.056 1.00 0.00 H
+ATOM 13193 HD2 TYR H 105 -7.515 105.158 18.054 1.00 0.00 H
+ATOM 13194 HE1 TYR H 105 -4.959 109.395 17.973 1.00 0.00 H
+ATOM 13195 HE2 TYR H 105 -7.671 106.719 19.923 1.00 0.00 H
+ATOM 13196 HH TYR H 105 -6.841 108.508 20.892 1.00 0.00 H
+ATOM 13197 N CYS H 106 -6.095 104.755 12.697 1.00 16.56 N
+ATOM 13198 CA CYS H 106 -5.574 103.825 11.733 1.00 17.42 C
+ATOM 13199 C CYS H 106 -4.119 103.597 12.099 1.00 15.96 C
+ATOM 13200 O CYS H 106 -3.365 104.552 12.319 1.00 14.75 O
+ATOM 13201 CB CYS H 106 -5.724 104.397 10.344 1.00 18.75 C
+ATOM 13202 SG CYS H 106 -5.126 103.377 9.000 1.00 26.61 S
+ATOM 13203 H CYS H 106 -5.896 105.743 12.576 1.00 0.00 H
+ATOM 13204 HA CYS H 106 -6.124 102.883 11.801 1.00 0.00 H
+ATOM 13205 1HB CYS H 106 -6.784 104.630 10.179 1.00 0.00 H
+ATOM 13206 2HB CYS H 106 -5.184 105.345 10.296 1.00 0.00 H
+ATOM 13207 N SER H 107 -3.728 102.344 12.219 1.00 15.63 N
+ATOM 13208 CA SER H 107 -2.356 102.031 12.598 1.00 15.61 C
+ATOM 13209 C SER H 107 -1.875 100.802 11.853 1.00 16.22 C
+ATOM 13210 O SER H 107 -2.677 100.040 11.311 1.00 16.00 O
+ATOM 13211 CB SER H 107 -2.266 101.831 14.095 1.00 16.22 C
+ATOM 13212 OG SER H 107 -2.979 100.706 14.484 1.00 14.09 O
+ATOM 13213 H SER H 107 -4.403 101.600 12.056 1.00 0.00 H
+ATOM 13214 HA SER H 107 -1.712 102.859 12.323 1.00 0.00 H
+ATOM 13215 1HB SER H 107 -1.223 101.731 14.398 1.00 0.00 H
+ATOM 13216 2HB SER H 107 -2.670 102.709 14.589 1.00 0.00 H
+ATOM 13217 HG SER H 107 -2.550 99.973 14.044 1.00 0.00 H
+ATOM 13218 N ARG H 108 -0.569 100.582 11.837 1.00 16.62 N
+ATOM 13219 CA ARG H 108 -0.094 99.417 11.098 1.00 17.11 C
+ATOM 13220 C ARG H 108 0.992 98.630 11.832 1.00 18.50 C
+ATOM 13221 O ARG H 108 1.735 99.180 12.636 1.00 18.19 O
+ATOM 13222 CB ARG H 108 0.558 99.853 9.806 1.00 16.43 C
+ATOM 13223 CG ARG H 108 1.914 100.453 10.041 1.00 15.10 C
+ATOM 13224 CD ARG H 108 2.616 100.875 8.828 1.00 11.80 C
+ATOM 13225 NE ARG H 108 4.038 100.932 9.112 1.00 13.13 N
+ATOM 13226 CZ ARG H 108 5.005 101.125 8.200 1.00 17.33 C
+ATOM 13227 NH1 ARG H 108 4.700 101.310 6.946 1.00 17.39 N
+ATOM 13228 NH2 ARG H 108 6.270 101.104 8.566 1.00 17.59 N
+ATOM 13229 H ARG H 108 0.065 101.243 12.287 1.00 0.00 H
+ATOM 13230 HA ARG H 108 -0.932 98.754 10.897 1.00 0.00 H
+ATOM 13231 1HB ARG H 108 0.667 99.010 9.162 1.00 0.00 H
+ATOM 13232 2HB ARG H 108 -0.061 100.588 9.298 1.00 0.00 H
+ATOM 13233 1HG ARG H 108 1.808 101.325 10.684 1.00 0.00 H
+ATOM 13234 2HG ARG H 108 2.545 99.726 10.543 1.00 0.00 H
+ATOM 13235 1HD ARG H 108 2.442 100.206 8.005 1.00 0.00 H
+ATOM 13236 2HD ARG H 108 2.287 101.877 8.548 1.00 0.00 H
+ATOM 13237 HE ARG H 108 4.328 100.751 10.089 1.00 0.00 H
+ATOM 13238 1HH1 ARG H 108 3.729 101.318 6.654 1.00 0.00 H
+ATOM 13239 2HH1 ARG H 108 5.429 101.428 6.255 1.00 0.00 H
+ATOM 13240 1HH2 ARG H 108 6.517 100.924 9.554 1.00 0.00 H
+ATOM 13241 2HH2 ARG H 108 6.996 101.241 7.884 1.00 0.00 H
+ATOM 13242 N TRP H 109 1.092 97.340 11.503 1.00 20.34 N
+ATOM 13243 CA TRP H 109 2.225 96.492 11.930 1.00 21.91 C
+ATOM 13244 C TRP H 109 3.255 96.393 10.804 1.00 23.95 C
+ATOM 13245 O TRP H 109 3.256 95.407 10.067 1.00 26.60 O
+ATOM 13246 CB TRP H 109 1.786 95.077 12.347 1.00 20.66 C
+ATOM 13247 CG TRP H 109 1.101 95.008 13.688 1.00 19.36 C
+ATOM 13248 CD1 TRP H 109 0.993 96.014 14.567 1.00 15.79 C
+ATOM 13249 CD2 TRP H 109 0.453 93.866 14.313 1.00 16.50 C
+ATOM 13250 NE1 TRP H 109 0.325 95.593 15.688 1.00 15.17 N
+ATOM 13251 CE2 TRP H 109 -0.014 94.294 15.554 1.00 16.09 C
+ATOM 13252 CE3 TRP H 109 0.235 92.536 13.928 1.00 15.46 C
+ATOM 13253 CZ2 TRP H 109 -0.693 93.462 16.418 1.00 14.30 C
+ATOM 13254 CZ3 TRP H 109 -0.450 91.685 14.808 1.00 17.42 C
+ATOM 13255 CH2 TRP H 109 -0.902 92.147 16.021 1.00 15.84 C
+ATOM 13256 H TRP H 109 0.393 96.969 10.861 1.00 0.00 H
+ATOM 13257 HA TRP H 109 2.709 96.958 12.789 1.00 0.00 H
+ATOM 13258 1HB TRP H 109 1.111 94.670 11.593 1.00 0.00 H
+ATOM 13259 2HB TRP H 109 2.657 94.433 12.378 1.00 0.00 H
+ATOM 13260 HD1 TRP H 109 1.383 97.021 14.405 1.00 0.00 H
+ATOM 13261 HE1 TRP H 109 0.122 96.152 16.488 1.00 0.00 H
+ATOM 13262 HE3 TRP H 109 0.590 92.182 12.965 1.00 0.00 H
+ATOM 13263 HZ2 TRP H 109 -1.056 93.809 17.386 1.00 0.00 H
+ATOM 13264 HZ3 TRP H 109 -0.612 90.655 14.509 1.00 0.00 H
+ATOM 13265 HH2 TRP H 109 -1.429 91.477 16.688 1.00 0.00 H
+ATOM 13266 N GLY H 110 4.088 97.425 10.629 1.00 25.12 N
+ATOM 13267 CA GLY H 110 4.964 97.497 9.461 1.00 26.64 C
+ATOM 13268 C GLY H 110 5.844 96.268 9.206 1.00 26.59 C
+ATOM 13269 O GLY H 110 6.636 95.862 10.055 1.00 27.67 O
+ATOM 13270 H GLY H 110 4.110 98.216 11.283 1.00 0.00 H
+ATOM 13271 1HA GLY H 110 4.380 97.713 8.576 1.00 0.00 H
+ATOM 13272 2HA GLY H 110 5.619 98.358 9.599 1.00 0.00 H
+ATOM 13273 N GLY H 111 5.744 95.715 7.988 1.00 26.46 N
+ATOM 13274 CA GLY H 111 6.569 94.567 7.570 1.00 26.94 C
+ATOM 13275 C GLY H 111 6.193 93.185 8.132 1.00 26.53 C
+ATOM 13276 O GLY H 111 5.072 92.958 8.609 1.00 25.79 O
+ATOM 13277 H GLY H 111 5.055 96.095 7.336 1.00 0.00 H
+ATOM 13278 1HA GLY H 111 6.557 94.509 6.478 1.00 0.00 H
+ATOM 13279 2HA GLY H 111 7.603 94.778 7.841 1.00 0.00 H
+ATOM 13280 N ASP H 112 7.142 92.245 8.007 1.00 26.25 N
+ATOM 13281 CA ASP H 112 6.984 90.832 8.375 1.00 26.56 C
+ATOM 13282 C ASP H 112 7.597 90.438 9.725 1.00 25.86 C
+ATOM 13283 O ASP H 112 7.197 89.445 10.315 1.00 27.49 O
+ATOM 13284 CB ASP H 112 7.617 89.957 7.292 1.00 26.55 C
+ATOM 13285 CG ASP H 112 6.933 90.112 5.941 1.00 29.11 C
+ATOM 13286 OD1 ASP H 112 5.753 89.872 5.853 1.00 32.01 O
+ATOM 13287 OD2 ASP H 112 7.604 90.490 5.011 1.00 27.98 O
+ATOM 13288 H ASP H 112 8.028 92.533 7.611 1.00 0.00 H
+ATOM 13289 HA ASP H 112 5.913 90.613 8.414 1.00 0.00 H
+ATOM 13290 1HB ASP H 112 8.676 90.218 7.179 1.00 0.00 H
+ATOM 13291 2HB ASP H 112 7.570 88.910 7.594 1.00 0.00 H
+ATOM 13292 N GLY H 113 8.638 91.155 10.152 1.00 23.64 N
+ATOM 13293 CA GLY H 113 9.389 90.803 11.362 1.00 21.95 C
+ATOM 13294 C GLY H 113 9.184 91.765 12.535 1.00 21.39 C
+ATOM 13295 O GLY H 113 9.918 91.705 13.520 1.00 21.11 O
+ATOM 13296 H GLY H 113 8.917 91.966 9.631 1.00 0.00 H
+ATOM 13297 1HA GLY H 113 9.117 89.795 11.675 1.00 0.00 H
+ATOM 13298 2HA GLY H 113 10.450 90.772 11.117 1.00 0.00 H
+ATOM 13299 N PHE H 133 8.209 92.662 12.422 1.00 20.59 N
+ATOM 13300 CA PHE H 133 7.968 93.668 13.458 1.00 19.82 C
+ATOM 13301 C PHE H 133 6.462 93.798 13.713 1.00 18.96 C
+ATOM 13302 O PHE H 133 5.719 94.277 12.862 1.00 19.13 O
+ATOM 13303 CB PHE H 133 8.572 94.995 12.994 1.00 20.05 C
+ATOM 13304 CG PHE H 133 8.632 96.077 14.006 1.00 21.70 C
+ATOM 13305 CD1 PHE H 133 9.822 96.334 14.653 1.00 23.21 C
+ATOM 13306 CD2 PHE H 133 7.537 96.851 14.306 1.00 22.58 C
+ATOM 13307 CE1 PHE H 133 9.910 97.335 15.561 1.00 24.01 C
+ATOM 13308 CE2 PHE H 133 7.638 97.850 15.231 1.00 25.09 C
+ATOM 13309 CZ PHE H 133 8.828 98.089 15.857 1.00 25.38 C
+ATOM 13310 H PHE H 133 7.632 92.658 11.594 1.00 0.00 H
+ATOM 13311 HA PHE H 133 8.451 93.352 14.383 1.00 0.00 H
+ATOM 13312 1HB PHE H 133 9.587 94.816 12.645 1.00 0.00 H
+ATOM 13313 2HB PHE H 133 8.003 95.366 12.142 1.00 0.00 H
+ATOM 13314 HD1 PHE H 133 10.703 95.731 14.420 1.00 0.00 H
+ATOM 13315 HD2 PHE H 133 6.586 96.667 13.797 1.00 0.00 H
+ATOM 13316 HE1 PHE H 133 10.846 97.530 16.043 1.00 0.00 H
+ATOM 13317 HE2 PHE H 133 6.767 98.458 15.465 1.00 0.00 H
+ATOM 13318 HZ PHE H 133 8.915 98.877 16.581 1.00 0.00 H
+ATOM 13319 N TYR H 134 5.998 93.321 14.874 1.00 17.63 N
+ATOM 13320 CA TYR H 134 4.553 93.249 15.154 1.00 17.31 C
+ATOM 13321 C TYR H 134 4.052 94.313 16.130 1.00 17.68 C
+ATOM 13322 O TYR H 134 3.015 94.134 16.762 1.00 19.54 O
+ATOM 13323 CB TYR H 134 4.165 91.857 15.686 1.00 16.44 C
+ATOM 13324 CG TYR H 134 4.409 90.687 14.710 1.00 15.78 C
+ATOM 13325 CD1 TYR H 134 4.213 89.355 15.107 1.00 11.63 C
+ATOM 13326 CD2 TYR H 134 4.852 90.938 13.436 1.00 12.08 C
+ATOM 13327 CE1 TYR H 134 4.469 88.329 14.200 1.00 13.49 C
+ATOM 13328 CE2 TYR H 134 5.115 89.942 12.590 1.00 11.33 C
+ATOM 13329 CZ TYR H 134 4.929 88.646 12.942 1.00 13.27 C
+ATOM 13330 OH TYR H 134 5.191 87.659 12.024 1.00 9.68 O
+ATOM 13331 H TYR H 134 6.653 92.963 15.554 1.00 0.00 H
+ATOM 13332 HA TYR H 134 4.016 93.402 14.221 1.00 0.00 H
+ATOM 13333 1HB TYR H 134 4.744 91.651 16.585 1.00 0.00 H
+ATOM 13334 2HB TYR H 134 3.097 91.862 15.964 1.00 0.00 H
+ATOM 13335 HD1 TYR H 134 3.854 89.119 16.113 1.00 0.00 H
+ATOM 13336 HD2 TYR H 134 4.999 91.928 13.092 1.00 0.00 H
+ATOM 13337 HE1 TYR H 134 4.318 87.286 14.471 1.00 0.00 H
+ATOM 13338 HE2 TYR H 134 5.465 90.180 11.601 1.00 0.00 H
+ATOM 13339 HH TYR H 134 5.833 87.996 11.362 1.00 0.00 H
+ATOM 13340 N ALA H 135 4.803 95.394 16.290 1.00 17.17 N
+ATOM 13341 CA ALA H 135 4.363 96.485 17.156 1.00 16.70 C
+ATOM 13342 C ALA H 135 3.811 97.606 16.281 1.00 16.99 C
+ATOM 13343 O ALA H 135 4.208 97.756 15.124 1.00 15.88 O
+ATOM 13344 CB ALA H 135 5.484 96.979 18.057 1.00 16.33 C
+ATOM 13345 H ALA H 135 5.666 95.477 15.773 1.00 0.00 H
+ATOM 13346 HA ALA H 135 3.552 96.118 17.787 1.00 0.00 H
+ATOM 13347 1HB ALA H 135 5.099 97.769 18.683 1.00 0.00 H
+ATOM 13348 2HB ALA H 135 5.835 96.164 18.677 1.00 0.00 H
+ATOM 13349 3HB ALA H 135 6.296 97.354 17.478 1.00 0.00 H
+ATOM 13350 N MET H 136 2.900 98.411 16.819 1.00 17.12 N
+ATOM 13351 CA MET H 136 2.298 99.480 16.020 1.00 17.31 C
+ATOM 13352 C MET H 136 3.225 100.680 15.853 1.00 17.11 C
+ATOM 13353 O MET H 136 3.109 101.690 16.556 1.00 18.15 O
+ATOM 13354 CB MET H 136 0.935 99.882 16.595 1.00 17.12 C
+ATOM 13355 CG MET H 136 -0.102 98.775 16.508 1.00 16.93 C
+ATOM 13356 SD MET H 136 -1.719 99.185 17.172 1.00 22.16 S
+ATOM 13357 CE MET H 136 -2.585 97.635 16.870 1.00 20.82 C
+ATOM 13358 H MET H 136 2.606 98.281 17.776 1.00 0.00 H
+ATOM 13359 HA MET H 136 2.121 99.087 15.024 1.00 0.00 H
+ATOM 13360 1HB MET H 136 1.022 100.167 17.625 1.00 0.00 H
+ATOM 13361 2HB MET H 136 0.553 100.739 16.050 1.00 0.00 H
+ATOM 13362 1HG MET H 136 -0.227 98.491 15.466 1.00 0.00 H
+ATOM 13363 2HG MET H 136 0.272 97.924 17.058 1.00 0.00 H
+ATOM 13364 1HE MET H 136 -3.611 97.715 17.225 1.00 0.00 H
+ATOM 13365 2HE MET H 136 -2.585 97.420 15.802 1.00 0.00 H
+ATOM 13366 3HE MET H 136 -2.083 96.824 17.400 1.00 0.00 H
+ATOM 13367 N ASP H 137 4.170 100.541 14.911 1.00 17.16 N
+ATOM 13368 CA ASP H 137 5.196 101.559 14.668 1.00 17.66 C
+ATOM 13369 C ASP H 137 4.645 102.875 14.121 1.00 18.09 C
+ATOM 13370 O ASP H 137 5.196 103.942 14.399 1.00 18.87 O
+ATOM 13371 CB ASP H 137 6.305 101.021 13.730 1.00 17.37 C
+ATOM 13372 CG ASP H 137 5.868 100.510 12.282 1.00 19.03 C
+ATOM 13373 OD1 ASP H 137 4.757 100.032 12.080 1.00 20.42 O
+ATOM 13374 OD2 ASP H 137 6.696 100.622 11.387 1.00 19.62 O
+ATOM 13375 H ASP H 137 4.183 99.659 14.406 1.00 0.00 H
+ATOM 13376 HA ASP H 137 5.672 101.784 15.622 1.00 0.00 H
+ATOM 13377 1HB ASP H 137 7.012 101.820 13.569 1.00 0.00 H
+ATOM 13378 2HB ASP H 137 6.846 100.246 14.220 1.00 0.00 H
+ATOM 13379 N TYR H 138 3.533 102.823 13.380 1.00 17.92 N
+ATOM 13380 CA TYR H 138 2.909 104.051 12.887 1.00 17.72 C
+ATOM 13381 C TYR H 138 1.409 104.117 13.124 1.00 17.28 C
+ATOM 13382 O TYR H 138 0.673 103.135 12.990 1.00 17.23 O
+ATOM 13383 CB TYR H 138 3.229 104.330 11.409 1.00 17.99 C
+ATOM 13384 CG TYR H 138 4.685 104.701 11.165 1.00 17.44 C
+ATOM 13385 CD1 TYR H 138 5.618 103.731 10.932 1.00 20.06 C
+ATOM 13386 CD2 TYR H 138 5.073 106.041 11.195 1.00 18.63 C
+ATOM 13387 CE1 TYR H 138 6.941 104.059 10.726 1.00 20.60 C
+ATOM 13388 CE2 TYR H 138 6.400 106.385 10.990 1.00 19.97 C
+ATOM 13389 CZ TYR H 138 7.334 105.394 10.756 1.00 19.74 C
+ATOM 13390 OH TYR H 138 8.655 105.723 10.551 1.00 19.49 O
+ATOM 13391 H TYR H 138 3.132 101.913 13.177 1.00 0.00 H
+ATOM 13392 HA TYR H 138 3.335 104.881 13.447 1.00 0.00 H
+ATOM 13393 1HB TYR H 138 2.998 103.450 10.813 1.00 0.00 H
+ATOM 13394 2HB TYR H 138 2.602 105.146 11.048 1.00 0.00 H
+ATOM 13395 HD1 TYR H 138 5.311 102.700 10.910 1.00 0.00 H
+ATOM 13396 HD2 TYR H 138 4.332 106.821 11.379 1.00 0.00 H
+ATOM 13397 HE1 TYR H 138 7.671 103.268 10.546 1.00 0.00 H
+ATOM 13398 HE2 TYR H 138 6.701 107.436 11.010 1.00 0.00 H
+ATOM 13399 HH TYR H 138 8.778 106.662 10.718 1.00 0.00 H
+ATOM 13400 N TRP H 139 0.977 105.330 13.463 1.00 17.01 N
+ATOM 13401 CA TRP H 139 -0.409 105.690 13.737 1.00 16.52 C
+ATOM 13402 C TRP H 139 -0.780 106.953 12.971 1.00 16.04 C
+ATOM 13403 O TRP H 139 0.069 107.829 12.787 1.00 15.23 O
+ATOM 13404 CB TRP H 139 -0.564 105.994 15.231 1.00 16.21 C
+ATOM 13405 CG TRP H 139 -0.315 104.838 16.179 1.00 14.53 C
+ATOM 13406 CD1 TRP H 139 0.896 104.318 16.534 1.00 15.84 C
+ATOM 13407 CD2 TRP H 139 -1.302 104.116 16.960 1.00 12.31 C
+ATOM 13408 NE1 TRP H 139 0.734 103.308 17.438 1.00 14.68 N
+ATOM 13409 CE2 TRP H 139 -0.610 103.176 17.725 1.00 13.44 C
+ATOM 13410 CE3 TRP H 139 -2.694 104.202 17.071 1.00 12.78 C
+ATOM 13411 CZ2 TRP H 139 -1.267 102.313 18.602 1.00 13.57 C
+ATOM 13412 CZ3 TRP H 139 -3.354 103.348 17.945 1.00 14.89 C
+ATOM 13413 CH2 TRP H 139 -2.662 102.427 18.690 1.00 15.01 C
+ATOM 13414 H TRP H 139 1.671 106.063 13.543 1.00 0.00 H
+ATOM 13415 HA TRP H 139 -1.065 104.873 13.436 1.00 0.00 H
+ATOM 13416 1HB TRP H 139 0.112 106.808 15.499 1.00 0.00 H
+ATOM 13417 2HB TRP H 139 -1.580 106.351 15.401 1.00 0.00 H
+ATOM 13418 HD1 TRP H 139 1.859 104.648 16.148 1.00 0.00 H
+ATOM 13419 HE1 TRP H 139 1.509 102.764 17.826 1.00 0.00 H
+ATOM 13420 HE3 TRP H 139 -3.238 104.930 16.485 1.00 0.00 H
+ATOM 13421 HZ2 TRP H 139 -0.732 101.576 19.205 1.00 0.00 H
+ATOM 13422 HZ3 TRP H 139 -4.435 103.429 18.024 1.00 0.00 H
+ATOM 13423 HH2 TRP H 139 -3.212 101.780 19.362 1.00 0.00 H
+ATOM 13424 N GLY H 140 -2.045 107.083 12.586 1.00 16.91 N
+ATOM 13425 CA GLY H 140 -2.515 108.335 11.978 1.00 17.89 C
+ATOM 13426 C GLY H 140 -2.857 109.341 13.080 1.00 18.82 C
+ATOM 13427 O GLY H 140 -2.647 109.079 14.251 1.00 17.92 O
+ATOM 13428 H GLY H 140 -2.693 106.309 12.697 1.00 0.00 H
+ATOM 13429 1HA GLY H 140 -1.731 108.740 11.344 1.00 0.00 H
+ATOM 13430 2HA GLY H 140 -3.378 108.139 11.353 1.00 0.00 H
+ATOM 13431 N GLN H 141 -3.387 110.514 12.673 1.00 20.16 N
+ATOM 13432 CA GLN H 141 -3.660 111.560 13.669 1.00 20.90 C
+ATOM 13433 C GLN H 141 -4.890 111.271 14.553 1.00 20.52 C
+ATOM 13434 O GLN H 141 -4.981 111.813 15.668 1.00 20.68 O
+ATOM 13435 CB GLN H 141 -3.908 112.912 12.926 1.00 21.38 C
+ATOM 13436 CG GLN H 141 -5.317 113.116 12.289 1.00 25.35 C
+ATOM 13437 CD GLN H 141 -5.550 112.547 10.874 1.00 30.68 C
+ATOM 13438 OE1 GLN H 141 -4.683 111.963 10.214 1.00 34.59 O
+ATOM 13439 NE2 GLN H 141 -6.795 112.727 10.426 1.00 30.79 N
+ATOM 13440 H GLN H 141 -3.565 110.665 11.700 1.00 0.00 H
+ATOM 13441 HA GLN H 141 -2.796 111.668 14.301 1.00 0.00 H
+ATOM 13442 1HB GLN H 141 -3.751 113.732 13.622 1.00 0.00 H
+ATOM 13443 2HB GLN H 141 -3.175 113.015 12.128 1.00 0.00 H
+ATOM 13444 1HG GLN H 141 -6.071 112.702 12.937 1.00 0.00 H
+ATOM 13445 2HG GLN H 141 -5.471 114.189 12.221 1.00 0.00 H
+ATOM 13446 1HE2 GLN H 141 -7.110 112.371 9.525 1.00 0.00 H
+ATOM 13447 2HE2 GLN H 141 -7.464 113.193 11.006 1.00 0.00 H
+ATOM 13448 N GLY H 142 -5.769 110.388 14.111 1.00 20.63 N
+ATOM 13449 CA GLY H 142 -7.000 110.031 14.836 1.00 20.11 C
+ATOM 13450 C GLY H 142 -8.215 110.855 14.375 1.00 20.40 C
+ATOM 13451 O GLY H 142 -8.124 112.073 14.215 1.00 20.61 O
+ATOM 13452 H GLY H 142 -5.623 109.968 13.189 1.00 0.00 H
+ATOM 13453 1HA GLY H 142 -7.193 108.969 14.693 1.00 0.00 H
+ATOM 13454 2HA GLY H 142 -6.840 110.177 15.901 1.00 0.00 H
+ATOM 13455 N THR H 143 -9.359 110.196 14.177 1.00 19.74 N
+ATOM 13456 CA THR H 143 -10.599 110.847 13.731 1.00 19.09 C
+ATOM 13457 C THR H 143 -11.784 110.635 14.667 1.00 18.55 C
+ATOM 13458 O THR H 143 -12.086 109.511 15.059 1.00 18.49 O
+ATOM 13459 CB THR H 143 -10.983 110.388 12.317 1.00 19.23 C
+ATOM 13460 OG1 THR H 143 -9.985 110.805 11.401 1.00 19.57 O
+ATOM 13461 CG2 THR H 143 -12.302 110.911 11.901 1.00 21.19 C
+ATOM 13462 H THR H 143 -9.360 109.184 14.322 1.00 0.00 H
+ATOM 13463 HA THR H 143 -10.410 111.920 13.683 1.00 0.00 H
+ATOM 13464 HB THR H 143 -11.026 109.303 12.303 1.00 0.00 H
+ATOM 13465 HG1 THR H 143 -9.141 110.423 11.652 1.00 0.00 H
+ATOM 13466 1HG2 THR H 143 -12.523 110.543 10.900 1.00 0.00 H
+ATOM 13467 2HG2 THR H 143 -13.064 110.558 12.600 1.00 0.00 H
+ATOM 13468 3HG2 THR H 143 -12.279 111.999 11.897 1.00 0.00 H
+ATOM 13469 N LEU H 144 -12.478 111.715 15.022 1.00 17.76 N
+ATOM 13470 CA LEU H 144 -13.609 111.566 15.933 1.00 16.74 C
+ATOM 13471 C LEU H 144 -14.926 111.225 15.256 1.00 16.19 C
+ATOM 13472 O LEU H 144 -15.393 111.935 14.356 1.00 17.22 O
+ATOM 13473 CB LEU H 144 -13.825 112.821 16.786 1.00 16.36 C
+ATOM 13474 CG LEU H 144 -15.064 112.743 17.756 1.00 16.75 C
+ATOM 13475 CD1 LEU H 144 -14.838 111.646 18.809 1.00 16.68 C
+ATOM 13476 CD2 LEU H 144 -15.280 114.083 18.423 1.00 17.13 C
+ATOM 13477 H LEU H 144 -12.209 112.624 14.675 1.00 0.00 H
+ATOM 13478 HA LEU H 144 -13.386 110.750 16.612 1.00 0.00 H
+ATOM 13479 1HB LEU H 144 -12.938 112.991 17.392 1.00 0.00 H
+ATOM 13480 2HB LEU H 144 -13.968 113.678 16.125 1.00 0.00 H
+ATOM 13481 HG LEU H 144 -15.957 112.483 17.181 1.00 0.00 H
+ATOM 13482 1HD1 LEU H 144 -15.707 111.587 19.464 1.00 0.00 H
+ATOM 13483 2HD1 LEU H 144 -14.699 110.699 18.318 1.00 0.00 H
+ATOM 13484 3HD1 LEU H 144 -13.954 111.880 19.398 1.00 0.00 H
+ATOM 13485 1HD2 LEU H 144 -16.148 114.017 19.084 1.00 0.00 H
+ATOM 13486 2HD2 LEU H 144 -14.398 114.346 19.008 1.00 0.00 H
+ATOM 13487 3HD2 LEU H 144 -15.456 114.842 17.664 1.00 0.00 H
+ATOM 13488 N VAL H 145 -15.508 110.145 15.748 1.00 14.35 N
+ATOM 13489 CA VAL H 145 -16.815 109.657 15.365 1.00 13.38 C
+ATOM 13490 C VAL H 145 -17.710 109.781 16.568 1.00 12.70 C
+ATOM 13491 O VAL H 145 -17.387 109.288 17.650 1.00 13.45 O
+ATOM 13492 CB VAL H 145 -16.740 108.186 14.944 1.00 12.88 C
+ATOM 13493 CG1 VAL H 145 -18.159 107.642 14.622 1.00 13.52 C
+ATOM 13494 CG2 VAL H 145 -15.813 108.085 13.755 1.00 13.90 C
+ATOM 13495 H VAL H 145 -15.009 109.615 16.460 1.00 0.00 H
+ATOM 13496 HA VAL H 145 -17.212 110.261 14.549 1.00 0.00 H
+ATOM 13497 HB VAL H 145 -16.342 107.600 15.761 1.00 0.00 H
+ATOM 13498 1HG1 VAL H 145 -18.098 106.595 14.328 1.00 0.00 H
+ATOM 13499 2HG1 VAL H 145 -18.789 107.725 15.509 1.00 0.00 H
+ATOM 13500 3HG1 VAL H 145 -18.602 108.217 13.827 1.00 0.00 H
+ATOM 13501 1HG2 VAL H 145 -15.735 107.058 13.453 1.00 0.00 H
+ATOM 13502 2HG2 VAL H 145 -16.211 108.678 12.943 1.00 0.00 H
+ATOM 13503 3HG2 VAL H 145 -14.824 108.458 14.026 1.00 0.00 H
+ATOM 13504 N THR H 146 -18.848 110.421 16.403 1.00 11.92 N
+ATOM 13505 CA THR H 146 -19.710 110.563 17.552 1.00 11.96 C
+ATOM 13506 C THR H 146 -21.141 110.268 17.178 1.00 11.75 C
+ATOM 13507 O THR H 146 -21.583 110.598 16.077 1.00 11.82 O
+ATOM 13508 CB THR H 146 -19.547 111.973 18.156 1.00 12.10 C
+ATOM 13509 OG1 THR H 146 -20.357 112.100 19.330 1.00 12.99 O
+ATOM 13510 CG2 THR H 146 -19.937 113.022 17.155 1.00 10.64 C
+ATOM 13511 H THR H 146 -19.092 110.825 15.496 1.00 0.00 H
+ATOM 13512 HA THR H 146 -19.423 109.832 18.297 1.00 0.00 H
+ATOM 13513 HB THR H 146 -18.502 112.121 18.430 1.00 0.00 H
+ATOM 13514 HG1 THR H 146 -21.273 111.906 19.111 1.00 0.00 H
+ATOM 13515 1HG2 THR H 146 -19.807 114.010 17.594 1.00 0.00 H
+ATOM 13516 2HG2 THR H 146 -19.312 112.933 16.263 1.00 0.00 H
+ATOM 13517 3HG2 THR H 146 -20.971 112.880 16.890 1.00 0.00 H
+ATOM 13518 N VAL H 147 -21.853 109.633 18.105 1.00 11.44 N
+ATOM 13519 CA VAL H 147 -23.223 109.223 17.841 1.00 11.57 C
+ATOM 13520 C VAL H 147 -24.196 109.916 18.798 1.00 11.94 C
+ATOM 13521 O VAL H 147 -23.994 109.887 20.014 1.00 12.12 O
+ATOM 13522 CB VAL H 147 -23.330 107.686 17.974 1.00 11.55 C
+ATOM 13523 CG1 VAL H 147 -24.744 107.248 17.692 1.00 11.15 C
+ATOM 13524 CG2 VAL H 147 -22.332 106.988 17.039 1.00 10.48 C
+ATOM 13525 H VAL H 147 -21.418 109.401 18.999 1.00 0.00 H
+ATOM 13526 HA VAL H 147 -23.478 109.500 16.823 1.00 0.00 H
+ATOM 13527 HB VAL H 147 -23.092 107.408 18.988 1.00 0.00 H
+ATOM 13528 1HG1 VAL H 147 -24.831 106.175 17.798 1.00 0.00 H
+ATOM 13529 2HG1 VAL H 147 -25.404 107.735 18.390 1.00 0.00 H
+ATOM 13530 3HG1 VAL H 147 -25.013 107.531 16.672 1.00 0.00 H
+ATOM 13531 1HG2 VAL H 147 -22.418 105.919 17.182 1.00 0.00 H
+ATOM 13532 2HG2 VAL H 147 -22.551 107.228 16.020 1.00 0.00 H
+ATOM 13533 3HG2 VAL H 147 -21.317 107.298 17.277 1.00 0.00 H
+ATOM 13534 N SER H 148 -25.219 110.562 18.240 1.00 12.19 N
+ATOM 13535 CA SER H 148 -26.200 111.304 19.039 1.00 12.87 C
+ATOM 13536 C SER H 148 -27.392 111.773 18.208 1.00 12.85 C
+ATOM 13537 O SER H 148 -27.220 112.247 17.087 1.00 12.78 O
+ATOM 13538 OXT SER H 148 -28.529 111.678 18.663 1.00 0.00 O
+ATOM 13539 CB SER H 148 -25.554 112.514 19.697 1.00 12.47 C
+ATOM 13540 OG SER H 148 -26.494 113.254 20.429 1.00 13.74 O
+ATOM 13541 H SER H 148 -25.311 110.512 17.226 1.00 0.00 H
+ATOM 13542 HA SER H 148 -26.575 110.641 19.818 1.00 0.00 H
+ATOM 13543 1HB SER H 148 -24.758 112.197 20.359 1.00 0.00 H
+ATOM 13544 2HB SER H 148 -25.108 113.145 18.938 1.00 0.00 H
+ATOM 13545 HG SER H 148 -26.754 112.694 21.166 1.00 0.00 H
+TER
+ATOM 13547 N ASP L 1 -8.249 84.535 24.607 1.00 30.87 N
+ATOM 13548 CA ASP L 1 -8.204 85.979 24.803 1.00 30.75 C
+ATOM 13549 C ASP L 1 -7.277 86.291 25.968 1.00 29.03 C
+ATOM 13550 O ASP L 1 -7.419 85.720 27.048 1.00 29.42 O
+ATOM 13551 CB ASP L 1 -9.620 86.514 25.077 1.00 30.97 C
+ATOM 13552 CG ASP L 1 -9.750 88.052 25.107 1.00 33.98 C
+ATOM 13553 OD1 ASP L 1 -9.750 88.612 26.183 1.00 37.66 O
+ATOM 13554 OD2 ASP L 1 -9.876 88.641 24.055 1.00 38.04 O
+ATOM 13555 1H ASP L 1 -8.877 84.309 23.849 1.00 0.00 H
+ATOM 13556 2H ASP L 1 -7.318 84.205 24.389 1.00 0.00 H
+ATOM 13557 3H ASP L 1 -8.569 84.093 25.456 1.00 0.00 H
+ATOM 13558 HA ASP L 1 -7.805 86.453 23.907 1.00 0.00 H
+ATOM 13559 1HB ASP L 1 -10.295 86.132 24.314 1.00 0.00 H
+ATOM 13560 2HB ASP L 1 -9.968 86.125 26.040 1.00 0.00 H
+ATOM 13561 N ILE L 2 -6.346 87.203 25.747 1.00 26.30 N
+ATOM 13562 CA ILE L 2 -5.377 87.577 26.779 1.00 22.98 C
+ATOM 13563 C ILE L 2 -5.662 88.998 27.205 1.00 21.67 C
+ATOM 13564 O ILE L 2 -5.761 89.879 26.355 1.00 20.42 O
+ATOM 13565 CB ILE L 2 -3.931 87.511 26.257 1.00 22.50 C
+ATOM 13566 CG1 ILE L 2 -3.632 86.113 25.750 1.00 21.74 C
+ATOM 13567 CG2 ILE L 2 -2.968 87.907 27.405 1.00 21.48 C
+ATOM 13568 CD1 ILE L 2 -2.331 85.980 25.005 1.00 23.80 C
+ATOM 13569 H ILE L 2 -6.294 87.656 24.844 1.00 0.00 H
+ATOM 13570 HA ILE L 2 -5.485 86.916 27.642 1.00 0.00 H
+ATOM 13571 HB ILE L 2 -3.809 88.188 25.415 1.00 0.00 H
+ATOM 13572 1HG1 ILE L 2 -3.610 85.439 26.576 1.00 0.00 H
+ATOM 13573 2HG1 ILE L 2 -4.440 85.819 25.076 1.00 0.00 H
+ATOM 13574 1HG2 ILE L 2 -1.952 87.865 27.054 1.00 0.00 H
+ATOM 13575 2HG2 ILE L 2 -3.195 88.919 27.734 1.00 0.00 H
+ATOM 13576 3HG2 ILE L 2 -3.091 87.221 28.245 1.00 0.00 H
+ATOM 13577 1HD1 ILE L 2 -2.217 84.959 24.667 1.00 0.00 H
+ATOM 13578 2HD1 ILE L 2 -2.325 86.643 24.146 1.00 0.00 H
+ATOM 13579 3HD1 ILE L 2 -1.529 86.230 25.661 1.00 0.00 H
+ATOM 13580 N GLN L 3 -5.789 89.225 28.504 1.00 20.83 N
+ATOM 13581 CA GLN L 3 -6.080 90.566 28.975 1.00 20.08 C
+ATOM 13582 C GLN L 3 -4.848 91.160 29.623 1.00 18.56 C
+ATOM 13583 O GLN L 3 -4.115 90.489 30.353 1.00 18.76 O
+ATOM 13584 CB GLN L 3 -7.221 90.564 30.000 1.00 20.92 C
+ATOM 13585 CG GLN L 3 -8.557 89.971 29.524 1.00 23.86 C
+ATOM 13586 CD GLN L 3 -8.630 88.464 29.761 1.00 29.74 C
+ATOM 13587 OE1 GLN L 3 -8.312 88.025 30.868 1.00 30.18 O
+ATOM 13588 NE2 GLN L 3 -9.059 87.691 28.773 1.00 33.10 N
+ATOM 13589 H GLN L 3 -5.694 88.468 29.167 1.00 0.00 H
+ATOM 13590 HA GLN L 3 -6.362 91.192 28.128 1.00 0.00 H
+ATOM 13591 1HB GLN L 3 -6.914 90.027 30.889 1.00 0.00 H
+ATOM 13592 2HB GLN L 3 -7.417 91.596 30.303 1.00 0.00 H
+ATOM 13593 1HG GLN L 3 -9.359 90.424 30.096 1.00 0.00 H
+ATOM 13594 2HG GLN L 3 -8.690 90.161 28.456 1.00 0.00 H
+ATOM 13595 1HE2 GLN L 3 -9.129 86.705 28.899 1.00 0.00 H
+ATOM 13596 2HE2 GLN L 3 -9.324 88.095 27.881 1.00 0.00 H
+ATOM 13597 N MET L 4 -4.610 92.428 29.338 1.00 16.52 N
+ATOM 13598 CA MET L 4 -3.526 93.185 29.948 1.00 15.09 C
+ATOM 13599 C MET L 4 -4.005 93.897 31.207 1.00 14.61 C
+ATOM 13600 O MET L 4 -4.972 94.655 31.164 1.00 15.71 O
+ATOM 13601 CB MET L 4 -3.039 94.194 28.926 1.00 14.90 C
+ATOM 13602 CG MET L 4 -2.415 93.599 27.683 1.00 15.39 C
+ATOM 13603 SD MET L 4 -0.823 92.825 28.025 1.00 15.99 S
+ATOM 13604 CE MET L 4 -1.265 91.129 28.228 1.00 20.31 C
+ATOM 13605 H MET L 4 -5.224 92.902 28.689 1.00 0.00 H
+ATOM 13606 HA MET L 4 -2.711 92.504 30.224 1.00 0.00 H
+ATOM 13607 1HB MET L 4 -3.888 94.770 28.587 1.00 0.00 H
+ATOM 13608 2HB MET L 4 -2.358 94.875 29.384 1.00 0.00 H
+ATOM 13609 1HG MET L 4 -3.081 92.855 27.238 1.00 0.00 H
+ATOM 13610 2HG MET L 4 -2.261 94.412 26.959 1.00 0.00 H
+ATOM 13611 1HE MET L 4 -0.371 90.545 28.423 1.00 0.00 H
+ATOM 13612 2HE MET L 4 -1.964 91.029 29.045 1.00 0.00 H
+ATOM 13613 3HE MET L 4 -1.731 90.784 27.367 1.00 0.00 H
+ATOM 13614 N THR L 5 -3.317 93.683 32.324 1.00 13.30 N
+ATOM 13615 CA THR L 5 -3.666 94.377 33.559 1.00 13.22 C
+ATOM 13616 C THR L 5 -2.557 95.325 33.941 1.00 13.35 C
+ATOM 13617 O THR L 5 -1.472 94.900 34.309 1.00 12.65 O
+ATOM 13618 CB THR L 5 -3.931 93.396 34.710 1.00 13.63 C
+ATOM 13619 OG1 THR L 5 -5.026 92.522 34.372 1.00 16.67 O
+ATOM 13620 CG2 THR L 5 -4.266 94.160 35.986 1.00 11.66 C
+ATOM 13621 H THR L 5 -2.550 93.013 32.340 1.00 0.00 H
+ATOM 13622 HA THR L 5 -4.573 94.963 33.387 1.00 0.00 H
+ATOM 13623 HB THR L 5 -3.046 92.794 34.886 1.00 0.00 H
+ATOM 13624 HG1 THR L 5 -5.719 93.037 33.940 1.00 0.00 H
+ATOM 13625 1HG2 THR L 5 -4.434 93.456 36.800 1.00 0.00 H
+ATOM 13626 2HG2 THR L 5 -3.431 94.820 36.247 1.00 0.00 H
+ATOM 13627 3HG2 THR L 5 -5.163 94.765 35.839 1.00 0.00 H
+ATOM 13628 N GLN L 6 -2.828 96.613 33.850 1.00 14.17 N
+ATOM 13629 CA GLN L 6 -1.785 97.598 34.061 1.00 14.17 C
+ATOM 13630 C GLN L 6 -2.013 98.418 35.311 1.00 14.86 C
+ATOM 13631 O GLN L 6 -3.121 98.851 35.591 1.00 14.78 O
+ATOM 13632 CB GLN L 6 -1.669 98.497 32.842 1.00 13.40 C
+ATOM 13633 CG GLN L 6 -0.542 99.517 32.899 1.00 13.93 C
+ATOM 13634 CD GLN L 6 -0.415 100.236 31.613 1.00 13.05 C
+ATOM 13635 OE1 GLN L 6 0.564 100.909 31.323 1.00 17.74 O
+ATOM 13636 NE2 GLN L 6 -1.457 100.087 30.807 1.00 11.59 N
+ATOM 13637 H GLN L 6 -3.753 96.899 33.568 1.00 0.00 H
+ATOM 13638 HA GLN L 6 -0.830 97.079 34.176 1.00 0.00 H
+ATOM 13639 1HB GLN L 6 -1.511 97.873 31.949 1.00 0.00 H
+ATOM 13640 2HB GLN L 6 -2.605 99.041 32.687 1.00 0.00 H
+ATOM 13641 1HG GLN L 6 -0.781 100.234 33.682 1.00 0.00 H
+ATOM 13642 2HG GLN L 6 0.396 99.008 33.121 1.00 0.00 H
+ATOM 13643 1HE2 GLN L 6 -1.499 100.537 29.924 1.00 0.00 H
+ATOM 13644 2HE2 GLN L 6 -2.223 99.521 31.107 1.00 0.00 H
+ATOM 13645 N SER L 7 -0.950 98.607 36.077 1.00 15.40 N
+ATOM 13646 CA SER L 7 -1.058 99.410 37.298 1.00 16.30 C
+ATOM 13647 C SER L 7 0.293 100.031 37.684 1.00 15.74 C
+ATOM 13648 O SER L 7 1.342 99.554 37.224 1.00 16.51 O
+ATOM 13649 CB SER L 7 -1.478 98.516 38.449 1.00 17.40 C
+ATOM 13650 OG SER L 7 -0.465 97.586 38.772 1.00 20.36 O
+ATOM 13651 H SER L 7 -0.068 98.193 35.813 1.00 0.00 H
+ATOM 13652 HA SER L 7 -1.812 100.160 37.136 1.00 0.00 H
+ATOM 13653 1HB SER L 7 -1.709 99.106 39.337 1.00 0.00 H
+ATOM 13654 2HB SER L 7 -2.373 97.963 38.161 1.00 0.00 H
+ATOM 13655 HG SER L 7 0.329 98.093 38.884 1.00 0.00 H
+ATOM 13656 N PRO L 8 0.323 101.156 38.415 1.00 14.47 N
+ATOM 13657 CA PRO L 8 -0.764 102.032 38.917 1.00 13.73 C
+ATOM 13658 C PRO L 8 -1.577 102.613 37.781 1.00 14.34 C
+ATOM 13659 O PRO L 8 -1.090 102.767 36.667 1.00 14.63 O
+ATOM 13660 CB PRO L 8 0.049 103.147 39.627 1.00 12.94 C
+ATOM 13661 CG PRO L 8 1.349 102.521 40.018 1.00 13.01 C
+ATOM 13662 CD PRO L 8 1.604 101.480 38.911 1.00 14.04 C
+ATOM 13663 HA PRO L 8 -1.379 101.495 39.627 1.00 0.00 H
+ATOM 13664 1HB PRO L 8 0.171 103.964 38.915 1.00 0.00 H
+ATOM 13665 2HB PRO L 8 -0.549 103.538 40.450 1.00 0.00 H
+ATOM 13666 1HG PRO L 8 2.118 103.251 40.102 1.00 0.00 H
+ATOM 13667 2HG PRO L 8 1.229 102.073 40.997 1.00 0.00 H
+ATOM 13668 1HD PRO L 8 2.220 101.935 38.097 1.00 0.00 H
+ATOM 13669 2HD PRO L 8 2.097 100.588 39.314 1.00 0.00 H
+ATOM 13670 N SER L 9 -2.872 102.933 38.027 1.00 14.12 N
+ATOM 13671 CA SER L 9 -3.706 103.530 36.957 1.00 14.21 C
+ATOM 13672 C SER L 9 -3.265 104.979 36.694 1.00 13.42 C
+ATOM 13673 O SER L 9 -3.537 105.568 35.641 1.00 12.87 O
+ATOM 13674 CB SER L 9 -5.190 103.449 37.316 1.00 14.51 C
+ATOM 13675 OG SER L 9 -5.517 104.265 38.415 1.00 16.53 O
+ATOM 13676 H SER L 9 -3.286 102.766 38.941 1.00 0.00 H
+ATOM 13677 HA SER L 9 -3.559 102.963 36.040 1.00 0.00 H
+ATOM 13678 1HB SER L 9 -5.786 103.726 36.450 1.00 0.00 H
+ATOM 13679 2HB SER L 9 -5.416 102.410 37.562 1.00 0.00 H
+ATOM 13680 HG SER L 9 -4.915 104.048 39.120 1.00 0.00 H
+ATOM 13681 N SER L 10 -2.560 105.539 37.647 1.00 12.04 N
+ATOM 13682 CA SER L 10 -1.967 106.840 37.553 1.00 12.20 C
+ATOM 13683 C SER L 10 -0.850 106.875 38.583 1.00 12.74 C
+ATOM 13684 O SER L 10 -0.917 106.185 39.598 1.00 12.71 O
+ATOM 13685 CB SER L 10 -2.979 107.952 37.815 1.00 11.85 C
+ATOM 13686 OG SER L 10 -3.422 107.937 39.149 1.00 12.91 O
+ATOM 13687 H SER L 10 -2.389 104.998 38.483 1.00 0.00 H
+ATOM 13688 HA SER L 10 -1.529 106.979 36.568 1.00 0.00 H
+ATOM 13689 1HB SER L 10 -2.522 108.926 37.607 1.00 0.00 H
+ATOM 13690 2HB SER L 10 -3.838 107.849 37.148 1.00 0.00 H
+ATOM 13691 HG SER L 10 -2.628 108.064 39.685 1.00 0.00 H
+ATOM 13692 N LEU L 11 0.149 107.692 38.344 1.00 12.34 N
+ATOM 13693 CA LEU L 11 1.217 107.811 39.324 1.00 13.21 C
+ATOM 13694 C LEU L 11 1.812 109.184 39.242 1.00 13.08 C
+ATOM 13695 O LEU L 11 1.795 109.804 38.174 1.00 13.27 O
+ATOM 13696 CB LEU L 11 2.276 106.722 39.087 1.00 13.46 C
+ATOM 13697 CG LEU L 11 3.046 106.791 37.766 1.00 15.99 C
+ATOM 13698 CD1 LEU L 11 4.292 107.666 37.972 1.00 15.38 C
+ATOM 13699 CD2 LEU L 11 3.421 105.377 37.288 1.00 13.61 C
+ATOM 13700 H LEU L 11 0.161 108.218 37.477 1.00 0.00 H
+ATOM 13701 HA LEU L 11 0.792 107.678 40.320 1.00 0.00 H
+ATOM 13702 1HB LEU L 11 3.008 106.770 39.895 1.00 0.00 H
+ATOM 13703 2HB LEU L 11 1.789 105.738 39.124 1.00 0.00 H
+ATOM 13704 HG LEU L 11 2.425 107.279 37.012 1.00 0.00 H
+ATOM 13705 1HD1 LEU L 11 4.831 107.732 37.046 1.00 0.00 H
+ATOM 13706 2HD1 LEU L 11 3.997 108.663 38.295 1.00 0.00 H
+ATOM 13707 3HD1 LEU L 11 4.921 107.209 38.730 1.00 0.00 H
+ATOM 13708 1HD2 LEU L 11 3.967 105.432 36.348 1.00 0.00 H
+ATOM 13709 2HD2 LEU L 11 4.051 104.883 38.034 1.00 0.00 H
+ATOM 13710 3HD2 LEU L 11 2.512 104.785 37.141 1.00 0.00 H
+ATOM 13711 N SER L 12 2.356 109.658 40.347 1.00 13.10 N
+ATOM 13712 CA SER L 12 3.008 110.946 40.330 1.00 13.49 C
+ATOM 13713 C SER L 12 4.482 110.757 40.599 1.00 12.78 C
+ATOM 13714 O SER L 12 4.870 109.977 41.476 1.00 12.65 O
+ATOM 13715 CB SER L 12 2.401 111.850 41.376 1.00 14.27 C
+ATOM 13716 OG SER L 12 1.043 112.061 41.140 1.00 18.11 O
+ATOM 13717 H SER L 12 2.320 109.124 41.203 1.00 0.00 H
+ATOM 13718 HA SER L 12 2.894 111.400 39.339 1.00 0.00 H
+ATOM 13719 1HB SER L 12 2.546 111.429 42.370 1.00 0.00 H
+ATOM 13720 2HB SER L 12 2.917 112.799 41.356 1.00 0.00 H
+ATOM 13721 HG SER L 12 0.966 112.392 40.236 1.00 0.00 H
+ATOM 13722 N ALA L 13 5.302 111.502 39.887 1.00 11.97 N
+ATOM 13723 CA ALA L 13 6.743 111.470 40.094 1.00 11.69 C
+ATOM 13724 C ALA L 13 7.333 112.817 39.676 1.00 11.56 C
+ATOM 13725 O ALA L 13 6.715 113.548 38.911 1.00 12.89 O
+ATOM 13726 CB ALA L 13 7.348 110.315 39.311 1.00 9.72 C
+ATOM 13727 H ALA L 13 4.917 112.094 39.152 1.00 0.00 H
+ATOM 13728 HA ALA L 13 6.946 111.328 41.151 1.00 0.00 H
+ATOM 13729 1HB ALA L 13 8.415 110.291 39.472 1.00 0.00 H
+ATOM 13730 2HB ALA L 13 6.912 109.376 39.654 1.00 0.00 H
+ATOM 13731 3HB ALA L 13 7.136 110.443 38.269 1.00 0.00 H
+ATOM 13732 N SER L 14 8.501 113.158 40.200 1.00 10.83 N
+ATOM 13733 CA SER L 14 9.166 114.413 39.859 1.00 10.30 C
+ATOM 13734 C SER L 14 10.097 114.288 38.676 1.00 10.70 C
+ATOM 13735 O SER L 14 10.476 113.191 38.270 1.00 10.27 O
+ATOM 13736 CB SER L 14 9.938 114.956 41.042 1.00 10.33 C
+ATOM 13737 OG SER L 14 9.066 115.366 42.055 1.00 9.39 O
+ATOM 13738 H SER L 14 8.986 112.514 40.836 1.00 0.00 H
+ATOM 13739 HA SER L 14 8.396 115.147 39.602 1.00 0.00 H
+ATOM 13740 1HB SER L 14 10.598 114.182 41.427 1.00 0.00 H
+ATOM 13741 2HB SER L 14 10.566 115.791 40.716 1.00 0.00 H
+ATOM 13742 HG SER L 14 8.580 116.135 41.677 1.00 0.00 H
+ATOM 13743 N VAL L 15 10.493 115.418 38.116 1.00 11.55 N
+ATOM 13744 CA VAL L 15 11.466 115.357 37.045 1.00 10.98 C
+ATOM 13745 C VAL L 15 12.766 114.780 37.601 1.00 11.39 C
+ATOM 13746 O VAL L 15 13.247 115.217 38.647 1.00 12.57 O
+ATOM 13747 CB VAL L 15 11.702 116.747 36.447 1.00 10.64 C
+ATOM 13748 CG1 VAL L 15 12.819 116.692 35.429 1.00 10.01 C
+ATOM 13749 CG2 VAL L 15 10.427 117.224 35.804 1.00 8.46 C
+ATOM 13750 H VAL L 15 10.138 116.309 38.446 1.00 0.00 H
+ATOM 13751 HA VAL L 15 11.087 114.701 36.261 1.00 0.00 H
+ATOM 13752 HB VAL L 15 11.998 117.437 37.233 1.00 0.00 H
+ATOM 13753 1HG1 VAL L 15 12.981 117.683 35.008 1.00 0.00 H
+ATOM 13754 2HG1 VAL L 15 13.731 116.351 35.909 1.00 0.00 H
+ATOM 13755 3HG1 VAL L 15 12.550 116.001 34.643 1.00 0.00 H
+ATOM 13756 1HG2 VAL L 15 10.582 118.214 35.386 1.00 0.00 H
+ATOM 13757 2HG2 VAL L 15 10.135 116.530 35.011 1.00 0.00 H
+ATOM 13758 3HG2 VAL L 15 9.643 117.270 36.561 1.00 0.00 H
+ATOM 13759 N GLY L 16 13.308 113.786 36.908 1.00 11.20 N
+ATOM 13760 CA GLY L 16 14.527 113.088 37.302 1.00 11.26 C
+ATOM 13761 C GLY L 16 14.250 111.772 38.030 1.00 11.50 C
+ATOM 13762 O GLY L 16 15.145 110.937 38.173 1.00 11.42 O
+ATOM 13763 H GLY L 16 12.850 113.504 36.049 1.00 0.00 H
+ATOM 13764 1HA GLY L 16 15.127 112.893 36.419 1.00 0.00 H
+ATOM 13765 2HA GLY L 16 15.117 113.736 37.947 1.00 0.00 H
+ATOM 13766 N ASP L 17 13.016 111.571 38.482 1.00 12.30 N
+ATOM 13767 CA ASP L 17 12.666 110.336 39.165 1.00 13.40 C
+ATOM 13768 C ASP L 17 12.632 109.148 38.223 1.00 13.60 C
+ATOM 13769 O ASP L 17 12.336 109.274 37.033 1.00 13.10 O
+ATOM 13770 CB ASP L 17 11.321 110.444 39.885 1.00 13.33 C
+ATOM 13771 CG ASP L 17 11.376 111.261 41.183 1.00 16.59 C
+ATOM 13772 OD1 ASP L 17 10.326 111.640 41.675 1.00 12.90 O
+ATOM 13773 OD2 ASP L 17 12.451 111.473 41.692 1.00 20.18 O
+ATOM 13774 H ASP L 17 12.297 112.281 38.349 1.00 0.00 H
+ATOM 13775 HA ASP L 17 13.428 110.142 39.919 1.00 0.00 H
+ATOM 13776 1HB ASP L 17 10.600 110.901 39.219 1.00 0.00 H
+ATOM 13777 2HB ASP L 17 10.962 109.434 40.113 1.00 0.00 H
+ATOM 13778 N ARG L 18 12.910 107.980 38.771 1.00 14.34 N
+ATOM 13779 CA ARG L 18 12.784 106.760 38.002 1.00 14.57 C
+ATOM 13780 C ARG L 18 11.344 106.295 38.123 1.00 14.43 C
+ATOM 13781 O ARG L 18 10.808 106.214 39.234 1.00 14.86 O
+ATOM 13782 CB ARG L 18 13.761 105.706 38.496 1.00 13.90 C
+ATOM 13783 CG ARG L 18 13.764 104.390 37.733 1.00 18.57 C
+ATOM 13784 CD ARG L 18 14.875 103.512 38.215 1.00 22.02 C
+ATOM 13785 NE ARG L 18 14.962 102.251 37.492 1.00 25.09 N
+ATOM 13786 CZ ARG L 18 14.382 101.096 37.881 1.00 26.51 C
+ATOM 13787 NH1 ARG L 18 13.675 101.051 38.989 1.00 24.55 N
+ATOM 13788 NH2 ARG L 18 14.526 100.005 37.148 1.00 26.39 N
+ATOM 13789 H ARG L 18 13.187 107.935 39.741 1.00 0.00 H
+ATOM 13790 HA ARG L 18 13.003 106.973 36.956 1.00 0.00 H
+ATOM 13791 1HB ARG L 18 14.773 106.112 38.439 1.00 0.00 H
+ATOM 13792 2HB ARG L 18 13.556 105.481 39.540 1.00 0.00 H
+ATOM 13793 1HG ARG L 18 12.815 103.875 37.886 1.00 0.00 H
+ATOM 13794 2HG ARG L 18 13.901 104.589 36.668 1.00 0.00 H
+ATOM 13795 1HD ARG L 18 15.823 104.035 38.099 1.00 0.00 H
+ATOM 13796 2HD ARG L 18 14.714 103.287 39.269 1.00 0.00 H
+ATOM 13797 HE ARG L 18 15.498 102.240 36.634 1.00 0.00 H
+ATOM 13798 1HH1 ARG L 18 13.564 101.883 39.553 1.00 0.00 H
+ATOM 13799 2HH1 ARG L 18 13.244 100.186 39.279 1.00 0.00 H
+ATOM 13800 1HH2 ARG L 18 15.070 100.036 36.296 1.00 0.00 H
+ATOM 13801 2HH2 ARG L 18 14.093 99.142 37.437 1.00 0.00 H
+ATOM 13802 N VAL L 19 10.703 106.048 36.988 1.00 15.05 N
+ATOM 13803 CA VAL L 19 9.302 105.629 36.973 1.00 15.89 C
+ATOM 13804 C VAL L 19 9.129 104.185 36.546 1.00 16.19 C
+ATOM 13805 O VAL L 19 9.702 103.747 35.544 1.00 17.02 O
+ATOM 13806 CB VAL L 19 8.455 106.542 36.053 1.00 16.35 C
+ATOM 13807 CG1 VAL L 19 7.025 106.027 35.944 1.00 16.00 C
+ATOM 13808 CG2 VAL L 19 8.434 107.939 36.621 1.00 17.14 C
+ATOM 13809 H VAL L 19 11.222 106.150 36.115 1.00 0.00 H
+ATOM 13810 HA VAL L 19 8.912 105.731 37.987 1.00 0.00 H
+ATOM 13811 HB VAL L 19 8.875 106.549 35.072 1.00 0.00 H
+ATOM 13812 1HG1 VAL L 19 6.448 106.684 35.294 1.00 0.00 H
+ATOM 13813 2HG1 VAL L 19 7.033 105.024 35.523 1.00 0.00 H
+ATOM 13814 3HG1 VAL L 19 6.569 106.002 36.929 1.00 0.00 H
+ATOM 13815 1HG2 VAL L 19 7.837 108.569 35.975 1.00 0.00 H
+ATOM 13816 2HG2 VAL L 19 7.991 107.915 37.617 1.00 0.00 H
+ATOM 13817 3HG2 VAL L 19 9.448 108.334 36.686 1.00 0.00 H
+ATOM 13818 N THR L 20 8.340 103.445 37.321 1.00 17.41 N
+ATOM 13819 CA THR L 20 8.048 102.050 37.023 1.00 18.16 C
+ATOM 13820 C THR L 20 6.568 101.840 36.749 1.00 17.74 C
+ATOM 13821 O THR L 20 5.719 102.187 37.585 1.00 18.50 O
+ATOM 13822 CB THR L 20 8.453 101.132 38.197 1.00 18.59 C
+ATOM 13823 OG1 THR L 20 9.853 101.260 38.462 1.00 22.60 O
+ATOM 13824 CG2 THR L 20 8.148 99.682 37.862 1.00 20.36 C
+ATOM 13825 H THR L 20 7.920 103.869 38.137 1.00 0.00 H
+ATOM 13826 HA THR L 20 8.600 101.755 36.124 1.00 0.00 H
+ATOM 13827 HB THR L 20 7.894 101.421 39.086 1.00 0.00 H
+ATOM 13828 HG1 THR L 20 10.344 100.920 37.711 1.00 0.00 H
+ATOM 13829 1HG2 THR L 20 8.436 99.049 38.698 1.00 0.00 H
+ATOM 13830 2HG2 THR L 20 7.081 99.559 37.663 1.00 0.00 H
+ATOM 13831 3HG2 THR L 20 8.715 99.397 36.983 1.00 0.00 H
+ATOM 13832 N ILE L 21 6.255 101.268 35.594 1.00 17.53 N
+ATOM 13833 CA ILE L 21 4.901 100.927 35.177 1.00 17.17 C
+ATOM 13834 C ILE L 21 4.788 99.410 34.967 1.00 18.02 C
+ATOM 13835 O ILE L 21 5.594 98.829 34.229 1.00 18.81 O
+ATOM 13836 CB ILE L 21 4.534 101.694 33.901 1.00 16.88 C
+ATOM 13837 CG1 ILE L 21 4.583 103.229 34.184 1.00 16.87 C
+ATOM 13838 CG2 ILE L 21 3.165 101.245 33.406 1.00 17.53 C
+ATOM 13839 CD1 ILE L 21 4.606 104.105 32.953 1.00 14.13 C
+ATOM 13840 H ILE L 21 7.019 101.057 34.945 1.00 0.00 H
+ATOM 13841 HA ILE L 21 4.205 101.221 35.970 1.00 0.00 H
+ATOM 13842 HB ILE L 21 5.270 101.492 33.151 1.00 0.00 H
+ATOM 13843 1HG1 ILE L 21 3.702 103.491 34.771 1.00 0.00 H
+ATOM 13844 2HG1 ILE L 21 5.463 103.457 34.765 1.00 0.00 H
+ATOM 13845 1HG2 ILE L 21 2.912 101.778 32.493 1.00 0.00 H
+ATOM 13846 2HG2 ILE L 21 3.181 100.176 33.205 1.00 0.00 H
+ATOM 13847 3HG2 ILE L 21 2.413 101.455 34.171 1.00 0.00 H
+ATOM 13848 1HD1 ILE L 21 4.628 105.152 33.250 1.00 0.00 H
+ATOM 13849 2HD1 ILE L 21 5.496 103.881 32.374 1.00 0.00 H
+ATOM 13850 3HD1 ILE L 21 3.727 103.918 32.358 1.00 0.00 H
+ATOM 13851 N THR L 22 3.809 98.760 35.605 1.00 18.36 N
+ATOM 13852 CA THR L 22 3.699 97.311 35.503 1.00 18.92 C
+ATOM 13853 C THR L 22 2.484 96.853 34.712 1.00 18.76 C
+ATOM 13854 O THR L 22 1.376 97.338 34.927 1.00 17.69 O
+ATOM 13855 CB THR L 22 3.615 96.660 36.910 1.00 19.27 C
+ATOM 13856 OG1 THR L 22 4.791 96.985 37.661 1.00 22.39 O
+ATOM 13857 CG2 THR L 22 3.498 95.122 36.796 1.00 19.33 C
+ATOM 13858 H THR L 22 3.125 99.260 36.180 1.00 0.00 H
+ATOM 13859 HA THR L 22 4.590 96.933 34.998 1.00 0.00 H
+ATOM 13860 HB THR L 22 2.740 97.056 37.437 1.00 0.00 H
+ATOM 13861 HG1 THR L 22 5.566 96.751 37.151 1.00 0.00 H
+ATOM 13862 1HG2 THR L 22 3.449 94.684 37.794 1.00 0.00 H
+ATOM 13863 2HG2 THR L 22 2.597 94.851 36.242 1.00 0.00 H
+ATOM 13864 3HG2 THR L 22 4.369 94.729 36.278 1.00 0.00 H
+ATOM 13865 N CYS L 23 2.686 95.905 33.819 1.00 19.34 N
+ATOM 13866 CA CYS L 23 1.575 95.307 33.063 1.00 21.34 C
+ATOM 13867 C CYS L 23 1.616 93.798 33.163 1.00 20.70 C
+ATOM 13868 O CYS L 23 2.573 93.160 32.704 1.00 21.85 O
+ATOM 13869 CB CYS L 23 1.618 95.763 31.624 1.00 22.14 C
+ATOM 13870 SG CYS L 23 0.257 95.131 30.612 1.00 29.34 S
+ATOM 13871 H CYS L 23 3.622 95.559 33.644 1.00 0.00 H
+ATOM 13872 HA CYS L 23 0.644 95.655 33.515 1.00 0.00 H
+ATOM 13873 1HB CYS L 23 1.576 96.852 31.584 1.00 0.00 H
+ATOM 13874 2HB CYS L 23 2.563 95.445 31.159 1.00 0.00 H
+ATOM 13875 N ARG L 24 0.614 93.207 33.778 1.00 19.88 N
+ATOM 13876 CA ARG L 24 0.559 91.771 34.006 1.00 19.34 C
+ATOM 13877 C ARG L 24 -0.329 91.075 33.003 1.00 18.34 C
+ATOM 13878 O ARG L 24 -1.437 91.530 32.721 1.00 19.15 O
+ATOM 13879 CB ARG L 24 0.054 91.459 35.407 1.00 19.50 C
+ATOM 13880 CG ARG L 24 -0.105 89.977 35.698 1.00 22.36 C
+ATOM 13881 CD ARG L 24 -0.412 89.713 37.122 1.00 27.55 C
+ATOM 13882 NE ARG L 24 0.750 89.941 37.986 1.00 32.88 N
+ATOM 13883 CZ ARG L 24 0.753 89.886 39.334 1.00 33.56 C
+ATOM 13884 NH1 ARG L 24 -0.356 89.641 40.002 1.00 31.93 N
+ATOM 13885 NH2 ARG L 24 1.886 90.070 39.985 1.00 31.60 N
+ATOM 13886 H ARG L 24 -0.156 93.777 34.111 1.00 0.00 H
+ATOM 13887 HA ARG L 24 1.561 91.360 33.913 1.00 0.00 H
+ATOM 13888 1HB ARG L 24 0.736 91.873 36.151 1.00 0.00 H
+ATOM 13889 2HB ARG L 24 -0.915 91.924 35.557 1.00 0.00 H
+ATOM 13890 1HG ARG L 24 -0.906 89.560 35.083 1.00 0.00 H
+ATOM 13891 2HG ARG L 24 0.847 89.471 35.455 1.00 0.00 H
+ATOM 13892 1HD ARG L 24 -1.217 90.364 37.456 1.00 0.00 H
+ATOM 13893 2HD ARG L 24 -0.726 88.671 37.236 1.00 0.00 H
+ATOM 13894 HE ARG L 24 1.643 90.158 37.528 1.00 0.00 H
+ATOM 13895 1HH1 ARG L 24 -1.224 89.507 39.504 1.00 0.00 H
+ATOM 13896 2HH1 ARG L 24 -0.334 89.604 41.006 1.00 0.00 H
+ATOM 13897 1HH2 ARG L 24 2.753 90.251 39.434 1.00 0.00 H
+ATOM 13898 2HH2 ARG L 24 1.916 90.008 40.993 1.00 0.00 H
+ATOM 13899 N ALA L 25 0.153 89.982 32.423 1.00 16.94 N
+ATOM 13900 CA ALA L 25 -0.699 89.273 31.491 1.00 15.82 C
+ATOM 13901 C ALA L 25 -1.628 88.324 32.237 1.00 14.74 C
+ATOM 13902 O ALA L 25 -1.193 87.609 33.139 1.00 14.55 O
+ATOM 13903 CB ALA L 25 0.147 88.521 30.488 1.00 14.79 C
+ATOM 13904 H ALA L 25 1.091 89.644 32.644 1.00 0.00 H
+ATOM 13905 HA ALA L 25 -1.307 90.002 30.965 1.00 0.00 H
+ATOM 13906 1HB ALA L 25 -0.510 88.035 29.786 1.00 0.00 H
+ATOM 13907 2HB ALA L 25 0.791 89.215 29.957 1.00 0.00 H
+ATOM 13908 3HB ALA L 25 0.757 87.771 30.995 1.00 0.00 H
+ATOM 13909 N SER L 26 -2.907 88.267 31.835 1.00 14.96 N
+ATOM 13910 CA SER L 26 -3.863 87.318 32.424 1.00 15.34 C
+ATOM 13911 C SER L 26 -3.514 85.857 32.094 1.00 16.33 C
+ATOM 13912 O SER L 26 -3.945 84.931 32.792 1.00 16.14 O
+ATOM 13913 CB SER L 26 -5.248 87.577 31.890 1.00 14.97 C
+ATOM 13914 OG SER L 26 -5.310 87.195 30.547 1.00 15.68 O
+ATOM 13915 H SER L 26 -3.241 88.924 31.132 1.00 0.00 H
+ATOM 13916 HA SER L 26 -3.850 87.455 33.513 1.00 0.00 H
+ATOM 13917 1HB SER L 26 -5.987 87.013 32.466 1.00 0.00 H
+ATOM 13918 2HB SER L 26 -5.484 88.633 31.984 1.00 0.00 H
+ATOM 13919 HG SER L 26 -5.209 86.235 30.553 1.00 0.00 H
+ATOM 13920 N GLN L 27 -2.749 85.672 31.020 1.00 16.83 N
+ATOM 13921 CA GLN L 27 -2.267 84.377 30.520 1.00 17.52 C
+ATOM 13922 C GLN L 27 -0.793 84.538 30.265 1.00 17.20 C
+ATOM 13923 O GLN L 27 -0.326 85.613 29.975 1.00 16.06 O
+ATOM 13924 CB GLN L 27 -2.977 83.944 29.209 1.00 17.71 C
+ATOM 13925 CG GLN L 27 -4.514 83.781 29.347 1.00 21.67 C
+ATOM 13926 CD GLN L 27 -5.287 83.179 28.117 1.00 24.32 C
+ATOM 13927 OE1 GLN L 27 -5.170 83.567 26.950 1.00 25.52 O
+ATOM 13928 NE2 GLN L 27 -6.130 82.212 28.440 1.00 24.24 N
+ATOM 13929 H GLN L 27 -2.466 86.506 30.519 1.00 0.00 H
+ATOM 13930 HA GLN L 27 -2.406 83.611 31.273 1.00 0.00 H
+ATOM 13931 1HB GLN L 27 -2.736 84.617 28.416 1.00 0.00 H
+ATOM 13932 2HB GLN L 27 -2.569 82.983 28.901 1.00 0.00 H
+ATOM 13933 1HG GLN L 27 -4.714 83.158 30.211 1.00 0.00 H
+ATOM 13934 2HG GLN L 27 -4.926 84.760 29.499 1.00 0.00 H
+ATOM 13935 1HE2 GLN L 27 -6.694 81.764 27.742 1.00 0.00 H
+ATOM 13936 2HE2 GLN L 27 -6.220 81.930 29.397 1.00 0.00 H
+ATOM 13937 N ASP L 28 -0.033 83.455 30.310 1.00 16.80 N
+ATOM 13938 CA ASP L 28 1.396 83.637 29.995 1.00 16.46 C
+ATOM 13939 C ASP L 28 1.556 84.188 28.569 1.00 15.86 C
+ATOM 13940 O ASP L 28 0.916 83.693 27.650 1.00 15.43 O
+ATOM 13941 CB ASP L 28 2.207 82.345 30.153 1.00 16.91 C
+ATOM 13942 CG ASP L 28 3.720 82.589 29.882 1.00 18.06 C
+ATOM 13943 OD1 ASP L 28 4.080 82.661 28.745 1.00 17.54 O
+ATOM 13944 OD2 ASP L 28 4.493 82.696 30.791 1.00 20.78 O
+ATOM 13945 H ASP L 28 -0.467 82.555 30.551 1.00 0.00 H
+ATOM 13946 HA ASP L 28 1.827 84.374 30.695 1.00 0.00 H
+ATOM 13947 1HB ASP L 28 2.109 81.989 31.178 1.00 0.00 H
+ATOM 13948 2HB ASP L 28 1.808 81.552 29.507 1.00 0.00 H
+ATOM 13949 N VAL L 29 2.435 85.215 28.414 1.00 15.17 N
+ATOM 13950 CA VAL L 29 2.683 85.858 27.118 1.00 14.28 C
+ATOM 13951 C VAL L 29 4.145 85.837 26.644 1.00 13.66 C
+ATOM 13952 O VAL L 29 4.524 86.718 25.881 1.00 13.85 O
+ATOM 13953 CB VAL L 29 2.202 87.340 27.136 1.00 14.13 C
+ATOM 13954 CG1 VAL L 29 2.576 88.109 25.909 1.00 17.00 C
+ATOM 13955 CG2 VAL L 29 0.746 87.371 27.191 1.00 15.17 C
+ATOM 13956 H VAL L 29 2.924 85.559 29.221 1.00 0.00 H
+ATOM 13957 HA VAL L 29 2.088 85.317 26.385 1.00 0.00 H
+ATOM 13958 HB VAL L 29 2.622 87.828 27.992 1.00 0.00 H
+ATOM 13959 1HG1 VAL L 29 2.194 89.114 26.025 1.00 0.00 H
+ATOM 13960 2HG1 VAL L 29 3.657 88.131 25.814 1.00 0.00 H
+ATOM 13961 3HG1 VAL L 29 2.155 87.668 25.059 1.00 0.00 H
+ATOM 13962 1HG2 VAL L 29 0.410 88.394 27.202 1.00 0.00 H
+ATOM 13963 2HG2 VAL L 29 0.367 86.850 26.325 1.00 0.00 H
+ATOM 13964 3HG2 VAL L 29 0.427 86.861 28.075 1.00 0.00 H
+ATOM 13965 N ASN L 38 4.926 84.814 27.039 1.00 12.74 N
+ATOM 13966 CA ASN L 38 6.338 84.689 26.602 1.00 11.55 C
+ATOM 13967 C ASN L 38 6.975 86.094 26.469 1.00 11.40 C
+ATOM 13968 O ASN L 38 7.026 86.852 27.452 1.00 11.05 O
+ATOM 13969 CB ASN L 38 6.382 83.850 25.310 1.00 11.27 C
+ATOM 13970 CG ASN L 38 7.797 83.354 24.865 1.00 10.86 C
+ATOM 13971 OD1 ASN L 38 7.360 83.980 25.804 1.00 9.89 O
+ATOM 13972 ND2 ASN L 38 7.310 82.743 23.790 1.00 6.92 N
+ATOM 13973 H ASN L 38 4.547 84.111 27.675 1.00 0.00 H
+ATOM 13974 HA ASN L 38 6.885 84.170 27.385 1.00 0.00 H
+ATOM 13975 1HB ASN L 38 5.693 82.983 25.345 1.00 0.00 H
+ATOM 13976 2HB ASN L 38 5.977 84.484 24.542 1.00 0.00 H
+ATOM 13977 1HD2 ASN L 38 6.310 82.739 23.593 1.00 0.00 H
+ATOM 13978 2HD2 ASN L 38 7.954 82.242 23.171 1.00 0.00 H
+ATOM 13979 N THR L 39 7.417 86.471 25.256 1.00 11.08 N
+ATOM 13980 CA THR L 39 7.842 87.819 24.957 1.00 10.12 C
+ATOM 13981 C THR L 39 7.081 88.407 23.764 1.00 10.35 C
+ATOM 13982 O THR L 39 7.485 88.267 22.620 1.00 9.57 O
+ATOM 13983 CB THR L 39 9.342 87.860 24.668 1.00 10.26 C
+ATOM 13984 OG1 THR L 39 10.085 87.333 25.781 1.00 8.20 O
+ATOM 13985 CG2 THR L 39 9.699 89.062 23.862 1.00 10.15 C
+ATOM 13986 H THR L 39 7.374 85.788 24.504 1.00 0.00 H
+ATOM 13987 HA THR L 39 7.618 88.455 25.814 1.00 0.00 H
+ATOM 13988 HB THR L 39 9.798 88.670 25.234 1.00 0.00 H
+ATOM 13989 HG1 THR L 39 10.986 87.651 25.723 1.00 0.00 H
+ATOM 13990 1HG2 THR L 39 10.780 89.068 23.718 1.00 0.00 H
+ATOM 13991 2HG2 THR L 39 9.188 89.089 22.879 1.00 0.00 H
+ATOM 13992 3HG2 THR L 39 9.406 89.935 24.441 1.00 0.00 H
+ATOM 13993 N ALA L 40 5.972 89.079 24.039 1.00 11.20 N
+ATOM 13994 CA ALA L 40 5.177 89.637 22.954 1.00 12.51 C
+ATOM 13995 C ALA L 40 4.354 90.825 23.411 1.00 12.80 C
+ATOM 13996 O ALA L 40 3.140 90.883 23.164 1.00 13.07 O
+ATOM 13997 CB ALA L 40 4.277 88.549 22.374 1.00 11.99 C
+ATOM 13998 H ALA L 40 5.648 89.162 24.993 1.00 0.00 H
+ATOM 13999 HA ALA L 40 5.860 89.999 22.179 1.00 0.00 H
+ATOM 14000 1HB ALA L 40 3.701 88.955 21.543 1.00 0.00 H
+ATOM 14001 2HB ALA L 40 4.877 87.695 22.027 1.00 0.00 H
+ATOM 14002 3HB ALA L 40 3.601 88.197 23.136 1.00 0.00 H
+ATOM 14003 N VAL L 41 5.012 91.760 24.096 1.00 12.01 N
+ATOM 14004 CA VAL L 41 4.379 92.973 24.599 1.00 11.01 C
+ATOM 14005 C VAL L 41 5.039 94.254 24.086 1.00 11.03 C
+ATOM 14006 O VAL L 41 6.260 94.407 24.082 1.00 10.43 O
+ATOM 14007 CB VAL L 41 4.343 92.970 26.153 1.00 11.67 C
+ATOM 14008 CG1 VAL L 41 3.799 94.304 26.689 1.00 11.18 C
+ATOM 14009 CG2 VAL L 41 3.430 91.852 26.630 1.00 6.18 C
+ATOM 14010 H VAL L 41 5.996 91.623 24.260 1.00 0.00 H
+ATOM 14011 HA VAL L 41 3.359 92.970 24.255 1.00 0.00 H
+ATOM 14012 HB VAL L 41 5.346 92.841 26.543 1.00 0.00 H
+ATOM 14013 1HG1 VAL L 41 3.775 94.293 27.784 1.00 0.00 H
+ATOM 14014 2HG1 VAL L 41 4.441 95.122 26.364 1.00 0.00 H
+ATOM 14015 3HG1 VAL L 41 2.795 94.459 26.306 1.00 0.00 H
+ATOM 14016 1HG2 VAL L 41 3.397 91.862 27.705 1.00 0.00 H
+ATOM 14017 2HG2 VAL L 41 2.436 92.019 26.232 1.00 0.00 H
+ATOM 14018 3HG2 VAL L 41 3.801 90.890 26.290 1.00 0.00 H
+ATOM 14019 N ALA L 42 4.203 95.174 23.612 1.00 10.90 N
+ATOM 14020 CA ALA L 42 4.674 96.460 23.116 1.00 10.98 C
+ATOM 14021 C ALA L 42 4.261 97.555 24.089 1.00 11.44 C
+ATOM 14022 O ALA L 42 3.211 97.462 24.726 1.00 11.17 O
+ATOM 14023 CB ALA L 42 4.119 96.731 21.729 1.00 10.40 C
+ATOM 14024 H ALA L 42 3.212 94.968 23.624 1.00 0.00 H
+ATOM 14025 HA ALA L 42 5.759 96.438 23.075 1.00 0.00 H
+ATOM 14026 1HB ALA L 42 4.489 97.693 21.363 1.00 0.00 H
+ATOM 14027 2HB ALA L 42 4.436 95.943 21.050 1.00 0.00 H
+ATOM 14028 3HB ALA L 42 3.033 96.754 21.769 1.00 0.00 H
+ATOM 14029 N TRP L 43 5.073 98.605 24.182 1.00 12.16 N
+ATOM 14030 CA TRP L 43 4.710 99.744 25.025 1.00 13.08 C
+ATOM 14031 C TRP L 43 4.561 101.002 24.194 1.00 13.16 C
+ATOM 14032 O TRP L 43 5.387 101.255 23.314 1.00 14.74 O
+ATOM 14033 CB TRP L 43 5.747 99.979 26.116 1.00 12.69 C
+ATOM 14034 CG TRP L 43 5.802 98.890 27.141 1.00 12.90 C
+ATOM 14035 CD1 TRP L 43 6.562 97.758 27.104 1.00 14.54 C
+ATOM 14036 CD2 TRP L 43 5.070 98.845 28.390 1.00 13.72 C
+ATOM 14037 NE1 TRP L 43 6.357 97.014 28.244 1.00 14.49 N
+ATOM 14038 CE2 TRP L 43 5.450 97.671 29.045 1.00 14.40 C
+ATOM 14039 CE3 TRP L 43 4.146 99.709 29.007 1.00 13.68 C
+ATOM 14040 CZ2 TRP L 43 4.944 97.332 30.286 1.00 10.38 C
+ATOM 14041 CZ3 TRP L 43 3.652 99.374 30.256 1.00 10.94 C
+ATOM 14042 CH2 TRP L 43 4.044 98.215 30.881 1.00 11.82 C
+ATOM 14043 H TRP L 43 5.933 98.605 23.644 1.00 0.00 H
+ATOM 14044 HA TRP L 43 3.766 99.526 25.503 1.00 0.00 H
+ATOM 14045 1HB TRP L 43 6.723 100.108 25.681 1.00 0.00 H
+ATOM 14046 2HB TRP L 43 5.505 100.906 26.630 1.00 0.00 H
+ATOM 14047 HD1 TRP L 43 7.235 97.484 26.294 1.00 0.00 H
+ATOM 14048 HE1 TRP L 43 6.814 96.137 28.459 1.00 0.00 H
+ATOM 14049 HE3 TRP L 43 3.837 100.632 28.515 1.00 0.00 H
+ATOM 14050 HZ2 TRP L 43 5.238 96.424 30.796 1.00 0.00 H
+ATOM 14051 HZ3 TRP L 43 2.945 100.053 30.727 1.00 0.00 H
+ATOM 14052 HH2 TRP L 43 3.640 97.981 31.863 1.00 0.00 H
+ATOM 14053 N TYR L 44 3.550 101.809 24.531 1.00 13.10 N
+ATOM 14054 CA TYR L 44 3.239 103.049 23.819 1.00 13.31 C
+ATOM 14055 C TYR L 44 3.130 104.254 24.748 1.00 13.88 C
+ATOM 14056 O TYR L 44 2.810 104.106 25.930 1.00 14.98 O
+ATOM 14057 CB TYR L 44 1.910 102.886 23.087 1.00 13.24 C
+ATOM 14058 CG TYR L 44 1.918 101.718 22.174 1.00 12.48 C
+ATOM 14059 CD1 TYR L 44 1.593 100.481 22.671 1.00 11.84 C
+ATOM 14060 CD2 TYR L 44 2.265 101.860 20.858 1.00 12.56 C
+ATOM 14061 CE1 TYR L 44 1.628 99.402 21.851 1.00 10.55 C
+ATOM 14062 CE2 TYR L 44 2.296 100.781 20.034 1.00 14.30 C
+ATOM 14063 CZ TYR L 44 1.984 99.545 20.525 1.00 14.33 C
+ATOM 14064 OH TYR L 44 2.032 98.444 19.709 1.00 20.40 O
+ATOM 14065 H TYR L 44 2.935 101.505 25.280 1.00 0.00 H
+ATOM 14066 HA TYR L 44 4.034 103.252 23.105 1.00 0.00 H
+ATOM 14067 1HB TYR L 44 1.096 102.776 23.794 1.00 0.00 H
+ATOM 14068 2HB TYR L 44 1.714 103.776 22.499 1.00 0.00 H
+ATOM 14069 HD1 TYR L 44 1.319 100.363 23.719 1.00 0.00 H
+ATOM 14070 HD2 TYR L 44 2.526 102.833 20.471 1.00 0.00 H
+ATOM 14071 HE1 TYR L 44 1.392 98.443 22.244 1.00 0.00 H
+ATOM 14072 HE2 TYR L 44 2.583 100.910 18.992 1.00 0.00 H
+ATOM 14073 HH TYR L 44 2.361 98.725 18.866 1.00 0.00 H
+ATOM 14074 N GLN L 45 3.355 105.443 24.187 1.00 14.20 N
+ATOM 14075 CA GLN L 45 3.217 106.722 24.881 1.00 14.51 C
+ATOM 14076 C GLN L 45 2.206 107.633 24.167 1.00 14.94 C
+ATOM 14077 O GLN L 45 2.428 108.010 23.013 1.00 15.68 O
+ATOM 14078 CB GLN L 45 4.574 107.431 24.911 1.00 14.63 C
+ATOM 14079 CG GLN L 45 4.603 108.739 25.649 1.00 14.17 C
+ATOM 14080 CD GLN L 45 5.953 109.466 25.550 1.00 15.43 C
+ATOM 14081 OE1 GLN L 45 6.392 109.783 24.437 1.00 20.82 O
+ATOM 14082 NE2 GLN L 45 6.606 109.738 26.675 1.00 13.42 N
+ATOM 14083 H GLN L 45 3.633 105.457 23.210 1.00 0.00 H
+ATOM 14084 HA GLN L 45 2.861 106.540 25.896 1.00 0.00 H
+ATOM 14085 1HB GLN L 45 5.283 106.793 25.381 1.00 0.00 H
+ATOM 14086 2HB GLN L 45 4.918 107.601 23.889 1.00 0.00 H
+ATOM 14087 1HG GLN L 45 3.830 109.393 25.240 1.00 0.00 H
+ATOM 14088 2HG GLN L 45 4.404 108.532 26.686 1.00 0.00 H
+ATOM 14089 1HE2 GLN L 45 7.484 110.230 26.637 1.00 0.00 H
+ATOM 14090 2HE2 GLN L 45 6.243 109.460 27.570 1.00 0.00 H
+ATOM 14091 N GLN L 46 1.127 108.020 24.853 1.00 16.14 N
+ATOM 14092 CA GLN L 46 0.116 108.886 24.246 1.00 17.45 C
+ATOM 14093 C GLN L 46 0.036 110.242 24.934 1.00 18.36 C
+ATOM 14094 O GLN L 46 -0.149 110.329 26.147 1.00 18.26 O
+ATOM 14095 CB GLN L 46 -1.270 108.248 24.312 1.00 17.18 C
+ATOM 14096 CG GLN L 46 -2.308 109.074 23.616 1.00 18.33 C
+ATOM 14097 CD GLN L 46 -3.685 108.471 23.630 1.00 20.85 C
+ATOM 14098 OE1 GLN L 46 -4.118 107.816 24.590 1.00 23.84 O
+ATOM 14099 NE2 GLN L 46 -4.397 108.692 22.549 1.00 19.00 N
+ATOM 14100 H GLN L 46 0.980 107.680 25.798 1.00 0.00 H
+ATOM 14101 HA GLN L 46 0.377 109.057 23.201 1.00 0.00 H
+ATOM 14102 1HB GLN L 46 -1.254 107.249 23.876 1.00 0.00 H
+ATOM 14103 2HB GLN L 46 -1.568 108.147 25.353 1.00 0.00 H
+ATOM 14104 1HG GLN L 46 -2.361 110.056 24.078 1.00 0.00 H
+ATOM 14105 2HG GLN L 46 -1.998 109.173 22.579 1.00 0.00 H
+ATOM 14106 1HE2 GLN L 46 -5.337 108.327 22.489 1.00 0.00 H
+ATOM 14107 2HE2 GLN L 46 -3.995 109.255 21.796 1.00 0.00 H
+ATOM 14108 N LYS L 47 0.139 111.313 24.172 1.00 20.48 N
+ATOM 14109 CA LYS L 47 0.056 112.639 24.762 1.00 21.33 C
+ATOM 14110 C LYS L 47 -1.297 113.213 24.400 1.00 21.91 C
+ATOM 14111 O LYS L 47 -1.884 112.749 23.415 1.00 22.15 O
+ATOM 14112 CB LYS L 47 1.214 113.500 24.271 1.00 20.96 C
+ATOM 14113 CG LYS L 47 2.552 112.937 24.714 1.00 21.61 C
+ATOM 14114 CD LYS L 47 3.726 113.744 24.250 1.00 23.98 C
+ATOM 14115 CE LYS L 47 5.013 113.054 24.682 1.00 26.11 C
+ATOM 14116 NZ LYS L 47 6.217 113.817 24.300 1.00 28.30 N
+ATOM 14117 H LYS L 47 0.287 111.212 23.172 1.00 0.00 H
+ATOM 14118 HA LYS L 47 0.145 112.537 25.850 1.00 0.00 H
+ATOM 14119 1HB LYS L 47 1.207 113.552 23.183 1.00 0.00 H
+ATOM 14120 2HB LYS L 47 1.133 114.513 24.655 1.00 0.00 H
+ATOM 14121 1HG LYS L 47 2.566 112.921 25.811 1.00 0.00 H
+ATOM 14122 2HG LYS L 47 2.649 111.909 24.354 1.00 0.00 H
+ATOM 14123 1HD LYS L 47 3.715 113.829 23.162 1.00 0.00 H
+ATOM 14124 2HD LYS L 47 3.694 114.741 24.683 1.00 0.00 H
+ATOM 14125 1HE LYS L 47 5.004 112.921 25.760 1.00 0.00 H
+ATOM 14126 2HE LYS L 47 5.063 112.077 24.206 1.00 0.00 H
+ATOM 14127 1HZ LYS L 47 7.044 113.311 24.605 1.00 0.00 H
+ATOM 14128 2HZ LYS L 47 6.245 113.932 23.302 1.00 0.00 H
+ATOM 14129 3HZ LYS L 47 6.193 114.722 24.745 1.00 0.00 H
+ATOM 14130 N PRO L 48 -1.893 114.118 25.181 1.00 24.06 N
+ATOM 14131 CA PRO L 48 -3.160 114.731 24.883 1.00 24.16 C
+ATOM 14132 C PRO L 48 -3.277 115.168 23.431 1.00 24.49 C
+ATOM 14133 O PRO L 48 -2.402 115.950 22.947 1.00 23.88 O
+ATOM 14134 CB PRO L 48 -3.235 115.871 25.888 1.00 24.19 C
+ATOM 14135 CG PRO L 48 -2.375 115.401 27.074 1.00 23.65 C
+ATOM 14136 CD PRO L 48 -1.241 114.605 26.443 1.00 24.61 C
+ATOM 14137 HA PRO L 48 -3.963 113.962 25.105 1.00 0.00 H
+ATOM 14138 1HB PRO L 48 -2.835 116.798 25.414 1.00 0.00 H
+ATOM 14139 2HB PRO L 48 -4.271 116.083 26.165 1.00 0.00 H
+ATOM 14140 1HG PRO L 48 -2.000 116.276 27.639 1.00 0.00 H
+ATOM 14141 2HG PRO L 48 -2.987 114.817 27.792 1.00 0.00 H
+ATOM 14142 1HD PRO L 48 -0.376 115.241 26.268 1.00 0.00 H
+ATOM 14143 2HD PRO L 48 -1.014 113.758 27.117 1.00 0.00 H
+ATOM 14144 N GLY L 49 -4.298 114.733 22.725 1.00 24.84 N
+ATOM 14145 CA GLY L 49 -4.563 115.079 21.331 1.00 24.34 C
+ATOM 14146 C GLY L 49 -3.702 114.317 20.313 1.00 23.86 C
+ATOM 14147 O GLY L 49 -3.828 114.538 19.111 1.00 24.12 O
+ATOM 14148 H GLY L 49 -4.951 114.096 23.192 1.00 0.00 H
+ATOM 14149 1HA GLY L 49 -5.613 114.898 21.114 1.00 0.00 H
+ATOM 14150 2HA GLY L 49 -4.396 116.151 21.198 1.00 0.00 H
+ATOM 14151 N LYS L 50 -2.819 113.435 20.795 1.00 22.51 N
+ATOM 14152 CA LYS L 50 -1.903 112.699 19.924 1.00 21.94 C
+ATOM 14153 C LYS L 50 -2.170 111.196 19.900 1.00 21.28 C
+ATOM 14154 O LYS L 50 -2.845 110.647 20.775 1.00 21.91 O
+ATOM 14155 CB LYS L 50 -0.455 112.951 20.362 1.00 22.59 C
+ATOM 14156 CG LYS L 50 -0.063 114.444 20.396 1.00 22.31 C
+ATOM 14157 CD LYS L 50 -0.048 115.097 19.004 1.00 24.04 C
+ATOM 14158 CE LYS L 50 0.405 116.570 19.090 1.00 27.78 C
+ATOM 14159 NZ LYS L 50 -0.601 117.419 19.808 1.00 27.68 N
+ATOM 14160 H LYS L 50 -2.752 113.286 21.795 1.00 0.00 H
+ATOM 14161 HA LYS L 50 -2.027 113.064 18.907 1.00 0.00 H
+ATOM 14162 1HB LYS L 50 -0.312 112.552 21.359 1.00 0.00 H
+ATOM 14163 2HB LYS L 50 0.234 112.411 19.698 1.00 0.00 H
+ATOM 14164 1HG LYS L 50 -0.777 114.971 21.027 1.00 0.00 H
+ATOM 14165 2HG LYS L 50 0.929 114.544 20.835 1.00 0.00 H
+ATOM 14166 1HD LYS L 50 0.642 114.558 18.345 1.00 0.00 H
+ATOM 14167 2HD LYS L 50 -1.047 115.057 18.569 1.00 0.00 H
+ATOM 14168 1HE LYS L 50 1.356 116.626 19.624 1.00 0.00 H
+ATOM 14169 2HE LYS L 50 0.543 116.966 18.083 1.00 0.00 H
+ATOM 14170 1HZ LYS L 50 -0.279 118.374 19.850 1.00 0.00 H
+ATOM 14171 2HZ LYS L 50 -1.482 117.384 19.315 1.00 0.00 H
+ATOM 14172 3HZ LYS L 50 -0.734 117.069 20.753 1.00 0.00 H
+ATOM 14173 N ALA L 51 -1.625 110.551 18.875 1.00 19.84 N
+ATOM 14174 CA ALA L 51 -1.689 109.092 18.763 1.00 18.44 C
+ATOM 14175 C ALA L 51 -0.767 108.432 19.811 1.00 17.65 C
+ATOM 14176 O ALA L 51 0.256 109.039 20.204 1.00 17.88 O
+ATOM 14177 CB ALA L 51 -1.326 108.661 17.380 1.00 18.21 C
+ATOM 14178 H ALA L 51 -1.135 111.063 18.177 1.00 0.00 H
+ATOM 14179 HA ALA L 51 -2.733 108.833 18.960 1.00 0.00 H
+ATOM 14180 1HB ALA L 51 -1.410 107.593 17.340 1.00 0.00 H
+ATOM 14181 2HB ALA L 51 -2.001 109.126 16.667 1.00 0.00 H
+ATOM 14182 3HB ALA L 51 -0.300 108.957 17.167 1.00 0.00 H
+ATOM 14183 N PRO L 52 -1.007 107.194 20.227 1.00 17.37 N
+ATOM 14184 CA PRO L 52 -0.184 106.365 21.068 1.00 16.08 C
+ATOM 14185 C PRO L 52 1.094 105.895 20.437 1.00 15.22 C
+ATOM 14186 O PRO L 52 1.194 104.720 20.030 1.00 13.86 O
+ATOM 14187 CB PRO L 52 -1.059 105.181 21.372 1.00 15.85 C
+ATOM 14188 CG PRO L 52 -2.467 105.621 21.049 1.00 17.69 C
+ATOM 14189 CD PRO L 52 -2.365 106.639 20.003 1.00 17.54 C
+ATOM 14190 HA PRO L 52 0.069 106.945 22.014 1.00 0.00 H
+ATOM 14191 1HB PRO L 52 -0.769 104.338 20.736 1.00 0.00 H
+ATOM 14192 2HB PRO L 52 -0.922 104.870 22.405 1.00 0.00 H
+ATOM 14193 1HG PRO L 52 -3.085 104.768 20.764 1.00 0.00 H
+ATOM 14194 2HG PRO L 52 -2.964 106.064 21.958 1.00 0.00 H
+ATOM 14195 1HD PRO L 52 -2.433 106.171 18.993 1.00 0.00 H
+ATOM 14196 2HD PRO L 52 -3.184 107.311 20.194 1.00 0.00 H
+ATOM 14197 N LYS L 53 2.080 106.740 20.284 1.00 14.49 N
+ATOM 14198 CA LYS L 53 3.352 106.404 19.618 1.00 14.80 C
+ATOM 14199 C LYS L 53 4.119 105.258 20.317 1.00 14.43 C
+ATOM 14200 O LYS L 53 4.173 105.163 21.528 1.00 14.74 O
+ATOM 14201 CB LYS L 53 4.236 107.617 19.512 1.00 14.29 C
+ATOM 14202 CG LYS L 53 3.715 108.725 18.586 1.00 17.03 C
+ATOM 14203 CD LYS L 53 4.736 109.881 18.479 1.00 20.61 C
+ATOM 14204 CE LYS L 53 4.265 111.011 17.550 1.00 21.40 C
+ATOM 14205 NZ LYS L 53 5.233 112.160 17.527 1.00 26.38 N
+ATOM 14206 H LYS L 53 1.924 107.705 20.629 1.00 0.00 H
+ATOM 14207 HA LYS L 53 3.103 106.047 18.611 1.00 0.00 H
+ATOM 14208 1HB LYS L 53 4.374 108.047 20.520 1.00 0.00 H
+ATOM 14209 2HB LYS L 53 5.220 107.317 19.155 1.00 0.00 H
+ATOM 14210 1HG LYS L 53 3.525 108.308 17.596 1.00 0.00 H
+ATOM 14211 2HG LYS L 53 2.772 109.118 18.987 1.00 0.00 H
+ATOM 14212 1HD LYS L 53 4.922 110.303 19.468 1.00 0.00 H
+ATOM 14213 2HD LYS L 53 5.679 109.487 18.088 1.00 0.00 H
+ATOM 14214 1HE LYS L 53 4.158 110.624 16.534 1.00 0.00 H
+ATOM 14215 2HE LYS L 53 3.290 111.376 17.886 1.00 0.00 H
+ATOM 14216 1HZ LYS L 53 4.894 112.883 16.907 1.00 0.00 H
+ATOM 14217 2HZ LYS L 53 5.327 112.539 18.458 1.00 0.00 H
+ATOM 14218 3HZ LYS L 53 6.135 111.842 17.202 1.00 0.00 H
+ATOM 14219 N LEU L 54 4.730 104.387 19.503 1.00 12.88 N
+ATOM 14220 CA LEU L 54 5.502 103.255 19.999 1.00 13.00 C
+ATOM 14221 C LEU L 54 6.805 103.603 20.734 1.00 13.48 C
+ATOM 14222 O LEU L 54 7.596 104.407 20.243 1.00 15.14 O
+ATOM 14223 CB LEU L 54 5.818 102.307 18.831 1.00 12.53 C
+ATOM 14224 CG LEU L 54 6.600 101.041 19.179 1.00 12.58 C
+ATOM 14225 CD1 LEU L 54 5.774 100.160 20.074 1.00 12.97 C
+ATOM 14226 CD2 LEU L 54 6.936 100.310 17.921 1.00 6.79 C
+ATOM 14227 H LEU L 54 4.653 104.521 18.510 1.00 0.00 H
+ATOM 14228 HA LEU L 54 4.884 102.708 20.703 1.00 0.00 H
+ATOM 14229 1HB LEU L 54 4.874 101.993 18.390 1.00 0.00 H
+ATOM 14230 2HB LEU L 54 6.381 102.855 18.077 1.00 0.00 H
+ATOM 14231 HG LEU L 54 7.511 101.311 19.706 1.00 0.00 H
+ATOM 14232 1HD1 LEU L 54 6.341 99.265 20.323 1.00 0.00 H
+ATOM 14233 2HD1 LEU L 54 5.523 100.690 20.977 1.00 0.00 H
+ATOM 14234 3HD1 LEU L 54 4.868 99.884 19.557 1.00 0.00 H
+ATOM 14235 1HD2 LEU L 54 7.491 99.419 18.180 1.00 0.00 H
+ATOM 14236 2HD2 LEU L 54 6.019 100.034 17.399 1.00 0.00 H
+ATOM 14237 3HD2 LEU L 54 7.532 100.946 17.281 1.00 0.00 H
+ATOM 14238 N LEU L 55 6.988 102.994 21.904 1.00 13.35 N
+ATOM 14239 CA LEU L 55 8.214 103.133 22.696 1.00 11.83 C
+ATOM 14240 C LEU L 55 9.107 101.897 22.622 1.00 12.20 C
+ATOM 14241 O LEU L 55 10.306 102.002 22.344 1.00 12.42 O
+ATOM 14242 CB LEU L 55 7.886 103.305 24.182 1.00 11.86 C
+ATOM 14243 CG LEU L 55 7.165 104.527 24.602 1.00 10.61 C
+ATOM 14244 CD1 LEU L 55 6.878 104.383 26.079 1.00 9.68 C
+ATOM 14245 CD2 LEU L 55 8.035 105.752 24.309 1.00 8.81 C
+ATOM 14246 H LEU L 55 6.264 102.390 22.259 1.00 0.00 H
+ATOM 14247 HA LEU L 55 8.750 103.998 22.346 1.00 0.00 H
+ATOM 14248 1HB LEU L 55 7.290 102.458 24.509 1.00 0.00 H
+ATOM 14249 2HB LEU L 55 8.822 103.285 24.735 1.00 0.00 H
+ATOM 14250 HG LEU L 55 6.217 104.616 24.066 1.00 0.00 H
+ATOM 14251 1HD1 LEU L 55 6.360 105.243 26.435 1.00 0.00 H
+ATOM 14252 2HD1 LEU L 55 6.264 103.498 26.246 1.00 0.00 H
+ATOM 14253 3HD1 LEU L 55 7.809 104.274 26.614 1.00 0.00 H
+ATOM 14254 1HD2 LEU L 55 7.533 106.661 24.627 1.00 0.00 H
+ATOM 14255 2HD2 LEU L 55 8.979 105.660 24.841 1.00 0.00 H
+ATOM 14256 3HD2 LEU L 55 8.230 105.805 23.235 1.00 0.00 H
+ATOM 14257 N ILE L 56 8.524 100.747 22.968 1.00 11.99 N
+ATOM 14258 CA ILE L 56 9.264 99.487 23.103 1.00 11.49 C
+ATOM 14259 C ILE L 56 8.579 98.325 22.400 1.00 11.51 C
+ATOM 14260 O ILE L 56 7.366 98.149 22.523 1.00 12.40 O
+ATOM 14261 CB ILE L 56 9.495 99.126 24.591 1.00 11.80 C
+ATOM 14262 CG1 ILE L 56 10.285 100.223 25.275 1.00 13.59 C
+ATOM 14263 CG2 ILE L 56 10.222 97.793 24.754 1.00 8.66 C
+ATOM 14264 CD1 ILE L 56 10.420 100.003 26.714 1.00 24.37 C
+ATOM 14265 H ILE L 56 7.523 100.759 23.147 1.00 0.00 H
+ATOM 14266 HA ILE L 56 10.238 99.619 22.641 1.00 0.00 H
+ATOM 14267 HB ILE L 56 8.548 99.055 25.083 1.00 0.00 H
+ATOM 14268 1HG1 ILE L 56 11.279 100.288 24.829 1.00 0.00 H
+ATOM 14269 2HG1 ILE L 56 9.784 101.163 25.143 1.00 0.00 H
+ATOM 14270 1HG2 ILE L 56 10.354 97.580 25.814 1.00 0.00 H
+ATOM 14271 2HG2 ILE L 56 9.649 96.991 24.299 1.00 0.00 H
+ATOM 14272 3HG2 ILE L 56 11.189 97.862 24.282 1.00 0.00 H
+ATOM 14273 1HD1 ILE L 56 10.985 100.823 27.156 1.00 0.00 H
+ATOM 14274 2HD1 ILE L 56 9.445 99.944 27.166 1.00 0.00 H
+ATOM 14275 3HD1 ILE L 56 10.938 99.073 26.868 1.00 0.00 H
+ATOM 14276 N TYR L 57 9.350 97.518 21.683 1.00 11.23 N
+ATOM 14277 CA TYR L 57 8.771 96.352 21.025 1.00 10.97 C
+ATOM 14278 C TYR L 57 9.369 95.046 21.572 1.00 10.52 C
+ATOM 14279 O TYR L 57 10.434 95.041 22.208 1.00 10.79 O
+ATOM 14280 CB TYR L 57 8.911 96.494 19.502 1.00 11.62 C
+ATOM 14281 CG TYR L 57 10.319 96.506 18.941 1.00 11.05 C
+ATOM 14282 CD1 TYR L 57 10.903 95.324 18.508 1.00 10.59 C
+ATOM 14283 CD2 TYR L 57 11.023 97.707 18.843 1.00 12.67 C
+ATOM 14284 CE1 TYR L 57 12.175 95.334 17.966 1.00 12.90 C
+ATOM 14285 CE2 TYR L 57 12.303 97.714 18.307 1.00 13.53 C
+ATOM 14286 CZ TYR L 57 12.874 96.536 17.863 1.00 13.92 C
+ATOM 14287 OH TYR L 57 14.138 96.550 17.316 1.00 18.24 O
+ATOM 14288 H TYR L 57 10.347 97.712 21.615 1.00 0.00 H
+ATOM 14289 HA TYR L 57 7.702 96.327 21.252 1.00 0.00 H
+ATOM 14290 1HB TYR L 57 8.372 95.682 19.012 1.00 0.00 H
+ATOM 14291 2HB TYR L 57 8.434 97.419 19.199 1.00 0.00 H
+ATOM 14292 HD1 TYR L 57 10.354 94.390 18.582 1.00 0.00 H
+ATOM 14293 HD2 TYR L 57 10.570 98.638 19.183 1.00 0.00 H
+ATOM 14294 HE1 TYR L 57 12.625 94.404 17.618 1.00 0.00 H
+ATOM 14295 HE2 TYR L 57 12.859 98.642 18.222 1.00 0.00 H
+ATOM 14296 HH TYR L 57 14.499 97.439 17.368 1.00 0.00 H
+ATOM 14297 N SER L 58 8.631 93.944 21.377 1.00 10.49 N
+ATOM 14298 CA SER L 58 9.050 92.609 21.826 1.00 10.76 C
+ATOM 14299 C SER L 58 9.513 92.601 23.293 1.00 11.66 C
+ATOM 14300 O SER L 58 10.512 91.973 23.638 1.00 11.47 O
+ATOM 14301 CB SER L 58 10.135 92.076 20.919 1.00 10.45 C
+ATOM 14302 OG SER L 58 9.660 91.900 19.612 1.00 11.94 O
+ATOM 14303 H SER L 58 7.757 94.030 20.879 1.00 0.00 H
+ATOM 14304 HA SER L 58 8.187 91.938 21.734 1.00 0.00 H
+ATOM 14305 1HB SER L 58 10.943 92.778 20.901 1.00 0.00 H
+ATOM 14306 2HB SER L 58 10.521 91.137 21.312 1.00 0.00 H
+ATOM 14307 HG SER L 58 9.408 92.767 19.299 1.00 0.00 H
+ATOM 14308 N ALA L 59 8.799 93.349 24.134 1.00 11.86 N
+ATOM 14309 CA ALA L 59 8.978 93.533 25.579 1.00 13.04 C
+ATOM 14310 C ALA L 59 10.371 93.997 26.042 1.00 14.02 C
+ATOM 14311 O ALA L 59 10.591 94.103 27.249 1.00 14.26 O
+ATOM 14312 CB ALA L 59 8.654 92.233 26.298 1.00 11.95 C
+ATOM 14313 H ALA L 59 7.998 93.825 23.742 1.00 0.00 H
+ATOM 14314 HA ALA L 59 8.262 94.298 25.889 1.00 0.00 H
+ATOM 14315 1HB ALA L 59 8.719 92.395 27.403 1.00 0.00 H
+ATOM 14316 2HB ALA L 59 7.657 91.919 26.031 1.00 0.00 H
+ATOM 14317 3HB ALA L 59 9.368 91.455 25.993 1.00 0.00 H
+ATOM 14318 N SER L 60 11.307 94.303 25.142 1.00 15.05 N
+ATOM 14319 CA SER L 60 12.609 94.769 25.626 1.00 15.20 C
+ATOM 14320 C SER L 60 13.432 95.613 24.652 1.00 15.40 C
+ATOM 14321 O SER L 60 14.540 96.026 24.981 1.00 15.87 O
+ATOM 14322 CB SER L 60 13.453 93.591 26.068 1.00 15.73 C
+ATOM 14323 OG SER L 60 13.733 92.746 24.994 1.00 15.37 O
+ATOM 14324 H SER L 60 11.109 94.220 24.146 1.00 0.00 H
+ATOM 14325 HA SER L 60 12.425 95.387 26.508 1.00 0.00 H
+ATOM 14326 1HB SER L 60 14.385 93.956 26.498 1.00 0.00 H
+ATOM 14327 2HB SER L 60 12.927 93.038 26.853 1.00 0.00 H
+ATOM 14328 HG SER L 60 14.011 93.328 24.279 1.00 0.00 H
+ATOM 14329 N PHE L 69 12.923 95.848 23.443 1.00 15.42 N
+ATOM 14330 CA PHE L 69 13.721 96.543 22.443 1.00 15.40 C
+ATOM 14331 C PHE L 69 13.263 97.974 22.246 1.00 15.62 C
+ATOM 14332 O PHE L 69 12.108 98.257 21.965 1.00 15.85 O
+ATOM 14333 CB PHE L 69 13.648 95.800 21.130 1.00 15.57 C
+ATOM 14334 CG PHE L 69 14.320 94.481 21.163 1.00 14.78 C
+ATOM 14335 CD1 PHE L 69 13.650 93.383 21.650 1.00 13.96 C
+ATOM 14336 CD2 PHE L 69 15.615 94.323 20.702 1.00 15.75 C
+ATOM 14337 CE1 PHE L 69 14.249 92.143 21.682 1.00 15.01 C
+ATOM 14338 CE2 PHE L 69 16.226 93.082 20.732 1.00 16.86 C
+ATOM 14339 CZ PHE L 69 15.538 91.989 21.223 1.00 16.73 C
+ATOM 14340 H PHE L 69 11.999 95.528 23.187 1.00 0.00 H
+ATOM 14341 HA PHE L 69 14.755 96.557 22.769 1.00 0.00 H
+ATOM 14342 1HB PHE L 69 12.611 95.644 20.865 1.00 0.00 H
+ATOM 14343 2HB PHE L 69 14.114 96.402 20.358 1.00 0.00 H
+ATOM 14344 HD1 PHE L 69 12.635 93.509 22.020 1.00 0.00 H
+ATOM 14345 HD2 PHE L 69 16.151 95.191 20.313 1.00 0.00 H
+ATOM 14346 HE1 PHE L 69 13.697 91.285 22.075 1.00 0.00 H
+ATOM 14347 HE2 PHE L 69 17.246 92.967 20.367 1.00 0.00 H
+ATOM 14348 HZ PHE L 69 16.016 91.009 21.249 1.00 0.00 H
+ATOM 14349 N LEU L 70 14.211 98.889 22.428 1.00 15.63 N
+ATOM 14350 CA LEU L 70 13.877 100.305 22.378 1.00 15.69 C
+ATOM 14351 C LEU L 70 13.645 100.700 20.911 1.00 16.47 C
+ATOM 14352 O LEU L 70 14.484 100.472 20.057 1.00 17.70 O
+ATOM 14353 CB LEU L 70 15.066 101.074 22.991 1.00 15.01 C
+ATOM 14354 CG LEU L 70 14.796 102.484 23.453 1.00 14.24 C
+ATOM 14355 CD1 LEU L 70 15.813 102.852 24.498 1.00 11.60 C
+ATOM 14356 CD2 LEU L 70 14.885 103.428 22.337 1.00 12.13 C
+ATOM 14357 H LEU L 70 15.147 98.594 22.642 1.00 0.00 H
+ATOM 14358 HA LEU L 70 12.983 100.493 22.957 1.00 0.00 H
+ATOM 14359 1HB LEU L 70 15.437 100.516 23.848 1.00 0.00 H
+ATOM 14360 2HB LEU L 70 15.859 101.127 22.247 1.00 0.00 H
+ATOM 14361 HG LEU L 70 13.799 102.534 23.907 1.00 0.00 H
+ATOM 14362 1HD1 LEU L 70 15.590 103.851 24.850 1.00 0.00 H
+ATOM 14363 2HD1 LEU L 70 15.761 102.155 25.327 1.00 0.00 H
+ATOM 14364 3HD1 LEU L 70 16.812 102.813 24.063 1.00 0.00 H
+ATOM 14365 1HD2 LEU L 70 14.686 104.422 22.720 1.00 0.00 H
+ATOM 14366 2HD2 LEU L 70 15.880 103.397 21.896 1.00 0.00 H
+ATOM 14367 3HD2 LEU L 70 14.155 103.165 21.585 1.00 0.00 H
+ATOM 14368 N TYR L 71 12.448 101.235 20.633 1.00 16.76 N
+ATOM 14369 CA TYR L 71 12.078 101.602 19.261 1.00 17.08 C
+ATOM 14370 C TYR L 71 12.886 102.786 18.724 1.00 16.95 C
+ATOM 14371 O TYR L 71 13.149 103.755 19.428 1.00 17.66 O
+ATOM 14372 CB TYR L 71 10.574 101.847 19.168 1.00 17.09 C
+ATOM 14373 CG TYR L 71 10.154 102.212 17.806 1.00 19.18 C
+ATOM 14374 CD1 TYR L 71 10.310 101.299 16.782 1.00 17.02 C
+ATOM 14375 CD2 TYR L 71 9.598 103.444 17.566 1.00 18.64 C
+ATOM 14376 CE1 TYR L 71 9.924 101.631 15.508 1.00 14.97 C
+ATOM 14377 CE2 TYR L 71 9.208 103.781 16.296 1.00 15.78 C
+ATOM 14378 CZ TYR L 71 9.374 102.883 15.266 1.00 14.29 C
+ATOM 14379 OH TYR L 71 8.995 103.226 13.993 1.00 15.79 O
+ATOM 14380 H TYR L 71 11.772 101.394 21.369 1.00 0.00 H
+ATOM 14381 HA TYR L 71 12.299 100.756 18.621 1.00 0.00 H
+ATOM 14382 1HB TYR L 71 10.032 100.952 19.466 1.00 0.00 H
+ATOM 14383 2HB TYR L 71 10.283 102.645 19.833 1.00 0.00 H
+ATOM 14384 HD1 TYR L 71 10.747 100.324 16.989 1.00 0.00 H
+ATOM 14385 HD2 TYR L 71 9.473 104.154 18.383 1.00 0.00 H
+ATOM 14386 HE1 TYR L 71 10.055 100.915 14.697 1.00 0.00 H
+ATOM 14387 HE2 TYR L 71 8.775 104.761 16.104 1.00 0.00 H
+ATOM 14388 HH TYR L 71 8.565 104.086 14.010 1.00 0.00 H
+ATOM 14389 N SER L 72 13.306 102.694 17.459 1.00 17.35 N
+ATOM 14390 CA SER L 72 14.099 103.764 16.876 1.00 17.59 C
+ATOM 14391 C SER L 72 13.404 105.119 17.000 1.00 17.83 C
+ATOM 14392 O SER L 72 12.208 105.241 16.758 1.00 18.37 O
+ATOM 14393 CB SER L 72 14.350 103.476 15.401 1.00 17.33 C
+ATOM 14394 OG SER L 72 15.081 104.519 14.807 1.00 19.39 O
+ATOM 14395 H SER L 72 13.076 101.883 16.916 1.00 0.00 H
+ATOM 14396 HA SER L 72 15.054 103.816 17.396 1.00 0.00 H
+ATOM 14397 1HB SER L 72 14.889 102.539 15.294 1.00 0.00 H
+ATOM 14398 2HB SER L 72 13.394 103.370 14.893 1.00 0.00 H
+ATOM 14399 HG SER L 72 15.922 104.550 15.265 1.00 0.00 H
+ATOM 14400 N GLY L 73 14.176 106.138 17.379 1.00 18.09 N
+ATOM 14401 CA GLY L 73 13.673 107.503 17.528 1.00 18.26 C
+ATOM 14402 C GLY L 73 13.234 107.822 18.958 1.00 19.02 C
+ATOM 14403 O GLY L 73 13.011 108.977 19.310 1.00 19.85 O
+ATOM 14404 H GLY L 73 15.151 105.958 17.571 1.00 0.00 H
+ATOM 14405 1HA GLY L 73 14.448 108.205 17.225 1.00 0.00 H
+ATOM 14406 2HA GLY L 73 12.830 107.654 16.850 1.00 0.00 H
+ATOM 14407 N VAL L 74 13.138 106.784 19.785 1.00 18.95 N
+ATOM 14408 CA VAL L 74 12.738 106.914 21.174 1.00 18.48 C
+ATOM 14409 C VAL L 74 14.007 107.143 22.021 1.00 18.19 C
+ATOM 14410 O VAL L 74 15.048 106.603 21.697 1.00 18.80 O
+ATOM 14411 CB VAL L 74 11.989 105.645 21.611 1.00 18.70 C
+ATOM 14412 CG1 VAL L 74 11.610 105.679 23.087 1.00 18.71 C
+ATOM 14413 CG2 VAL L 74 10.787 105.506 20.733 1.00 16.77 C
+ATOM 14414 H VAL L 74 13.319 105.847 19.430 1.00 0.00 H
+ATOM 14415 HA VAL L 74 12.041 107.726 21.247 1.00 0.00 H
+ATOM 14416 HB VAL L 74 12.617 104.799 21.474 1.00 0.00 H
+ATOM 14417 1HG1 VAL L 74 11.089 104.759 23.344 1.00 0.00 H
+ATOM 14418 2HG1 VAL L 74 12.509 105.768 23.696 1.00 0.00 H
+ATOM 14419 3HG1 VAL L 74 10.957 106.525 23.268 1.00 0.00 H
+ATOM 14420 1HG2 VAL L 74 10.264 104.610 20.985 1.00 0.00 H
+ATOM 14421 2HG2 VAL L 74 10.131 106.362 20.871 1.00 0.00 H
+ATOM 14422 3HG2 VAL L 74 11.108 105.454 19.693 1.00 0.00 H
+ATOM 14423 N PRO L 75 13.976 108.084 22.998 1.00 17.82 N
+ATOM 14424 CA PRO L 75 15.083 108.376 23.905 1.00 17.87 C
+ATOM 14425 C PRO L 75 15.522 107.147 24.706 1.00 17.94 C
+ATOM 14426 O PRO L 75 14.730 106.299 25.085 1.00 18.15 O
+ATOM 14427 CB PRO L 75 14.437 109.419 24.833 1.00 18.23 C
+ATOM 14428 CG PRO L 75 13.404 110.094 23.983 1.00 17.31 C
+ATOM 14429 CD PRO L 75 12.841 109.018 23.107 1.00 17.59 C
+ATOM 14430 HA PRO L 75 15.901 108.791 23.352 1.00 0.00 H
+ATOM 14431 1HB PRO L 75 14.019 108.956 25.703 1.00 0.00 H
+ATOM 14432 2HB PRO L 75 15.231 110.117 25.169 1.00 0.00 H
+ATOM 14433 1HG PRO L 75 12.628 110.541 24.631 1.00 0.00 H
+ATOM 14434 2HG PRO L 75 13.849 110.914 23.411 1.00 0.00 H
+ATOM 14435 1HD PRO L 75 11.957 108.552 23.551 1.00 0.00 H
+ATOM 14436 2HD PRO L 75 12.637 109.496 22.132 1.00 0.00 H
+ATOM 14437 N SER L 76 16.833 107.119 24.998 1.00 18.85 N
+ATOM 14438 CA SER L 76 17.501 106.013 25.681 1.00 19.52 C
+ATOM 14439 C SER L 76 16.959 105.691 27.067 1.00 18.82 C
+ATOM 14440 O SER L 76 17.188 104.606 27.603 1.00 20.05 O
+ATOM 14441 CB SER L 76 18.993 106.274 25.784 1.00 19.47 C
+ATOM 14442 OG SER L 76 19.265 107.365 26.628 1.00 23.18 O
+ATOM 14443 H SER L 76 17.417 107.885 24.668 1.00 0.00 H
+ATOM 14444 HA SER L 76 17.379 105.124 25.061 1.00 0.00 H
+ATOM 14445 1HB SER L 76 19.489 105.386 26.170 1.00 0.00 H
+ATOM 14446 2HB SER L 76 19.403 106.474 24.798 1.00 0.00 H
+ATOM 14447 HG SER L 76 18.993 108.145 26.149 1.00 0.00 H
+ATOM 14448 N ARG L 77 16.249 106.641 27.688 1.00 18.20 N
+ATOM 14449 CA ARG L 77 15.673 106.453 29.009 1.00 17.94 C
+ATOM 14450 C ARG L 77 14.536 105.427 29.060 1.00 17.66 C
+ATOM 14451 O ARG L 77 14.154 104.986 30.147 1.00 18.93 O
+ATOM 14452 CB ARG L 77 15.213 107.773 29.595 1.00 18.64 C
+ATOM 14453 CG ARG L 77 14.084 108.447 28.890 1.00 19.53 C
+ATOM 14454 CD ARG L 77 13.785 109.767 29.516 1.00 20.54 C
+ATOM 14455 NE ARG L 77 12.744 110.468 28.829 1.00 18.05 N
+ATOM 14456 CZ ARG L 77 12.940 111.276 27.782 1.00 20.32 C
+ATOM 14457 NH1 ARG L 77 14.162 111.504 27.343 1.00 23.05 N
+ATOM 14458 NH2 ARG L 77 11.906 111.850 27.208 1.00 18.50 N
+ATOM 14459 H ARG L 77 16.106 107.518 27.200 1.00 0.00 H
+ATOM 14460 HA ARG L 77 16.471 106.083 29.660 1.00 0.00 H
+ATOM 14461 1HB ARG L 77 14.899 107.623 30.631 1.00 0.00 H
+ATOM 14462 2HB ARG L 77 16.053 108.466 29.602 1.00 0.00 H
+ATOM 14463 1HG ARG L 77 14.363 108.595 27.854 1.00 0.00 H
+ATOM 14464 2HG ARG L 77 13.187 107.824 28.944 1.00 0.00 H
+ATOM 14465 1HD ARG L 77 13.457 109.607 30.538 1.00 0.00 H
+ATOM 14466 2HD ARG L 77 14.676 110.388 29.513 1.00 0.00 H
+ATOM 14467 HE ARG L 77 11.782 110.367 29.174 1.00 0.00 H
+ATOM 14468 1HH1 ARG L 77 14.952 111.071 27.805 1.00 0.00 H
+ATOM 14469 2HH1 ARG L 77 14.311 112.121 26.557 1.00 0.00 H
+ATOM 14470 1HH2 ARG L 77 10.961 111.656 27.570 1.00 0.00 H
+ATOM 14471 2HH2 ARG L 77 12.032 112.466 26.424 1.00 0.00 H
+ATOM 14472 N PHE L 78 13.949 105.059 27.911 1.00 16.56 N
+ATOM 14473 CA PHE L 78 12.848 104.096 27.938 1.00 15.02 C
+ATOM 14474 C PHE L 78 13.344 102.659 27.828 1.00 16.02 C
+ATOM 14475 O PHE L 78 13.919 102.265 26.823 1.00 16.16 O
+ATOM 14476 CB PHE L 78 11.849 104.383 26.827 1.00 14.16 C
+ATOM 14477 CG PHE L 78 11.105 105.644 27.053 1.00 10.49 C
+ATOM 14478 CD1 PHE L 78 9.965 105.645 27.824 1.00 7.23 C
+ATOM 14479 CD2 PHE L 78 11.549 106.837 26.520 1.00 7.43 C
+ATOM 14480 CE1 PHE L 78 9.268 106.800 28.050 1.00 9.78 C
+ATOM 14481 CE2 PHE L 78 10.855 107.999 26.746 1.00 5.46 C
+ATOM 14482 CZ PHE L 78 9.711 107.980 27.516 1.00 6.61 C
+ATOM 14483 H PHE L 78 14.281 105.437 27.018 1.00 0.00 H
+ATOM 14484 HA PHE L 78 12.324 104.204 28.892 1.00 0.00 H
+ATOM 14485 1HB PHE L 78 12.368 104.454 25.871 1.00 0.00 H
+ATOM 14486 2HB PHE L 78 11.127 103.568 26.756 1.00 0.00 H
+ATOM 14487 HD1 PHE L 78 9.620 104.711 28.251 1.00 0.00 H
+ATOM 14488 HD2 PHE L 78 12.454 106.846 25.913 1.00 0.00 H
+ATOM 14489 HE1 PHE L 78 8.371 106.780 28.663 1.00 0.00 H
+ATOM 14490 HE2 PHE L 78 11.209 108.936 26.325 1.00 0.00 H
+ATOM 14491 HZ PHE L 78 9.166 108.907 27.703 1.00 0.00 H
+ATOM 14492 N SER L 79 13.079 101.861 28.859 1.00 16.41 N
+ATOM 14493 CA SER L 79 13.574 100.489 28.903 1.00 15.94 C
+ATOM 14494 C SER L 79 12.486 99.520 29.334 1.00 15.86 C
+ATOM 14495 O SER L 79 11.566 99.883 30.058 1.00 16.27 O
+ATOM 14496 CB SER L 79 14.748 100.390 29.851 1.00 15.76 C
+ATOM 14497 OG SER L 79 15.196 99.070 29.951 1.00 16.80 O
+ATOM 14498 H SER L 79 12.578 102.241 29.660 1.00 0.00 H
+ATOM 14499 HA SER L 79 13.902 100.198 27.904 1.00 0.00 H
+ATOM 14500 1HB SER L 79 15.554 101.031 29.492 1.00 0.00 H
+ATOM 14501 2HB SER L 79 14.454 100.752 30.835 1.00 0.00 H
+ATOM 14502 HG SER L 79 14.443 98.561 30.271 1.00 0.00 H
+ATOM 14503 N GLY L 80 12.562 98.284 28.846 1.00 15.29 N
+ATOM 14504 CA GLY L 80 11.547 97.311 29.236 1.00 14.98 C
+ATOM 14505 C GLY L 80 12.128 95.985 29.670 1.00 15.80 C
+ATOM 14506 O GLY L 80 13.265 95.644 29.318 1.00 15.01 O
+ATOM 14507 H GLY L 80 13.321 98.016 28.234 1.00 0.00 H
+ATOM 14508 1HA GLY L 80 10.974 97.735 30.051 1.00 0.00 H
+ATOM 14509 2HA GLY L 80 10.854 97.156 28.414 1.00 0.00 H
+ATOM 14510 N SER L 81 11.337 95.220 30.424 1.00 16.11 N
+ATOM 14511 CA SER L 81 11.748 93.902 30.897 1.00 17.61 C
+ATOM 14512 C SER L 81 10.592 92.942 31.207 1.00 18.16 C
+ATOM 14513 O SER L 81 9.416 93.334 31.236 1.00 19.10 O
+ATOM 14514 CB SER L 81 12.652 94.046 32.109 1.00 16.81 C
+ATOM 14515 OG SER L 81 11.953 94.562 33.207 1.00 19.73 O
+ATOM 14516 H SER L 81 10.422 95.605 30.683 1.00 0.00 H
+ATOM 14517 HA SER L 81 12.342 93.443 30.098 1.00 0.00 H
+ATOM 14518 1HB SER L 81 13.069 93.071 32.363 1.00 0.00 H
+ATOM 14519 2HB SER L 81 13.485 94.700 31.866 1.00 0.00 H
+ATOM 14520 HG SER L 81 11.773 95.480 32.988 1.00 0.00 H
+ATOM 14521 N ARG L 82 10.949 91.680 31.451 1.00 18.37 N
+ATOM 14522 CA ARG L 82 10.022 90.580 31.748 1.00 18.78 C
+ATOM 14523 C ARG L 82 10.396 89.769 32.997 1.00 18.95 C
+ATOM 14524 O ARG L 82 11.529 89.324 33.141 1.00 19.68 O
+ATOM 14525 CB ARG L 82 9.995 89.579 30.586 1.00 19.33 C
+ATOM 14526 CG ARG L 82 9.246 88.270 30.889 1.00 20.54 C
+ATOM 14527 CD ARG L 82 9.415 87.221 29.833 1.00 20.33 C
+ATOM 14528 NE ARG L 82 9.219 85.889 30.413 1.00 21.76 N
+ATOM 14529 CZ ARG L 82 8.082 85.169 30.448 1.00 23.13 C
+ATOM 14530 NH1 ARG L 82 6.989 85.579 29.894 1.00 24.22 N
+ATOM 14531 NH2 ARG L 82 8.074 83.988 31.056 1.00 22.76 N
+ATOM 14532 H ARG L 82 11.935 91.459 31.415 1.00 0.00 H
+ATOM 14533 HA ARG L 82 9.027 90.995 31.903 1.00 0.00 H
+ATOM 14534 1HB ARG L 82 9.512 90.049 29.718 1.00 0.00 H
+ATOM 14535 2HB ARG L 82 11.008 89.329 30.290 1.00 0.00 H
+ATOM 14536 1HG ARG L 82 9.583 87.842 31.829 1.00 0.00 H
+ATOM 14537 2HG ARG L 82 8.179 88.498 30.965 1.00 0.00 H
+ATOM 14538 1HD ARG L 82 8.674 87.380 29.063 1.00 0.00 H
+ATOM 14539 2HD ARG L 82 10.417 87.246 29.404 1.00 0.00 H
+ATOM 14540 HE ARG L 82 10.028 85.495 30.859 1.00 0.00 H
+ATOM 14541 1HH1 ARG L 82 6.958 86.456 29.364 1.00 0.00 H
+ATOM 14542 2HH1 ARG L 82 6.169 84.992 29.962 1.00 0.00 H
+ATOM 14543 1HH2 ARG L 82 8.914 83.643 31.495 1.00 0.00 H
+ATOM 14544 2HH2 ARG L 82 7.185 83.449 31.082 1.00 0.00 H
+ATOM 14545 N SER L 83 9.404 89.542 33.866 1.00 19.41 N
+ATOM 14546 CA SER L 83 9.561 88.646 35.015 1.00 19.55 C
+ATOM 14547 C SER L 83 8.277 87.838 35.187 1.00 20.32 C
+ATOM 14548 O SER L 83 7.254 88.358 35.644 1.00 20.20 O
+ATOM 14549 CB SER L 83 9.861 89.433 36.269 1.00 19.35 C
+ATOM 14550 OG SER L 83 9.970 88.582 37.382 1.00 20.94 O
+ATOM 14551 H SER L 83 8.497 89.977 33.713 1.00 0.00 H
+ATOM 14552 HA SER L 83 10.380 87.959 34.814 1.00 0.00 H
+ATOM 14553 1HB SER L 83 10.798 89.980 36.137 1.00 0.00 H
+ATOM 14554 2HB SER L 83 9.071 90.163 36.441 1.00 0.00 H
+ATOM 14555 HG SER L 83 9.118 88.142 37.463 1.00 0.00 H
+ATOM 14556 N GLY L 84 8.324 86.556 34.859 1.00 21.06 N
+ATOM 14557 CA GLY L 84 7.106 85.761 34.869 1.00 20.80 C
+ATOM 14558 C GLY L 84 6.126 86.388 33.875 1.00 20.61 C
+ATOM 14559 O GLY L 84 6.511 86.720 32.761 1.00 20.69 O
+ATOM 14560 H GLY L 84 9.197 86.154 34.540 1.00 0.00 H
+ATOM 14561 1HA GLY L 84 7.324 84.734 34.584 1.00 0.00 H
+ATOM 14562 2HA GLY L 84 6.676 85.747 35.869 1.00 0.00 H
+ATOM 14563 N THR L 87 4.892 86.626 34.326 1.00 20.45 N
+ATOM 14564 CA THR L 87 3.866 87.219 33.465 1.00 20.14 C
+ATOM 14565 C THR L 87 3.800 88.737 33.608 1.00 20.06 C
+ATOM 14566 O THR L 87 2.920 89.384 33.037 1.00 20.07 O
+ATOM 14567 CB THR L 87 2.486 86.605 33.758 1.00 19.91 C
+ATOM 14568 OG1 THR L 87 2.118 86.866 35.121 1.00 20.01 O
+ATOM 14569 CG2 THR L 87 2.537 85.104 33.521 1.00 19.64 C
+ATOM 14570 H THR L 87 4.651 86.361 35.265 1.00 0.00 H
+ATOM 14571 HA THR L 87 4.116 86.994 32.431 1.00 0.00 H
+ATOM 14572 HB THR L 87 1.740 87.043 33.093 1.00 0.00 H
+ATOM 14573 HG1 THR L 87 2.898 86.836 35.680 1.00 0.00 H
+ATOM 14574 1HG2 THR L 87 1.562 84.666 33.715 1.00 0.00 H
+ATOM 14575 2HG2 THR L 87 2.826 84.920 32.499 1.00 0.00 H
+ATOM 14576 3HG2 THR L 87 3.268 84.650 34.180 1.00 0.00 H
+ATOM 14577 N ASP L 88 4.709 89.303 34.412 1.00 19.55 N
+ATOM 14578 CA ASP L 88 4.771 90.745 34.607 1.00 19.63 C
+ATOM 14579 C ASP L 88 5.739 91.413 33.641 1.00 18.44 C
+ATOM 14580 O ASP L 88 6.928 91.079 33.576 1.00 18.65 O
+ATOM 14581 CB ASP L 88 5.155 91.126 36.040 1.00 20.48 C
+ATOM 14582 CG ASP L 88 4.043 90.840 37.046 1.00 25.54 C
+ATOM 14583 OD1 ASP L 88 2.927 91.228 36.800 1.00 31.90 O
+ATOM 14584 OD2 ASP L 88 4.308 90.266 38.082 1.00 30.06 O
+ATOM 14585 H ASP L 88 5.414 88.725 34.865 1.00 0.00 H
+ATOM 14586 HA ASP L 88 3.785 91.162 34.419 1.00 0.00 H
+ATOM 14587 1HB ASP L 88 6.062 90.577 36.329 1.00 0.00 H
+ATOM 14588 2HB ASP L 88 5.393 92.190 36.077 1.00 0.00 H
+ATOM 14589 N PHE L 89 5.224 92.365 32.887 1.00 16.72 N
+ATOM 14590 CA PHE L 89 6.030 93.121 31.952 1.00 15.21 C
+ATOM 14591 C PHE L 89 6.235 94.512 32.534 1.00 14.57 C
+ATOM 14592 O PHE L 89 5.319 95.086 33.133 1.00 15.17 O
+ATOM 14593 CB PHE L 89 5.328 93.173 30.605 1.00 15.14 C
+ATOM 14594 CG PHE L 89 5.229 91.816 29.988 1.00 14.07 C
+ATOM 14595 CD1 PHE L 89 4.144 90.974 30.271 1.00 11.60 C
+ATOM 14596 CD2 PHE L 89 6.226 91.353 29.148 1.00 13.56 C
+ATOM 14597 CE1 PHE L 89 4.073 89.717 29.709 1.00 12.46 C
+ATOM 14598 CE2 PHE L 89 6.152 90.091 28.589 1.00 14.51 C
+ATOM 14599 CZ PHE L 89 5.070 89.276 28.868 1.00 12.01 C
+ATOM 14600 H PHE L 89 4.238 92.583 32.954 1.00 0.00 H
+ATOM 14601 HA PHE L 89 7.000 92.634 31.835 1.00 0.00 H
+ATOM 14602 1HB PHE L 89 4.318 93.565 30.741 1.00 0.00 H
+ATOM 14603 2HB PHE L 89 5.858 93.832 29.924 1.00 0.00 H
+ATOM 14604 HD1 PHE L 89 3.345 91.314 30.939 1.00 0.00 H
+ATOM 14605 HD2 PHE L 89 7.071 91.997 28.940 1.00 0.00 H
+ATOM 14606 HE1 PHE L 89 3.231 89.068 29.930 1.00 0.00 H
+ATOM 14607 HE2 PHE L 89 6.939 89.735 27.932 1.00 0.00 H
+ATOM 14608 HZ PHE L 89 5.003 88.276 28.427 1.00 0.00 H
+ATOM 14609 N THR L 90 7.427 95.064 32.373 1.00 13.48 N
+ATOM 14610 CA THR L 90 7.695 96.369 32.958 1.00 13.48 C
+ATOM 14611 C THR L 90 8.221 97.410 31.991 1.00 13.73 C
+ATOM 14612 O THR L 90 9.087 97.123 31.165 1.00 13.76 O
+ATOM 14613 CB THR L 90 8.684 96.231 34.138 1.00 13.99 C
+ATOM 14614 OG1 THR L 90 8.110 95.385 35.140 1.00 12.46 O
+ATOM 14615 CG2 THR L 90 8.996 97.594 34.747 1.00 12.31 C
+ATOM 14616 H THR L 90 8.158 94.554 31.879 1.00 0.00 H
+ATOM 14617 HA THR L 90 6.759 96.753 33.357 1.00 0.00 H
+ATOM 14618 HB THR L 90 9.609 95.776 33.787 1.00 0.00 H
+ATOM 14619 HG1 THR L 90 7.216 95.675 35.323 1.00 0.00 H
+ATOM 14620 1HG2 THR L 90 9.685 97.471 35.578 1.00 0.00 H
+ATOM 14621 2HG2 THR L 90 9.456 98.235 34.000 1.00 0.00 H
+ATOM 14622 3HG2 THR L 90 8.072 98.049 35.100 1.00 0.00 H
+ATOM 14623 N LEU L 91 7.689 98.629 32.126 1.00 14.49 N
+ATOM 14624 CA LEU L 91 8.190 99.817 31.437 1.00 14.05 C
+ATOM 14625 C LEU L 91 8.893 100.705 32.442 1.00 13.80 C
+ATOM 14626 O LEU L 91 8.346 101.027 33.507 1.00 13.40 O
+ATOM 14627 CB LEU L 91 7.080 100.602 30.738 1.00 13.27 C
+ATOM 14628 CG LEU L 91 7.463 101.983 30.127 1.00 12.02 C
+ATOM 14629 CD1 LEU L 91 8.439 101.788 28.998 1.00 11.64 C
+ATOM 14630 CD2 LEU L 91 6.209 102.673 29.596 1.00 10.60 C
+ATOM 14631 H LEU L 91 6.932 98.746 32.799 1.00 0.00 H
+ATOM 14632 HA LEU L 91 8.919 99.509 30.685 1.00 0.00 H
+ATOM 14633 1HB LEU L 91 6.787 100.018 29.921 1.00 0.00 H
+ATOM 14634 2HB LEU L 91 6.242 100.716 31.396 1.00 0.00 H
+ATOM 14635 HG LEU L 91 7.932 102.605 30.895 1.00 0.00 H
+ATOM 14636 1HD1 LEU L 91 8.702 102.745 28.574 1.00 0.00 H
+ATOM 14637 2HD1 LEU L 91 9.341 101.294 29.363 1.00 0.00 H
+ATOM 14638 3HD1 LEU L 91 7.963 101.177 28.241 1.00 0.00 H
+ATOM 14639 1HD2 LEU L 91 6.486 103.637 29.173 1.00 0.00 H
+ATOM 14640 2HD2 LEU L 91 5.758 102.061 28.823 1.00 0.00 H
+ATOM 14641 3HD2 LEU L 91 5.494 102.820 30.394 1.00 0.00 H
+ATOM 14642 N THR L 92 10.117 101.071 32.125 1.00 14.14 N
+ATOM 14643 CA THR L 92 10.915 101.897 32.996 1.00 15.06 C
+ATOM 14644 C THR L 92 11.349 103.185 32.317 1.00 16.14 C
+ATOM 14645 O THR L 92 11.829 103.166 31.178 1.00 17.18 O
+ATOM 14646 CB THR L 92 12.167 101.130 33.450 1.00 15.74 C
+ATOM 14647 OG1 THR L 92 11.767 99.945 34.137 1.00 16.74 O
+ATOM 14648 CG2 THR L 92 13.026 101.992 34.376 1.00 13.80 C
+ATOM 14649 H THR L 92 10.522 100.747 31.254 1.00 0.00 H
+ATOM 14650 HA THR L 92 10.322 102.155 33.871 1.00 0.00 H
+ATOM 14651 HB THR L 92 12.749 100.846 32.576 1.00 0.00 H
+ATOM 14652 HG1 THR L 92 11.066 100.172 34.754 1.00 0.00 H
+ATOM 14653 1HG2 THR L 92 13.900 101.426 34.680 1.00 0.00 H
+ATOM 14654 2HG2 THR L 92 13.349 102.888 33.853 1.00 0.00 H
+ATOM 14655 3HG2 THR L 92 12.445 102.274 35.258 1.00 0.00 H
+ATOM 14656 N ILE L 93 11.212 104.298 33.028 1.00 17.22 N
+ATOM 14657 CA ILE L 93 11.743 105.566 32.547 1.00 18.24 C
+ATOM 14658 C ILE L 93 12.885 105.889 33.499 1.00 18.68 C
+ATOM 14659 O ILE L 93 12.652 106.183 34.675 1.00 19.79 O
+ATOM 14660 CB ILE L 93 10.686 106.684 32.570 1.00 17.96 C
+ATOM 14661 CG1 ILE L 93 9.448 106.253 31.756 1.00 19.85 C
+ATOM 14662 CG2 ILE L 93 11.286 107.950 31.955 1.00 18.60 C
+ATOM 14663 CD1 ILE L 93 8.247 107.183 31.894 1.00 22.47 C
+ATOM 14664 H ILE L 93 10.759 104.242 33.941 1.00 0.00 H
+ATOM 14665 HA ILE L 93 12.132 105.450 31.535 1.00 0.00 H
+ATOM 14666 HB ILE L 93 10.388 106.892 33.579 1.00 0.00 H
+ATOM 14667 1HG1 ILE L 93 9.732 106.201 30.718 1.00 0.00 H
+ATOM 14668 2HG1 ILE L 93 9.143 105.258 32.080 1.00 0.00 H
+ATOM 14669 1HG2 ILE L 93 10.548 108.751 31.957 1.00 0.00 H
+ATOM 14670 2HG2 ILE L 93 12.155 108.259 32.530 1.00 0.00 H
+ATOM 14671 3HG2 ILE L 93 11.586 107.742 30.927 1.00 0.00 H
+ATOM 14672 1HD1 ILE L 93 7.425 106.802 31.288 1.00 0.00 H
+ATOM 14673 2HD1 ILE L 93 7.935 107.227 32.936 1.00 0.00 H
+ATOM 14674 3HD1 ILE L 93 8.515 108.183 31.553 1.00 0.00 H
+ATOM 14675 N SER L 94 14.131 105.791 33.020 1.00 18.71 N
+ATOM 14676 CA SER L 94 15.279 105.914 33.925 1.00 18.63 C
+ATOM 14677 C SER L 94 15.392 107.277 34.609 1.00 18.75 C
+ATOM 14678 O SER L 94 15.959 107.387 35.692 1.00 21.09 O
+ATOM 14679 CB SER L 94 16.564 105.671 33.169 1.00 18.88 C
+ATOM 14680 OG SER L 94 16.820 106.722 32.281 1.00 19.34 O
+ATOM 14681 H SER L 94 14.269 105.564 32.034 1.00 0.00 H
+ATOM 14682 HA SER L 94 15.180 105.158 34.700 1.00 0.00 H
+ATOM 14683 1HB SER L 94 17.389 105.572 33.872 1.00 0.00 H
+ATOM 14684 2HB SER L 94 16.482 104.736 32.616 1.00 0.00 H
+ATOM 14685 HG SER L 94 16.880 107.514 32.828 1.00 0.00 H
+ATOM 14686 N SER L 95 14.857 108.298 33.961 1.00 16.97 N
+ATOM 14687 CA SER L 95 14.880 109.660 34.468 1.00 16.26 C
+ATOM 14688 C SER L 95 13.749 110.450 33.825 1.00 15.58 C
+ATOM 14689 O SER L 95 13.892 110.904 32.688 1.00 15.85 O
+ATOM 14690 CB SER L 95 16.210 110.303 34.152 1.00 16.18 C
+ATOM 14691 OG SER L 95 16.247 111.623 34.588 1.00 18.15 O
+ATOM 14692 H SER L 95 14.408 108.113 33.077 1.00 0.00 H
+ATOM 14693 HA SER L 95 14.714 109.641 35.553 1.00 0.00 H
+ATOM 14694 1HB SER L 95 17.014 109.737 34.626 1.00 0.00 H
+ATOM 14695 2HB SER L 95 16.377 110.266 33.074 1.00 0.00 H
+ATOM 14696 HG SER L 95 15.389 111.992 34.357 1.00 0.00 H
+ATOM 14697 N LEU L 96 12.672 110.645 34.566 1.00 14.29 N
+ATOM 14698 CA LEU L 96 11.473 111.287 34.037 1.00 12.58 C
+ATOM 14699 C LEU L 96 11.714 112.723 33.592 1.00 11.94 C
+ATOM 14700 O LEU L 96 12.259 113.529 34.336 1.00 11.73 O
+ATOM 14701 CB LEU L 96 10.407 111.272 35.131 1.00 12.59 C
+ATOM 14702 CG LEU L 96 9.030 111.748 34.741 1.00 11.11 C
+ATOM 14703 CD1 LEU L 96 8.445 110.791 33.718 1.00 10.37 C
+ATOM 14704 CD2 LEU L 96 8.211 111.783 35.995 1.00 9.79 C
+ATOM 14705 H LEU L 96 12.645 110.261 35.503 1.00 0.00 H
+ATOM 14706 HA LEU L 96 11.122 110.723 33.178 1.00 0.00 H
+ATOM 14707 1HB LEU L 96 10.315 110.256 35.501 1.00 0.00 H
+ATOM 14708 2HB LEU L 96 10.740 111.902 35.956 1.00 0.00 H
+ATOM 14709 HG LEU L 96 9.073 112.740 34.286 1.00 0.00 H
+ATOM 14710 1HD1 LEU L 96 7.445 111.121 33.435 1.00 0.00 H
+ATOM 14711 2HD1 LEU L 96 9.089 110.779 32.847 1.00 0.00 H
+ATOM 14712 3HD1 LEU L 96 8.390 109.793 34.131 1.00 0.00 H
+ATOM 14713 1HD2 LEU L 96 7.210 112.072 35.797 1.00 0.00 H
+ATOM 14714 2HD2 LEU L 96 8.210 110.800 36.414 1.00 0.00 H
+ATOM 14715 3HD2 LEU L 96 8.658 112.477 36.700 1.00 0.00 H
+ATOM 14716 N GLN L 97 11.303 113.034 32.370 1.00 11.03 N
+ATOM 14717 CA GLN L 97 11.440 114.395 31.847 1.00 9.90 C
+ATOM 14718 C GLN L 97 10.066 115.053 31.767 1.00 10.08 C
+ATOM 14719 O GLN L 97 9.059 114.353 31.719 1.00 9.92 O
+ATOM 14720 CB GLN L 97 12.128 114.352 30.476 1.00 9.77 C
+ATOM 14721 CG GLN L 97 13.486 113.678 30.476 1.00 10.35 C
+ATOM 14722 CD GLN L 97 14.509 114.366 31.344 1.00 15.98 C
+ATOM 14723 OE1 GLN L 97 14.807 115.555 31.201 1.00 17.27 O
+ATOM 14724 NE2 GLN L 97 15.065 113.600 32.271 1.00 15.69 N
+ATOM 14725 H GLN L 97 10.890 112.316 31.765 1.00 0.00 H
+ATOM 14726 HA GLN L 97 12.073 114.953 32.536 1.00 0.00 H
+ATOM 14727 1HB GLN L 97 11.491 113.793 29.784 1.00 0.00 H
+ATOM 14728 2HB GLN L 97 12.249 115.339 30.065 1.00 0.00 H
+ATOM 14729 1HG GLN L 97 13.360 112.652 30.814 1.00 0.00 H
+ATOM 14730 2HG GLN L 97 13.858 113.689 29.451 1.00 0.00 H
+ATOM 14731 1HE2 GLN L 97 15.753 113.976 32.890 1.00 0.00 H
+ATOM 14732 2HE2 GLN L 97 14.775 112.628 32.357 1.00 0.00 H
+ATOM 14733 N PRO L 98 9.938 116.399 31.736 1.00 10.29 N
+ATOM 14734 CA PRO L 98 8.709 117.150 31.510 1.00 10.45 C
+ATOM 14735 C PRO L 98 7.916 116.660 30.294 1.00 11.47 C
+ATOM 14736 O PRO L 98 6.693 116.659 30.245 1.00 12.23 O
+ATOM 14737 CB PRO L 98 9.215 118.564 31.290 1.00 10.27 C
+ATOM 14738 CG PRO L 98 10.505 118.619 32.066 1.00 9.98 C
+ATOM 14739 CD PRO L 98 11.122 117.251 31.906 1.00 10.10 C
+ATOM 14740 HA PRO L 98 8.073 117.108 32.435 1.00 0.00 H
+ATOM 14741 1HB PRO L 98 9.393 118.716 30.195 1.00 0.00 H
+ATOM 14742 2HB PRO L 98 8.492 119.322 31.601 1.00 0.00 H
+ATOM 14743 1HG PRO L 98 11.151 119.420 31.674 1.00 0.00 H
+ATOM 14744 2HG PRO L 98 10.274 118.867 33.101 1.00 0.00 H
+ATOM 14745 1HD PRO L 98 11.771 117.233 31.024 1.00 0.00 H
+ATOM 14746 2HD PRO L 98 11.641 117.015 32.822 1.00 0.00 H
+ATOM 14747 N GLU L 99 8.677 116.197 29.304 1.00 11.73 N
+ATOM 14748 CA GLU L 99 8.149 115.726 28.036 1.00 12.72 C
+ATOM 14749 C GLU L 99 7.521 114.353 28.113 1.00 12.46 C
+ATOM 14750 O GLU L 99 6.938 113.875 27.143 1.00 11.58 O
+ATOM 14751 CB GLU L 99 9.237 115.725 26.984 1.00 13.16 C
+ATOM 14752 CG GLU L 99 9.796 117.104 26.670 1.00 19.66 C
+ATOM 14753 CD GLU L 99 10.842 117.613 27.669 1.00 26.12 C
+ATOM 14754 OE1 GLU L 99 11.647 116.833 28.099 1.00 30.88 O
+ATOM 14755 OE2 GLU L 99 10.839 118.776 27.967 1.00 29.41 O
+ATOM 14756 H GLU L 99 9.679 116.208 29.405 1.00 0.00 H
+ATOM 14757 HA GLU L 99 7.372 116.419 27.732 1.00 0.00 H
+ATOM 14758 1HB GLU L 99 10.062 115.099 27.326 1.00 0.00 H
+ATOM 14759 2HB GLU L 99 8.850 115.286 26.061 1.00 0.00 H
+ATOM 14760 1HG GLU L 99 10.226 117.090 25.656 1.00 0.00 H
+ATOM 14761 2HG GLU L 99 8.958 117.802 26.668 1.00 0.00 H
+ATOM 14762 N ASP L 100 7.663 113.712 29.265 1.00 12.56 N
+ATOM 14763 CA ASP L 100 7.138 112.382 29.435 1.00 12.65 C
+ATOM 14764 C ASP L 100 5.730 112.416 29.998 1.00 12.94 C
+ATOM 14765 O ASP L 100 5.144 111.357 30.240 1.00 11.86 O
+ATOM 14766 CB ASP L 100 8.064 111.578 30.327 1.00 12.39 C
+ATOM 14767 CG ASP L 100 9.368 111.319 29.638 1.00 14.08 C
+ATOM 14768 OD1 ASP L 100 9.381 111.291 28.427 1.00 12.60 O
+ATOM 14769 OD2 ASP L 100 10.374 111.182 30.301 1.00 14.71 O
+ATOM 14770 H ASP L 100 8.142 114.146 30.044 1.00 0.00 H
+ATOM 14771 HA ASP L 100 7.107 111.901 28.467 1.00 0.00 H
+ATOM 14772 1HB ASP L 100 8.228 112.126 31.245 1.00 0.00 H
+ATOM 14773 2HB ASP L 100 7.605 110.635 30.575 1.00 0.00 H
+ATOM 14774 N PHE L 101 5.164 113.613 30.170 1.00 11.75 N
+ATOM 14775 CA PHE L 101 3.778 113.670 30.629 1.00 11.90 C
+ATOM 14776 C PHE L 101 2.942 112.999 29.555 1.00 12.16 C
+ATOM 14777 O PHE L 101 2.802 113.516 28.450 1.00 12.97 O
+ATOM 14778 CB PHE L 101 3.309 115.109 30.819 1.00 11.72 C
+ATOM 14779 CG PHE L 101 1.882 115.202 31.312 1.00 12.66 C
+ATOM 14780 CD1 PHE L 101 1.563 114.919 32.631 1.00 13.78 C
+ATOM 14781 CD2 PHE L 101 0.850 115.571 30.444 1.00 12.92 C
+ATOM 14782 CE1 PHE L 101 0.251 114.995 33.070 1.00 10.98 C
+ATOM 14783 CE2 PHE L 101 -0.457 115.645 30.884 1.00 12.95 C
+ATOM 14784 CZ PHE L 101 -0.753 115.360 32.198 1.00 15.29 C
+ATOM 14785 H PHE L 101 5.676 114.480 29.989 1.00 0.00 H
+ATOM 14786 HA PHE L 101 3.687 113.115 31.565 1.00 0.00 H
+ATOM 14787 1HB PHE L 101 3.953 115.622 31.526 1.00 0.00 H
+ATOM 14788 2HB PHE L 101 3.378 115.642 29.870 1.00 0.00 H
+ATOM 14789 HD1 PHE L 101 2.356 114.624 33.317 1.00 0.00 H
+ATOM 14790 HD2 PHE L 101 1.088 115.796 29.403 1.00 0.00 H
+ATOM 14791 HE1 PHE L 101 0.007 114.766 34.105 1.00 0.00 H
+ATOM 14792 HE2 PHE L 101 -1.252 115.931 30.197 1.00 0.00 H
+ATOM 14793 HZ PHE L 101 -1.782 115.416 32.545 1.00 0.00 H
+ATOM 14794 N ALA L 102 2.424 111.814 29.868 1.00 11.65 N
+ATOM 14795 CA ALA L 102 1.723 111.005 28.884 1.00 11.41 C
+ATOM 14796 C ALA L 102 0.975 109.849 29.535 1.00 12.15 C
+ATOM 14797 O ALA L 102 1.244 109.470 30.684 1.00 12.87 O
+ATOM 14798 CB ALA L 102 2.715 110.462 27.864 1.00 10.99 C
+ATOM 14799 H ALA L 102 2.556 111.462 30.808 1.00 0.00 H
+ATOM 14800 HA ALA L 102 0.995 111.637 28.372 1.00 0.00 H
+ATOM 14801 1HB ALA L 102 2.186 109.871 27.122 1.00 0.00 H
+ATOM 14802 2HB ALA L 102 3.238 111.276 27.369 1.00 0.00 H
+ATOM 14803 3HB ALA L 102 3.434 109.840 28.372 1.00 0.00 H
+ATOM 14804 N THR L 103 0.058 109.262 28.767 1.00 12.06 N
+ATOM 14805 CA THR L 103 -0.595 108.037 29.187 1.00 12.77 C
+ATOM 14806 C THR L 103 0.158 106.893 28.543 1.00 13.01 C
+ATOM 14807 O THR L 103 0.443 106.923 27.343 1.00 13.36 O
+ATOM 14808 CB THR L 103 -2.080 107.982 28.784 1.00 12.58 C
+ATOM 14809 OG1 THR L 103 -2.785 109.074 29.391 1.00 13.24 O
+ATOM 14810 CG2 THR L 103 -2.703 106.656 29.278 1.00 12.39 C
+ATOM 14811 H THR L 103 -0.141 109.646 27.850 1.00 0.00 H
+ATOM 14812 HA THR L 103 -0.519 107.941 30.259 1.00 0.00 H
+ATOM 14813 HB THR L 103 -2.170 108.052 27.702 1.00 0.00 H
+ATOM 14814 HG1 THR L 103 -2.799 108.949 30.339 1.00 0.00 H
+ATOM 14815 1HG2 THR L 103 -3.752 106.621 28.998 1.00 0.00 H
+ATOM 14816 2HG2 THR L 103 -2.185 105.807 28.833 1.00 0.00 H
+ATOM 14817 3HG2 THR L 103 -2.619 106.594 30.358 1.00 0.00 H
+ATOM 14818 N TYR L 104 0.535 105.910 29.323 1.00 12.66 N
+ATOM 14819 CA TYR L 104 1.303 104.821 28.764 1.00 12.49 C
+ATOM 14820 C TYR L 104 0.449 103.587 28.643 1.00 13.72 C
+ATOM 14821 O TYR L 104 -0.431 103.335 29.471 1.00 13.35 O
+ATOM 14822 CB TYR L 104 2.538 104.567 29.610 1.00 11.67 C
+ATOM 14823 CG TYR L 104 3.478 105.725 29.597 1.00 10.84 C
+ATOM 14824 CD1 TYR L 104 4.521 105.741 28.718 1.00 9.77 C
+ATOM 14825 CD2 TYR L 104 3.273 106.792 30.455 1.00 15.39 C
+ATOM 14826 CE1 TYR L 104 5.376 106.807 28.692 1.00 13.16 C
+ATOM 14827 CE2 TYR L 104 4.131 107.866 30.421 1.00 11.83 C
+ATOM 14828 CZ TYR L 104 5.176 107.869 29.545 1.00 14.89 C
+ATOM 14829 OH TYR L 104 6.024 108.932 29.484 1.00 14.08 O
+ATOM 14830 H TYR L 104 0.280 105.922 30.304 1.00 0.00 H
+ATOM 14831 HA TYR L 104 1.625 105.096 27.763 1.00 0.00 H
+ATOM 14832 1HB TYR L 104 2.260 104.366 30.618 1.00 0.00 H
+ATOM 14833 2HB TYR L 104 3.067 103.693 29.225 1.00 0.00 H
+ATOM 14834 HD1 TYR L 104 4.659 104.899 28.038 1.00 0.00 H
+ATOM 14835 HD2 TYR L 104 2.430 106.787 31.147 1.00 0.00 H
+ATOM 14836 HE1 TYR L 104 6.205 106.823 27.993 1.00 0.00 H
+ATOM 14837 HE2 TYR L 104 3.976 108.716 31.082 1.00 0.00 H
+ATOM 14838 HH TYR L 104 5.602 109.720 29.885 1.00 0.00 H
+ATOM 14839 N TYR L 105 0.712 102.810 27.601 1.00 14.92 N
+ATOM 14840 CA TYR L 105 -0.019 101.569 27.409 1.00 16.71 C
+ATOM 14841 C TYR L 105 0.886 100.397 27.130 1.00 18.17 C
+ATOM 14842 O TYR L 105 1.872 100.514 26.408 1.00 19.12 O
+ATOM 14843 CB TYR L 105 -1.005 101.671 26.231 1.00 16.51 C
+ATOM 14844 CG TYR L 105 -2.066 102.718 26.375 1.00 14.66 C
+ATOM 14845 CD1 TYR L 105 -1.809 104.019 25.963 1.00 13.99 C
+ATOM 14846 CD2 TYR L 105 -3.299 102.384 26.915 1.00 13.10 C
+ATOM 14847 CE1 TYR L 105 -2.777 104.978 26.098 1.00 15.72 C
+ATOM 14848 CE2 TYR L 105 -4.263 103.349 27.054 1.00 14.53 C
+ATOM 14849 CZ TYR L 105 -4.004 104.645 26.647 1.00 17.40 C
+ATOM 14850 OH TYR L 105 -4.954 105.622 26.798 1.00 19.26 O
+ATOM 14851 H TYR L 105 1.441 103.097 26.950 1.00 0.00 H
+ATOM 14852 HA TYR L 105 -0.572 101.345 28.321 1.00 0.00 H
+ATOM 14853 1HB TYR L 105 -0.457 101.868 25.314 1.00 0.00 H
+ATOM 14854 2HB TYR L 105 -1.503 100.706 26.101 1.00 0.00 H
+ATOM 14855 HD1 TYR L 105 -0.836 104.280 25.538 1.00 0.00 H
+ATOM 14856 HD2 TYR L 105 -3.499 101.360 27.238 1.00 0.00 H
+ATOM 14857 HE1 TYR L 105 -2.580 105.998 25.784 1.00 0.00 H
+ATOM 14858 HE2 TYR L 105 -5.226 103.088 27.488 1.00 0.00 H
+ATOM 14859 HH TYR L 105 -5.565 105.372 27.492 1.00 0.00 H
+ATOM 14860 N CYS L 106 0.485 99.249 27.642 1.00 17.68 N
+ATOM 14861 CA CYS L 106 1.079 97.986 27.276 1.00 19.18 C
+ATOM 14862 C CYS L 106 0.108 97.321 26.331 1.00 18.54 C
+ATOM 14863 O CYS L 106 -1.109 97.474 26.482 1.00 19.07 O
+ATOM 14864 CB CYS L 106 1.294 97.097 28.495 1.00 19.19 C
+ATOM 14865 SG CYS L 106 -0.226 96.714 29.401 1.00 28.00 S
+ATOM 14866 H CYS L 106 -0.293 99.251 28.277 1.00 0.00 H
+ATOM 14867 HA CYS L 106 2.034 98.153 26.778 1.00 0.00 H
+ATOM 14868 1HB CYS L 106 1.748 96.157 28.186 1.00 0.00 H
+ATOM 14869 2HB CYS L 106 1.962 97.571 29.164 1.00 0.00 H
+ATOM 14870 N GLN L 107 0.626 96.549 25.402 1.00 17.00 N
+ATOM 14871 CA GLN L 107 -0.218 95.798 24.493 1.00 15.72 C
+ATOM 14872 C GLN L 107 0.345 94.442 24.212 1.00 14.27 C
+ATOM 14873 O GLN L 107 1.536 94.317 23.949 1.00 13.82 O
+ATOM 14874 CB GLN L 107 -0.339 96.494 23.127 1.00 16.40 C
+ATOM 14875 CG GLN L 107 -1.208 95.760 22.091 1.00 16.78 C
+ATOM 14876 CD GLN L 107 -1.284 96.449 20.758 1.00 16.92 C
+ATOM 14877 OE1 GLN L 107 -2.355 96.739 20.222 1.00 21.50 O
+ATOM 14878 NE2 GLN L 107 -0.126 96.717 20.189 1.00 11.91 N
+ATOM 14879 H GLN L 107 1.637 96.513 25.300 1.00 0.00 H
+ATOM 14880 HA GLN L 107 -1.188 95.687 24.954 1.00 0.00 H
+ATOM 14881 1HB GLN L 107 -0.717 97.499 23.255 1.00 0.00 H
+ATOM 14882 2HB GLN L 107 0.648 96.555 22.703 1.00 0.00 H
+ATOM 14883 1HG GLN L 107 -0.768 94.796 21.903 1.00 0.00 H
+ATOM 14884 2HG GLN L 107 -2.209 95.645 22.473 1.00 0.00 H
+ATOM 14885 1HE2 GLN L 107 -0.108 97.173 19.304 1.00 0.00 H
+ATOM 14886 2HE2 GLN L 107 0.730 96.460 20.643 1.00 0.00 H
+ATOM 14887 N GLN L 108 -0.513 93.435 24.160 1.00 13.13 N
+ATOM 14888 CA GLN L 108 0.008 92.181 23.676 1.00 12.56 C
+ATOM 14889 C GLN L 108 -0.398 92.062 22.241 1.00 11.48 C
+ATOM 14890 O GLN L 108 -1.526 92.394 21.859 1.00 11.14 O
+ATOM 14891 CB GLN L 108 -0.459 90.942 24.463 1.00 11.96 C
+ATOM 14892 CG GLN L 108 -1.969 90.727 24.533 1.00 12.35 C
+ATOM 14893 CD GLN L 108 -2.597 89.984 23.370 1.00 13.88 C
+ATOM 14894 OE1 GLN L 108 -1.972 89.197 22.605 1.00 18.45 O
+ATOM 14895 NE2 GLN L 108 -3.899 90.256 23.233 1.00 16.21 N
+ATOM 14896 H GLN L 108 -1.492 93.573 24.401 1.00 0.00 H
+ATOM 14897 HA GLN L 108 1.089 92.196 23.712 1.00 0.00 H
+ATOM 14898 1HB GLN L 108 -0.027 90.053 24.000 1.00 0.00 H
+ATOM 14899 2HB GLN L 108 -0.067 90.985 25.477 1.00 0.00 H
+ATOM 14900 1HG GLN L 108 -2.197 90.169 25.399 1.00 0.00 H
+ATOM 14901 2HG GLN L 108 -2.438 91.722 24.589 1.00 0.00 H
+ATOM 14902 1HE2 GLN L 108 -4.470 89.877 22.478 1.00 0.00 H
+ATOM 14903 2HE2 GLN L 108 -4.343 90.879 23.900 1.00 0.00 H
+ATOM 14904 N HIS L 109 0.531 91.539 21.476 1.00 11.28 N
+ATOM 14905 CA HIS L 109 0.378 91.278 20.064 1.00 10.80 C
+ATOM 14906 C HIS L 109 0.773 89.851 19.881 1.00 10.89 C
+ATOM 14907 O HIS L 109 1.523 89.504 18.958 1.00 11.00 O
+ATOM 14908 CB HIS L 109 1.221 92.214 19.198 1.00 10.27 C
+ATOM 14909 CG HIS L 109 2.676 92.197 19.540 1.00 9.83 C
+ATOM 14910 ND1 HIS L 109 3.247 93.089 20.414 1.00 12.10 N
+ATOM 14911 CD2 HIS L 109 3.658 91.371 19.145 1.00 9.45 C
+ATOM 14912 CE1 HIS L 109 4.534 92.820 20.529 1.00 11.08 C
+ATOM 14913 NE2 HIS L 109 4.803 91.776 19.760 1.00 9.39 N
+ATOM 14914 H HIS L 109 1.425 91.316 21.911 1.00 0.00 H
+ATOM 14915 HA HIS L 109 -0.644 91.371 19.764 1.00 0.00 H
+ATOM 14916 1HB HIS L 109 1.130 91.932 18.154 1.00 0.00 H
+ATOM 14917 2HB HIS L 109 0.872 93.240 19.296 1.00 0.00 H
+ATOM 14918 HD2 HIS L 109 3.546 90.530 18.453 1.00 0.00 H
+ATOM 14919 HE1 HIS L 109 5.249 93.360 21.147 1.00 0.00 H
+ATOM 14920 HE2 HIS L 109 5.711 91.340 19.640 1.00 0.00 H
+ATOM 14921 N TYR L 110 0.335 89.008 20.812 1.00 11.33 N
+ATOM 14922 CA TYR L 110 0.613 87.608 20.771 1.00 11.54 C
+ATOM 14923 C TYR L 110 -0.536 86.985 19.986 1.00 12.47 C
+ATOM 14924 O TYR L 110 -0.342 86.300 18.990 1.00 12.06 O
+ATOM 14925 CB TYR L 110 0.665 86.989 22.167 1.00 11.29 C
+ATOM 14926 CG TYR L 110 1.364 85.671 22.197 1.00 10.98 C
+ATOM 14927 CD1 TYR L 110 1.972 85.237 23.323 1.00 11.78 C
+ATOM 14928 CD2 TYR L 110 1.389 84.868 21.083 1.00 7.96 C
+ATOM 14929 CE1 TYR L 110 2.664 84.031 23.398 1.00 9.43 C
+ATOM 14930 CE2 TYR L 110 2.101 83.626 21.121 1.00 10.72 C
+ATOM 14931 CZ TYR L 110 2.698 83.224 22.272 1.00 10.43 C
+ATOM 14932 OH TYR L 110 3.344 82.029 22.309 1.00 11.41 O
+ATOM 14933 H TYR L 110 -0.282 89.341 21.569 1.00 0.00 H
+ATOM 14934 HA TYR L 110 1.548 87.439 20.229 1.00 0.00 H
+ATOM 14935 1HB TYR L 110 1.126 87.658 22.879 1.00 0.00 H
+ATOM 14936 2HB TYR L 110 -0.327 86.785 22.486 1.00 0.00 H
+ATOM 14937 HD1 TYR L 110 1.966 85.833 24.183 1.00 0.00 H
+ATOM 14938 HD2 TYR L 110 0.821 85.121 20.119 1.00 0.00 H
+ATOM 14939 HE1 TYR L 110 3.143 83.679 24.337 1.00 0.00 H
+ATOM 14940 HE2 TYR L 110 2.142 82.936 20.235 1.00 0.00 H
+ATOM 14941 HH TYR L 110 3.085 81.531 21.557 1.00 0.00 H
+ATOM 14942 N THR L 111 -1.738 87.308 20.471 1.00 12.85 N
+ATOM 14943 CA THR L 111 -2.984 86.790 19.957 1.00 14.32 C
+ATOM 14944 C THR L 111 -3.835 87.845 19.299 1.00 15.18 C
+ATOM 14945 O THR L 111 -3.503 89.034 19.312 1.00 14.21 O
+ATOM 14946 CB THR L 111 -3.747 86.144 21.105 1.00 15.09 C
+ATOM 14947 OG1 THR L 111 -3.965 87.123 22.149 1.00 13.50 O
+ATOM 14948 CG2 THR L 111 -3.025 84.994 21.611 1.00 13.16 C
+ATOM 14949 H THR L 111 -1.782 87.924 21.279 1.00 0.00 H
+ATOM 14950 HA THR L 111 -2.744 86.036 19.216 1.00 0.00 H
+ATOM 14951 HB THR L 111 -4.721 85.803 20.745 1.00 0.00 H
+ATOM 14952 HG1 THR L 111 -3.175 87.695 22.254 1.00 0.00 H
+ATOM 14953 1HG2 THR L 111 -3.609 84.540 22.395 1.00 0.00 H
+ATOM 14954 2HG2 THR L 111 -2.891 84.296 20.782 1.00 0.00 H
+ATOM 14955 3HG2 THR L 111 -2.057 85.310 21.976 1.00 0.00 H
+ATOM 14956 N THR L 135 -4.921 87.398 18.692 1.00 15.61 N
+ATOM 14957 CA THR L 135 -5.854 88.302 18.049 1.00 15.99 C
+ATOM 14958 C THR L 135 -7.208 88.156 18.755 1.00 16.43 C
+ATOM 14959 O THR L 135 -7.706 87.042 18.938 1.00 15.70 O
+ATOM 14960 CB THR L 135 -5.888 88.041 16.547 1.00 16.29 C
+ATOM 14961 OG1 THR L 135 -4.587 88.239 16.012 1.00 16.62 O
+ATOM 14962 CG2 THR L 135 -6.796 89.024 15.862 1.00 16.22 C
+ATOM 14963 H THR L 135 -5.114 86.396 18.709 1.00 0.00 H
+ATOM 14964 HA THR L 135 -5.436 89.309 18.140 1.00 0.00 H
+ATOM 14965 HB THR L 135 -6.220 87.018 16.351 1.00 0.00 H
+ATOM 14966 HG1 THR L 135 -3.935 87.812 16.555 1.00 0.00 H
+ATOM 14967 1HG2 THR L 135 -6.794 88.859 14.785 1.00 0.00 H
+ATOM 14968 2HG2 THR L 135 -7.779 88.897 16.259 1.00 0.00 H
+ATOM 14969 3HG2 THR L 135 -6.460 90.032 16.050 1.00 0.00 H
+ATOM 14970 N PRO L 136 -7.795 89.279 19.185 1.00 16.70 N
+ATOM 14971 CA PRO L 136 -7.357 90.643 19.007 1.00 17.20 C
+ATOM 14972 C PRO L 136 -6.164 90.909 19.894 1.00 17.42 C
+ATOM 14973 O PRO L 136 -5.997 90.226 20.912 1.00 17.71 O
+ATOM 14974 CB PRO L 136 -8.589 91.426 19.455 1.00 16.80 C
+ATOM 14975 CG PRO L 136 -9.233 90.549 20.501 1.00 18.22 C
+ATOM 14976 CD PRO L 136 -8.954 89.130 20.061 1.00 16.83 C
+ATOM 14977 HA PRO L 136 -7.150 90.830 17.965 1.00 0.00 H
+ATOM 14978 1HB PRO L 136 -8.296 92.427 19.836 1.00 0.00 H
+ATOM 14979 2HB PRO L 136 -9.249 91.588 18.606 1.00 0.00 H
+ATOM 14980 1HG PRO L 136 -8.812 90.763 21.490 1.00 0.00 H
+ATOM 14981 2HG PRO L 136 -10.306 90.749 20.553 1.00 0.00 H
+ATOM 14982 1HD PRO L 136 -8.675 88.532 20.940 1.00 0.00 H
+ATOM 14983 2HD PRO L 136 -9.803 88.684 19.517 1.00 0.00 H
+ATOM 14984 N PRO L 137 -5.310 91.856 19.533 1.00 17.65 N
+ATOM 14985 CA PRO L 137 -4.301 92.399 20.371 1.00 18.22 C
+ATOM 14986 C PRO L 137 -5.061 93.208 21.376 1.00 19.11 C
+ATOM 14987 O PRO L 137 -6.141 93.727 21.059 1.00 19.49 O
+ATOM 14988 CB PRO L 137 -3.418 93.186 19.401 1.00 17.34 C
+ATOM 14989 CG PRO L 137 -4.341 93.590 18.286 1.00 17.57 C
+ATOM 14990 CD PRO L 137 -5.377 92.466 18.196 1.00 17.09 C
+ATOM 14991 HA PRO L 137 -3.741 91.570 20.848 1.00 0.00 H
+ATOM 14992 1HB PRO L 137 -2.944 94.035 19.928 1.00 0.00 H
+ATOM 14993 2HB PRO L 137 -2.616 92.548 19.063 1.00 0.00 H
+ATOM 14994 1HG PRO L 137 -4.772 94.565 18.510 1.00 0.00 H
+ATOM 14995 2HG PRO L 137 -3.778 93.695 17.355 1.00 0.00 H
+ATOM 14996 1HD PRO L 137 -6.368 92.899 18.029 1.00 0.00 H
+ATOM 14997 2HD PRO L 137 -5.080 91.759 17.415 1.00 0.00 H
+ATOM 14998 N THR L 138 -4.554 93.309 22.580 1.00 19.00 N
+ATOM 14999 CA THR L 138 -5.281 94.044 23.590 1.00 17.74 C
+ATOM 15000 C THR L 138 -4.383 94.990 24.333 1.00 17.37 C
+ATOM 15001 O THR L 138 -3.205 94.696 24.551 1.00 18.95 O
+ATOM 15002 CB THR L 138 -5.989 93.090 24.576 1.00 17.66 C
+ATOM 15003 OG1 THR L 138 -5.014 92.304 25.253 1.00 18.33 O
+ATOM 15004 CG2 THR L 138 -6.957 92.145 23.840 1.00 16.51 C
+ATOM 15005 H THR L 138 -3.642 92.885 22.760 1.00 0.00 H
+ATOM 15006 HA THR L 138 -6.051 94.649 23.106 1.00 0.00 H
+ATOM 15007 HB THR L 138 -6.538 93.682 25.310 1.00 0.00 H
+ATOM 15008 HG1 THR L 138 -4.987 91.424 24.859 1.00 0.00 H
+ATOM 15009 1HG2 THR L 138 -7.432 91.491 24.563 1.00 0.00 H
+ATOM 15010 2HG2 THR L 138 -7.717 92.722 23.325 1.00 0.00 H
+ATOM 15011 3HG2 THR L 138 -6.424 91.535 23.112 1.00 0.00 H
+ATOM 15012 N PHE L 139 -4.963 96.083 24.798 1.00 16.22 N
+ATOM 15013 CA PHE L 139 -4.245 97.093 25.548 1.00 15.67 C
+ATOM 15014 C PHE L 139 -4.663 97.039 27.001 1.00 15.25 C
+ATOM 15015 O PHE L 139 -5.790 96.638 27.305 1.00 15.17 O
+ATOM 15016 CB PHE L 139 -4.557 98.503 25.017 1.00 15.53 C
+ATOM 15017 CG PHE L 139 -4.156 98.790 23.579 1.00 16.29 C
+ATOM 15018 CD1 PHE L 139 -2.905 99.308 23.275 1.00 17.19 C
+ATOM 15019 CD2 PHE L 139 -5.062 98.581 22.534 1.00 14.25 C
+ATOM 15020 CE1 PHE L 139 -2.564 99.606 21.964 1.00 18.46 C
+ATOM 15021 CE2 PHE L 139 -4.723 98.880 21.227 1.00 18.75 C
+ATOM 15022 CZ PHE L 139 -3.474 99.390 20.944 1.00 17.58 C
+ATOM 15023 H PHE L 139 -5.943 96.243 24.598 1.00 0.00 H
+ATOM 15024 HA PHE L 139 -3.178 96.899 25.479 1.00 0.00 H
+ATOM 15025 1HB PHE L 139 -5.631 98.682 25.106 1.00 0.00 H
+ATOM 15026 2HB PHE L 139 -4.068 99.241 25.657 1.00 0.00 H
+ATOM 15027 HD1 PHE L 139 -2.194 99.482 24.080 1.00 0.00 H
+ATOM 15028 HD2 PHE L 139 -6.055 98.186 22.759 1.00 0.00 H
+ATOM 15029 HE1 PHE L 139 -1.578 100.007 21.737 1.00 0.00 H
+ATOM 15030 HE2 PHE L 139 -5.436 98.711 20.420 1.00 0.00 H
+ATOM 15031 HZ PHE L 139 -3.202 99.617 19.918 1.00 0.00 H
+ATOM 15032 N GLY L 140 -3.785 97.464 27.897 1.00 14.45 N
+ATOM 15033 CA GLY L 140 -4.195 97.561 29.289 1.00 15.75 C
+ATOM 15034 C GLY L 140 -5.057 98.808 29.417 1.00 16.21 C
+ATOM 15035 O GLY L 140 -5.258 99.520 28.437 1.00 16.92 O
+ATOM 15036 H GLY L 140 -2.844 97.713 27.594 1.00 0.00 H
+ATOM 15037 1HA GLY L 140 -4.772 96.685 29.579 1.00 0.00 H
+ATOM 15038 2HA GLY L 140 -3.323 97.621 29.940 1.00 0.00 H
+ATOM 15039 N GLN L 141 -5.537 99.101 30.621 1.00 16.39 N
+ATOM 15040 CA GLN L 141 -6.426 100.246 30.827 1.00 17.80 C
+ATOM 15041 C GLN L 141 -5.740 101.571 30.505 1.00 16.82 C
+ATOM 15042 O GLN L 141 -6.385 102.529 30.072 1.00 16.60 O
+ATOM 15043 CB GLN L 141 -6.931 100.259 32.271 1.00 17.61 C
+ATOM 15044 CG GLN L 141 -7.869 99.108 32.604 1.00 24.77 C
+ATOM 15045 CD GLN L 141 -8.339 99.140 34.051 1.00 34.03 C
+ATOM 15046 OE1 GLN L 141 -7.702 99.750 34.913 1.00 36.20 O
+ATOM 15047 NE2 GLN L 141 -9.454 98.476 34.324 1.00 33.63 N
+ATOM 15048 H GLN L 141 -5.328 98.498 31.400 1.00 0.00 H
+ATOM 15049 HA GLN L 141 -7.280 100.141 30.158 1.00 0.00 H
+ATOM 15050 1HB GLN L 141 -6.080 100.213 32.954 1.00 0.00 H
+ATOM 15051 2HB GLN L 141 -7.459 101.192 32.466 1.00 0.00 H
+ATOM 15052 1HG GLN L 141 -8.742 99.155 31.953 1.00 0.00 H
+ATOM 15053 2HG GLN L 141 -7.333 98.171 32.442 1.00 0.00 H
+ATOM 15054 1HE2 GLN L 141 -9.810 98.459 35.259 1.00 0.00 H
+ATOM 15055 2HE2 GLN L 141 -9.940 97.992 33.596 1.00 0.00 H
+ATOM 15056 N GLY L 142 -4.435 101.603 30.734 1.00 16.60 N
+ATOM 15057 CA GLY L 142 -3.603 102.775 30.522 1.00 16.15 C
+ATOM 15058 C GLY L 142 -3.230 103.386 31.849 1.00 16.56 C
+ATOM 15059 O GLY L 142 -4.035 103.381 32.781 1.00 15.56 O
+ATOM 15060 H GLY L 142 -4.000 100.769 31.082 1.00 0.00 H
+ATOM 15061 1HA GLY L 142 -2.706 102.503 29.971 1.00 0.00 H
+ATOM 15062 2HA GLY L 142 -4.144 103.507 29.926 1.00 0.00 H
+ATOM 15063 N THR L 143 -2.020 103.921 31.936 1.00 18.01 N
+ATOM 15064 CA THR L 143 -1.579 104.562 33.170 1.00 18.53 C
+ATOM 15065 C THR L 143 -1.186 105.981 32.869 1.00 18.47 C
+ATOM 15066 O THR L 143 -0.516 106.229 31.868 1.00 19.17 O
+ATOM 15067 CB THR L 143 -0.354 103.875 33.779 1.00 18.29 C
+ATOM 15068 OG1 THR L 143 0.014 104.545 34.992 1.00 19.27 O
+ATOM 15069 CG2 THR L 143 0.770 103.985 32.834 1.00 19.37 C
+ATOM 15070 H THR L 143 -1.398 103.867 31.129 1.00 0.00 H
+ATOM 15071 HA THR L 143 -2.395 104.556 33.884 1.00 0.00 H
+ATOM 15072 HB THR L 143 -0.573 102.819 33.997 1.00 0.00 H
+ATOM 15073 HG1 THR L 143 -0.059 105.492 34.869 1.00 0.00 H
+ATOM 15074 1HG2 THR L 143 1.622 103.523 33.280 1.00 0.00 H
+ATOM 15075 2HG2 THR L 143 0.513 103.483 31.905 1.00 0.00 H
+ATOM 15076 3HG2 THR L 143 0.990 105.028 32.632 1.00 0.00 H
+ATOM 15077 N LYS L 144 -1.514 106.919 33.739 1.00 18.35 N
+ATOM 15078 CA LYS L 144 -1.123 108.298 33.438 1.00 18.25 C
+ATOM 15079 C LYS L 144 -0.098 108.855 34.411 1.00 17.63 C
+ATOM 15080 O LYS L 144 -0.327 108.913 35.628 1.00 18.49 O
+ATOM 15081 CB LYS L 144 -2.369 109.178 33.311 1.00 18.39 C
+ATOM 15082 CG LYS L 144 -2.118 110.614 32.779 1.00 22.50 C
+ATOM 15083 CD LYS L 144 -2.257 111.685 33.858 1.00 24.67 C
+ATOM 15084 CE LYS L 144 -3.751 111.894 34.204 1.00 24.70 C
+ATOM 15085 NZ LYS L 144 -3.991 113.022 35.167 1.00 22.87 N
+ATOM 15086 H LYS L 144 -2.087 106.671 34.552 1.00 0.00 H
+ATOM 15087 HA LYS L 144 -0.641 108.310 32.461 1.00 0.00 H
+ATOM 15088 1HB LYS L 144 -3.077 108.693 32.634 1.00 0.00 H
+ATOM 15089 2HB LYS L 144 -2.854 109.256 34.286 1.00 0.00 H
+ATOM 15090 1HG LYS L 144 -1.104 110.674 32.361 1.00 0.00 H
+ATOM 15091 2HG LYS L 144 -2.823 110.831 31.977 1.00 0.00 H
+ATOM 15092 1HD LYS L 144 -1.720 111.372 34.750 1.00 0.00 H
+ATOM 15093 2HD LYS L 144 -1.827 112.623 33.504 1.00 0.00 H
+ATOM 15094 1HE LYS L 144 -4.297 112.095 33.283 1.00 0.00 H
+ATOM 15095 2HE LYS L 144 -4.133 110.975 34.648 1.00 0.00 H
+ATOM 15096 1HZ LYS L 144 -4.979 113.098 35.350 1.00 0.00 H
+ATOM 15097 2HZ LYS L 144 -3.500 112.868 36.061 1.00 0.00 H
+ATOM 15098 3HZ LYS L 144 -3.664 113.884 34.772 1.00 0.00 H
+ATOM 15099 N VAL L 145 1.059 109.224 33.869 1.00 16.91 N
+ATOM 15100 CA VAL L 145 2.146 109.748 34.680 1.00 14.99 C
+ATOM 15101 C VAL L 145 2.040 111.255 34.814 1.00 15.85 C
+ATOM 15102 O VAL L 145 2.016 111.972 33.810 1.00 16.40 O
+ATOM 15103 CB VAL L 145 3.520 109.389 34.063 1.00 14.45 C
+ATOM 15104 CG1 VAL L 145 4.656 110.015 34.894 1.00 11.69 C
+ATOM 15105 CG2 VAL L 145 3.682 107.868 34.000 1.00 15.19 C
+ATOM 15106 H VAL L 145 1.176 109.161 32.852 1.00 0.00 H
+ATOM 15107 HA VAL L 145 2.084 109.307 35.675 1.00 0.00 H
+ATOM 15108 HB VAL L 145 3.575 109.803 33.058 1.00 0.00 H
+ATOM 15109 1HG1 VAL L 145 5.616 109.767 34.447 1.00 0.00 H
+ATOM 15110 2HG1 VAL L 145 4.541 111.099 34.923 1.00 0.00 H
+ATOM 15111 3HG1 VAL L 145 4.622 109.638 35.905 1.00 0.00 H
+ATOM 15112 1HG2 VAL L 145 4.647 107.625 33.552 1.00 0.00 H
+ATOM 15113 2HG2 VAL L 145 3.636 107.457 34.993 1.00 0.00 H
+ATOM 15114 3HG2 VAL L 145 2.884 107.436 33.399 1.00 0.00 H
+ATOM 15115 N GLU L 146 1.984 111.732 36.049 1.00 15.50 N
+ATOM 15116 CA GLU L 146 1.909 113.158 36.326 1.00 17.57 C
+ATOM 15117 C GLU L 146 3.293 113.623 36.730 1.00 16.96 C
+ATOM 15118 O GLU L 146 4.043 112.857 37.332 1.00 16.92 O
+ATOM 15119 CB GLU L 146 0.879 113.445 37.415 1.00 18.30 C
+ATOM 15120 CG GLU L 146 -0.530 113.069 37.001 1.00 25.15 C
+ATOM 15121 CD GLU L 146 -1.576 113.386 38.018 1.00 33.01 C
+ATOM 15122 OE1 GLU L 146 -1.237 113.876 39.067 1.00 33.22 O
+ATOM 15123 OE2 GLU L 146 -2.739 113.158 37.730 1.00 36.90 O
+ATOM 15124 H GLU L 146 1.987 111.070 36.826 1.00 0.00 H
+ATOM 15125 HA GLU L 146 1.613 113.683 35.421 1.00 0.00 H
+ATOM 15126 1HB GLU L 146 1.135 112.885 38.316 1.00 0.00 H
+ATOM 15127 2HB GLU L 146 0.891 114.505 37.669 1.00 0.00 H
+ATOM 15128 1HG GLU L 146 -0.772 113.589 36.081 1.00 0.00 H
+ATOM 15129 2HG GLU L 146 -0.546 112.000 36.798 1.00 0.00 H
+ATOM 15130 N ILE L 147 3.634 114.864 36.397 1.00 17.11 N
+ATOM 15131 CA ILE L 147 4.965 115.337 36.733 1.00 16.64 C
+ATOM 15132 C ILE L 147 4.954 116.446 37.773 1.00 16.23 C
+ATOM 15133 O ILE L 147 4.277 117.466 37.612 1.00 16.84 O
+ATOM 15134 CB ILE L 147 5.742 115.745 35.469 1.00 16.80 C
+ATOM 15135 CG1 ILE L 147 5.827 114.532 34.559 1.00 19.77 C
+ATOM 15136 CG2 ILE L 147 7.130 116.208 35.833 1.00 16.41 C
+ATOM 15137 CD1 ILE L 147 6.511 114.755 33.281 1.00 22.75 C
+ATOM 15138 H ILE L 147 2.985 115.468 35.919 1.00 0.00 H
+ATOM 15139 HA ILE L 147 5.518 114.509 37.156 1.00 0.00 H
+ATOM 15140 HB ILE L 147 5.212 116.541 34.940 1.00 0.00 H
+ATOM 15141 1HG1 ILE L 147 6.331 113.781 35.075 1.00 0.00 H
+ATOM 15142 2HG1 ILE L 147 4.821 114.189 34.332 1.00 0.00 H
+ATOM 15143 1HG2 ILE L 147 7.663 116.472 34.924 1.00 0.00 H
+ATOM 15144 2HG2 ILE L 147 7.066 117.079 36.488 1.00 0.00 H
+ATOM 15145 3HG2 ILE L 147 7.663 115.404 36.351 1.00 0.00 H
+ATOM 15146 1HD1 ILE L 147 6.531 113.823 32.712 1.00 0.00 H
+ATOM 15147 2HD1 ILE L 147 6.007 115.521 32.705 1.00 0.00 H
+ATOM 15148 3HD1 ILE L 147 7.526 115.071 33.490 1.00 0.00 H
+ATOM 15149 N LYS L 148 5.682 116.188 38.854 1.00 15.64 N
+ATOM 15150 CA LYS L 148 5.806 117.087 39.982 1.00 15.93 C
+ATOM 15151 C LYS L 148 7.174 117.772 39.886 1.00 14.55 C
+ATOM 15152 O LYS L 148 7.617 118.096 38.812 1.00 14.92 O
+ATOM 15153 OXT LYS L 148 7.959 117.497 40.808 1.00 0.00 O
+ATOM 15154 CB LYS L 148 5.687 116.324 41.310 1.00 16.17 C
+ATOM 15155 CG LYS L 148 4.366 115.549 41.514 1.00 19.62 C
+ATOM 15156 CD LYS L 148 4.226 114.995 42.961 1.00 23.99 C
+ATOM 15157 CE LYS L 148 5.226 113.858 43.258 1.00 24.82 C
+ATOM 15158 NZ LYS L 148 5.061 113.310 44.651 1.00 23.33 N
+ATOM 15159 H LYS L 148 6.187 115.311 38.890 1.00 0.00 H
+ATOM 15160 HA LYS L 148 5.003 117.830 39.939 1.00 0.00 H
+ATOM 15161 1HB LYS L 148 6.492 115.609 41.387 1.00 0.00 H
+ATOM 15162 2HB LYS L 148 5.800 117.026 42.145 1.00 0.00 H
+ATOM 15163 1HG LYS L 148 3.512 116.189 41.286 1.00 0.00 H
+ATOM 15164 2HG LYS L 148 4.362 114.703 40.825 1.00 0.00 H
+ATOM 15165 1HD LYS L 148 4.387 115.799 43.687 1.00 0.00 H
+ATOM 15166 2HD LYS L 148 3.209 114.606 43.095 1.00 0.00 H
+ATOM 15167 1HE LYS L 148 5.082 113.042 42.546 1.00 0.00 H
+ATOM 15168 2HE LYS L 148 6.239 114.247 43.150 1.00 0.00 H
+ATOM 15169 1HZ LYS L 148 5.739 112.578 44.802 1.00 0.00 H
+ATOM 15170 2HZ LYS L 148 5.207 114.051 45.323 1.00 0.00 H
+ATOM 15171 3HZ LYS L 148 4.134 112.930 44.766 1.00 0.00 H
+TER
+# All scores below are weighted scores, not raw scores.
+#BEGIN_POSE_ENERGIES_TABLE ./data/my_lab_test.pdb
+label fa_atr fa_rep fa_sol fa_intra_rep fa_intra_sol_xover4 lk_ball_wtd fa_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun p_aa_pp yhh_planarity ref rama_prepro cart_bonded total
+weights 1 0.55 1 0.005 1 1 1 1 1 1 1 1.25 0.4 0.7 0.6 0.625 1 0.45 0.625 NA
+pose -5654.74 495.129 3291.37 12.2576 172.049 -107.377 -1934.17 -81.9146 -632.469 -264.187 -167.168 -1.67611 27.5193 1205.53 -260.323 0.81241 372.765 -26.6532 879.941 -2673.3
+SER:NtermProteinFull_1 -1.65117 0.03437 2.42876 0.00246 0.07368 -0.2954 -0.83076 0 0 0 0 0 -0.09319 0.20155 0 0 -0.28969 0 0.01817 -0.40122
+ASP_2 -3.60767 0.1151 4.12482 0.00364 0.25496 -0.27358 -3.91818 0 0 0 -0.62019 0 -0.01825 1.48731 0.0448 0 -2.14574 -0.19095 0.14225 -4.60169
+PHE_3 -8.3982 0.95428 2.13867 0.02584 0.49168 -0.25855 -1.36855 0 0 -0.62068 0 0 -0.00934 1.21674 -0.48343 0 1.21829 -0.27105 0.28575 -5.07856
+VAL_4 -6.99418 0.44216 1.11932 0.02038 0.05273 0.14948 -2.06264 0 0 0 0 0 -0.02102 0.02332 -0.39901 0 2.64269 -0.26226 0.21943 -5.06961
+VAL_5 -8.06947 1.17573 1.54727 0.02052 0.04903 0.21271 -2.25728 0 0 0 0 0 -0.04725 0.02318 -0.73232 0 2.64269 -0.36319 0.25068 -5.5477
+ILE_6 -8.08432 0.8271 0.40652 0.02587 0.0818 0.0575 -2.20073 0 0 0 0 0 -0.03218 0.28975 -0.69275 0 2.30374 -0.32191 0.33871 -7.00089
+LYS_7 -8.50352 0.62301 6.66748 0.01977 0.23824 0.53583 -5.87019 0 0 -0.36563 -0.87486 0 -0.06027 1.26491 0.36443 0 -0.71458 -0.01437 0.50617 -6.18357
+ALA_8 -6.65261 0.6134 1.97673 0.0018 0 -0.06329 -2.40378 0 0 0 0 0 0.01212 0 0.27279 0 1.32468 0.06071 0.50231 -4.35514
+LEU_9 -6.67884 0.68917 2.9713 0.02317 0.08944 -0.45317 -1.18817 0 0 0 0 0 0.10576 0.04937 -0.11447 0 1.66147 -0.22818 0.42464 -2.64851
+GLU_10 -5.85639 0.39778 5.04713 0.00721 0.3761 -0.10283 -1.86354 0 0 -0.84254 0 0 0.00546 2.52893 0.0682 0 -2.72453 -0.08302 0.46354 -2.5785
+ASP_11 -3.19489 0.1708 3.31906 0.00302 0.26794 -0.0982 -2.47468 0 0 -0.89103 0 0 0.08388 1.59532 0.06707 0 -2.14574 -0.1583 0.42876 -3.027
+GLY_12 -1.68004 0.04873 1.87454 8e-05 0 0.00731 -0.75095 0 0 0 0 0 -0.13709 0 -1.502 0 0.79816 -0.2789 0.39864 -1.22152
+VAL_13 -7.79241 0.98865 1.73558 0.01564 0.0388 0.0181 -2.25678 0 0 0 0 0 0.15656 0.14135 -0.30555 0 2.64269 -0.25918 0.47881 -4.39775
+ASN_14 -6.42302 0.28739 5.77586 0.01125 0.46081 0.19519 -2.81792 0 0 0 -0.86425 0 -0.04952 3.42095 -0.01989 0 -1.34026 -0.09303 0.44954 -1.0069
+VAL_15 -6.75923 0.53296 1.20303 0.0168 0.04365 -0.05927 -2.08497 0 0 0 0 0 0.13449 0.04084 -0.60782 0 2.64269 -0.04821 0.28342 -4.66161
+ILE_16 -7.54633 0.82287 3.20743 0.03069 0.07454 -0.0308 -2.15553 0 0 0 0 0 0.01809 0.30636 -0.7725 0 2.30374 -0.39637 0.29277 -3.84503
+GLY_17 -4.27722 0.27936 2.92857 2e-05 0 -0.0063 -3.08573 0 0 0 0 0 -0.06886 0 1.1537 0 0.79816 0.58652 0.24531 -1.44646
+LEU_18 -8.16257 0.68776 2.99501 0.01733 0.07327 -0.1666 -2.90409 0 0 0 0 0 0.36993 1.90792 -0.32103 0 1.66147 0.76646 0.31737 -2.75778
+THR_19 -5.75258 0.61567 4.76347 0.00618 0.09506 -0.04108 -2.07508 0 0 -0.71988 0 0 0.13649 0.57355 0.28557 0 1.15175 -0.11271 0.95529 -0.11828
+ARG_20 -7.68156 0.31849 7.90881 0.01482 0.50233 0.17014 -4.45655 0 0 -0.94675 -1.19543 0 -0.0382 2.06534 -0.01097 0 -0.09474 -0.15447 1.06671 -2.53201
+GLY_21 -2.0376 0.16847 1.881 0.0001 0 -0.37776 0.28445 0 0 0 0 0 -0.09232 0 -1.51751 0 0.79816 0.27566 0.32839 -0.28896
+ALA_22 -2.08812 0.0788 1.77288 0.00142 0 -0.29398 0.47819 0 0 0 0 0 -0.04248 0 -0.34089 0 1.32468 0.06907 0.07403 1.03361
+ASP_23 -1.83703 0.13831 2.2522 0.00351 0.29183 -0.34242 -0.38313 0 0 0 0 0 -0.05091 2.79602 -0.16759 0 -2.14574 -0.2936 0.13388 0.39532
+THR_24 -3.43656 0.1591 2.19459 0.01085 0.06074 -0.52205 -0.20495 0 0 0 0 0 -0.01019 0.03527 0.11685 0 1.15175 0.06065 0.1834 -0.20056
+ARG_25 -5.19064 0.37929 4.66837 0.01902 0.63411 -0.06363 -1.91172 0 0 -0.71988 0 0 -0.0035 5.29608 -0.07376 0 -0.09474 0.03888 0.76815 3.746
+PHE_26 -4.61511 0.64399 2.24988 0.02642 0.54087 -0.21418 -0.53233 0 0 0 0 0 0.01073 2.95777 -0.11852 0 1.21829 -0.15554 0.90637 2.91864
+HIS_27 -6.29635 0.29742 4.60581 0.00697 0.76486 -0.44544 -0.43512 0 0 0 -0.96714 0 0.02372 3.01 -0.45253 0 -0.30065 0.12524 0.40427 0.34107
+HIS_28 -6.67519 0.39947 5.75007 0.00511 0.32552 -0.20315 -1.7547 0 0 0 -0.93352 0 -0.01741 1.50659 -0.43841 0 -0.30065 0.27957 0.32372 -1.73298
+SER_29 -2.97961 0.10146 2.72685 0.0022 0.07077 -0.12669 -0.52771 0 0 0 -0.86425 0 -0.04091 0.20898 0.20814 0 -0.28969 0.36725 0.28965 -0.85355
+GLU_30 -5.86374 0.25155 6.41282 0.00882 0.52706 0.51484 -4.83593 0 0 0 -1.72661 0 -0.03197 3.86807 0.30393 0 -2.72453 0.43726 0.25675 -2.60166
+LYS_31 -2.63824 0.20868 2.56838 0.01139 0.29032 -0.09912 -1.20199 0 0 0 0 0 0.02227 2.68194 0.02048 0 -0.71458 0.01598 0.20374 1.36925
+LEU_32 -8.3678 0.84931 3.21497 0.01258 0.05131 0.18329 -3.04995 0 0 0 0 0 0.21329 0.23212 -0.03042 0 1.66147 -0.09521 0.28269 -4.84235
+ASP_33 -4.42361 0.2758 4.92213 0.00312 0.26255 -0.08317 -3.16978 0 0 -0.81632 0 0 0.03076 1.96636 0.17528 0 -2.14574 -0.00038 0.51991 -2.48308
+LYS_34 -5.26781 0.37609 4.42566 0.00854 0.1455 -0.48354 -1.95968 0 0 -0.89103 0 0 -0.09052 1.06312 -0.00704 0 -0.71458 -0.18521 0.3581 -3.22239
+GLY_35 -4.03902 0.1719 3.35057 8e-05 0 0.12881 -1.99712 0 0 0 0 0 -0.13 0 -1.49001 0 0.79816 -0.54494 0.29272 -3.45886
+GLU_36 -7.68483 0.40578 8.41079 0.00418 0.20668 0.097 -6.22151 0 0 -0.81632 -1.12593 0 -0.00834 3.23777 -0.04114 0 -2.72453 -0.52283 0.37452 -6.4087
+VAL_37 -7.42583 0.6252 1.48116 0.01838 0.04356 0.07497 -1.93908 0 0 0 0 0 -0.01726 0.08562 -0.78756 0 2.64269 -0.3792 0.23178 -5.34559
+LEU_38 -7.39307 0.48841 1.4823 0.01661 0.09765 0.02667 -2.16169 0 0 0 0 0 0.00284 0.4234 -0.23999 0 1.66147 -0.14674 0.18111 -5.56102
+ILE_39 -8.3305 1.2175 0.61191 0.02327 0.07364 0.16957 -2.31492 0 0 0 0 0 0.26413 0.38533 -0.70154 0 2.30374 -0.13104 0.71679 -5.71212
+ALA_40 -4.62005 0.47006 1.80984 0.00157 0 0.13454 -2.08522 0 0 0 0 0 0.00513 0 -0.13836 0 1.32468 -0.03998 0.91532 -2.22247
+GLN_41 -7.23284 0.53389 5.10929 0.00821 0.20502 -0.34546 -2.93953 0 0 0 -0.63221 0 0.30829 2.48604 -0.09159 0 -1.45095 0.03959 0.60729 -3.39498
+PHE_42 -8.31732 0.7175 2.01406 0.02199 0.24679 -0.80736 -1.35646 0 0 0 0 0 0.41698 1.62294 -0.21416 0 1.21829 -0.26646 0.74403 -3.95917
+THR_43 -6.09428 0.50755 6.27629 0.00694 0.07707 -0.09908 -2.66175 0 0 -2.90904 0 0 0.15259 0.30741 -0.74073 0 1.15175 -0.21424 0.64398 -3.59554
+GLU_44 -3.82826 0.24992 3.85312 0.01245 1.28706 -0.37837 -0.87212 0 0 0 0 0 0.03683 2.86912 -0.22008 0 -2.72453 -0.14215 0.41003 0.55302
+HIS_45 -6.15573 0.72968 5.33002 0.00305 0.3774 -0.88741 -1.35832 0 0 -1.05566 0 0 0.04706 2.24339 -0.30436 0 -0.30065 0.14842 0.36679 -0.81632
+THR_46 -6.94861 0.15625 5.23512 0.01245 0.0674 0.08499 -1.45198 0 0 -0.90664 -0.96714 0 -0.04022 0.02826 0.13297 0 1.15175 0.38247 0.42639 -2.63655
+SER_47 -5.47059 0.25141 4.58887 0.00217 0.05457 -0.15809 -1.82516 0 0 0 0 0 0.03832 0.21767 -0.02778 0 -0.28969 0.15723 0.33686 -2.12422
+ALA_48 -5.76249 0.6762 1.71702 0.00119 0 0.12368 -1.78241 0 0 0 0 0 -0.0067 0 -0.47415 0 1.32468 0.02502 0.21198 -3.946
+ILE_49 -7.2792 0.52857 1.3254 0.02313 0.06793 -0.00823 -2.39058 0 0 0 0 0 -0.06243 0.17281 -0.71801 0 2.30374 -0.15553 0.20115 -5.99124
+LYS_50 -7.69282 0.56097 5.90926 0.00864 0.14412 -0.01374 -5.42496 0 0 0 -0.55993 0 -0.00265 1.27769 0.28558 0 -0.71458 -0.1629 0.28055 -6.10477
+VAL_51 -6.87363 0.59452 0.76748 0.01828 0.04079 -0.08106 -1.90622 0 0 0 0 0 -0.06301 0.18676 -0.79203 0 2.64269 -0.19714 0.35467 -5.30788
+ARG_52 -5.2206 0.33588 4.12636 0.01445 0.35508 0.31004 -2.75424 0 0 0 0 0 -0.02842 2.17715 0.00948 0 -0.09474 -0.23071 0.44124 -0.55902
+GLY_53 -3.28108 0.11411 2.98938 0.0001 0 -0.17738 -1.39686 0 0 0 0 0 0.06857 0 -1.48786 0 0.79816 0.06281 0.41742 -1.89261
+LYS_54 -6.78619 1.00743 6.28415 0.01245 0.24982 0.21042 -5.02562 0 0 -0.84254 -0.62838 0 -0.05972 4.04221 0.10177 0 -0.71458 0.09132 0.41483 -1.64263
+ALA_55 -6.46092 0.61385 2.78252 0.0013 0 0.21452 -1.85945 0 0 0 0 0 -0.01911 0 -0.27967 0 1.32468 0.14804 0.42005 -3.11419
+TYR_56 -6.95403 0.52291 3.45912 0.02137 0.09029 0.14595 -2.29787 0 0 0 0 0 -0.03427 2.16772 0.02638 0.00013 0.58223 0.03895 0.39115 -1.83998
+ILE_57 -9.00167 1.24678 1.7152 0.0358 0.07552 0.05833 -2.1217 0 0 0 0 0 0.00711 0.25531 -0.73395 0 2.30374 -0.28422 0.47126 -5.97248
+GLN_58 -8.95862 0.80539 5.4658 0.00832 0.24941 0.0949 -3.74779 0 0 -0.6293 0 0 0.01741 2.99179 0.22727 0 -1.45095 -0.19546 0.54138 -4.58046
+THR_59 -6.88459 0.72872 3.64809 0.01121 0.08118 -0.36733 -0.94025 0 0 -0.9374 0 0 -0.01505 0.62084 -0.62768 0 1.15175 -0.13803 0.63369 -3.03485
+ARG_60 -4.99815 0.27248 4.90175 0.01573 0.66396 -0.54732 -1.36903 0 0 0 -0.62019 0 -0.02995 3.74609 -0.09111 0 -0.09474 -0.31046 0.73376 2.27283
+HIS_61 -6.95559 0.53899 4.7748 0.00655 0.48246 -0.72717 -0.76935 0 0 -1.42183 0 0 -0.01855 2.9044 -0.30388 0 -0.30065 -0.49274 0.60355 -1.67901
+GLY_62 -2.42439 0.17606 2.76689 8e-05 0 -0.07203 -1.30986 0 0 0 0 0 -0.0989 0 -1.51782 0 0.79816 0.32929 0.25887 -1.09364
+VAL_63 -3.96046 0.33555 1.43873 0.02063 0.05287 0.12871 -1.17898 0 0 -0.47911 0 0 -0.01396 0.01833 -0.36743 0 2.64269 0.4511 0.19003 -0.7213
+ILE_64 -6.95595 0.83375 1.68131 0.02726 0.08144 0.11176 -1.47703 0 0 0 0 0 -0.00693 2.12017 0.14135 0 2.30374 -0.05979 0.40076 -0.79814
+GLU_65 -3.96838 0.36137 3.06958 0.00573 0.27641 0.03248 -1.97692 0 0 -0.40177 0 0 -0.00798 2.83944 0.36269 0 -2.72453 0.2663 0.35812 -1.50746
+SER_66 -6.08609 0.65835 5.34343 0.00172 0.07697 -0.05936 -2.72837 0 0 0 0 0 0.06517 0.47661 -0.13486 0 -0.28969 0.03585 0.25317 -2.38709
+GLU:CtermProteinFull_67 -5.35873 0.50103 7.27526 0.00761 0.36646 0.12813 -5.53524 0 0 0 -1.44297 0 0 4.08958 0 0 -2.72453 -0.11446 0.56896 -2.2389
+SER:NtermProteinFull_68 -1.44858 0.01054 2.20416 0.00249 0.0529 -0.27539 -0.80971 0 0 0 0 0 0.04859 0.47972 0 0 -0.28969 0 0.04275 0.01778
+ASP_69 -4.03614 0.17318 4.30639 0.00691 0.29016 -0.20781 -3.86102 0 0 0 0 0 -0.01812 1.48883 0.03623 0 -2.14574 -0.17961 0.39797 -3.74875
+PHE_70 -8.91846 1.18367 2.63844 0.02995 0.54013 -0.13076 -1.42039 0 0 -0.48443 0 0 -0.007 1.1694 -0.51829 0 1.21829 -0.24821 0.52913 -4.41853
+VAL_71 -6.87485 0.48222 0.82732 0.0244 0.05496 0.05548 -2.08331 0 0 0 0 0 -0.01897 0.06732 -0.36083 0 2.64269 -0.24514 0.29657 -5.13215
+VAL_72 -7.46569 0.97182 1.522 0.01931 0.0471 0.22322 -2.26829 0 0 0 0 0 -0.0481 0.08544 -0.7373 0 2.64269 -0.36438 0.37528 -4.99691
+ILE_73 -7.87521 0.86883 0.36151 0.02526 0.07689 0.01435 -2.15713 0 0 0 0 0 -0.03202 0.21008 -0.6784 0 2.30374 -0.33061 0.44272 -6.77
+LYS_74 -8.28109 0.5846 6.56554 0.01807 0.21136 0.46312 -5.85467 0 0 -0.40177 -0.81459 0 -0.0589 1.21094 0.35014 0 -0.71458 -0.04279 0.56181 -6.20281
+ALA_75 -6.49679 0.59756 1.88263 0.00178 0 -0.1892 -2.2704 0 0 0 0 0 0.02487 0 0.17809 0 1.32468 -0.09811 0.53376 -4.51113
+LEU_76 -6.22738 0.44492 2.7125 0.02215 0.09318 -0.41688 -1.09605 0 0 0 0 0 0.01076 0.05845 -0.12941 0 1.66147 -0.34333 0.29284 -2.9168
+GLU_77 -6.31044 0.39826 5.69293 0.00833 0.38604 -0.26309 -1.95913 0 0 -0.87669 0 0 -0.00389 2.43422 0.14193 0 -2.72453 -0.05805 0.29935 -2.83476
+ASP_78 -3.46784 0.25649 3.5895 0.00381 0.28442 -0.17218 -2.66113 0 0 -0.88801 0 0 0.0854 1.71487 0.09301 0 -2.14574 -0.09968 0.34563 -3.06143
+GLY_79 -2.13849 0.02946 2.55512 9e-05 0 -0.21459 -0.55384 0 0 0 0 0 -0.11873 0 -1.48097 0 0.79816 -0.19618 0.32426 -0.99571
+VAL_80 -8.223 1.01109 2.4009 0.01636 0.03947 0.05942 -2.32396 0 0 0 0 0 0.02753 0.1798 -0.31162 0 2.64269 -0.22274 0.4386 -4.26547
+ASN_81 -5.99841 0.3837 4.92722 0.00425 0.26327 -0.32283 -2.28817 0 0 0 0 0 0.02179 2.16596 0.1842 0 -1.34026 -0.06638 0.42017 -1.64549
+VAL_82 -6.50038 0.50939 0.83959 0.01818 0.0452 0.09881 -2.09669 0 0 0 0 0 0.34213 0.01216 -0.52686 0 2.64269 0.0101 0.38371 -4.22198
+ILE_83 -8.41509 0.88923 2.6532 0.03311 0.07612 0.05402 -2.38387 0 0 0 0 0 0.0123 0.30368 -0.76746 0 2.30374 -0.37244 0.45494 -5.15852
+GLY_84 -4.15494 0.28299 2.76537 3e-05 0 -0.11 -2.48906 0 0 0 0 0 -0.04497 0 0.996 0 0.79816 0.41159 0.3138 -1.23104
+LEU_85 -8.88664 0.81391 2.68301 0.01793 0.07382 -0.23218 -3.23279 0 0 0 0 0 0.35297 1.87307 -0.3163 0 1.66147 0.61774 0.34047 -4.23353
+THR_86 -6.41149 0.66859 5.31799 0.0053 0.09305 0.05267 -3.55767 0 0 -1.31793 0 0 -0.00372 0.75609 0.24442 0 1.15175 -0.11521 0.95871 -2.15744
+ARG_87 -7.20739 0.37127 7.02365 0.01602 0.52136 -0.21993 -3.23273 0 0 -0.94714 -0.59173 0 -0.02232 2.18072 -0.03186 0 -0.09474 -0.19125 0.90088 -1.52519
+GLY_88 -2.10143 0.24798 1.91053 0.00011 0 -0.39615 0.347 0 0 0 0 0 -0.01661 0 -1.51785 0 0.79816 0.28706 0.17654 -0.26465
+ALA_89 -2.06936 0.06038 1.80668 0.00141 0 -0.22984 0.48171 0 0 0 0 0 -0.05867 0 -0.35325 0 1.32468 0.07495 0.04508 1.08377
+ASP_90 -1.9568 0.16527 2.48717 0.00374 0.30894 -0.1995 -0.79269 0 0 -0.50875 0 0 -0.00184 3.00948 -0.2767 0 -2.14574 -0.32979 0.0803 -0.1569
+THR_91 -3.97019 0.32318 2.41129 0.01232 0.05912 -0.40457 -0.91237 0 0 0 0 0 -0.04156 0.06007 0.01656 0 1.15175 0.03086 0.17514 -1.0884
+ARG_92 -5.40721 0.37079 4.57005 0.01659 0.485 0.04195 -2.3735 0 0 -1.21174 0 0 0.0206 1.28491 -0.05942 0 -0.09474 0.09739 0.46607 -1.79323
+PHE_93 -5.66202 0.50964 1.29794 0.05046 0.2409 -0.01608 -0.8133 0 0 -0.40255 0 0 0.03082 3.42593 -0.07699 0 1.21829 -0.15594 0.53836 0.18545
+HIS_94 -5.69464 0.26173 4.44052 0.00681 0.78441 -0.44994 -0.44728 0 0 0 -0.92606 0 0.01242 2.98783 -0.46505 0 -0.30065 0.06047 0.31586 0.58645
+HIS_95 -6.05057 0.35377 5.50738 0.00454 0.3242 -0.21753 -1.45898 0 0 0 -0.81943 0 0.0453 1.42361 -0.53743 0 -0.30065 0.46833 0.20273 -1.05473
+SER_96 -3.15541 0.15551 2.44891 0.00183 0.02913 -0.32201 -0.374 0 0 0 0 0 -0.04848 1.00544 0.24553 0 -0.28969 0.50916 0.17936 0.38527
+GLU_97 -6.04279 0.21351 6.09178 0.00869 0.58937 0.47196 -4.43494 0 0 0 -1.37936 0 -0.03047 3.41986 0.26836 0 -2.72453 0.37339 0.17504 -3.00014
+LYS_98 -3.19691 0.29358 2.96984 0.00746 0.12288 -0.28698 -1.1644 0 0 0 0 0 0.081 1.24744 0.01879 0 -0.71458 -0.04697 0.22983 -0.43901
+LEU_99 -8.70197 0.749 3.13396 0.01177 0.05338 0.05733 -3.00587 0 0 0 0 0 0.24896 0.2806 -0.11638 0 1.66147 -0.15183 0.37317 -5.40641
+ASP_100 -4.87949 0.46184 5.42531 0.00526 0.2576 -0.15888 -3.4625 0 0 -0.82148 0 0 0.19671 2.13271 0.16748 0 -2.14574 0.0252 0.59342 -2.20257
+LYS_101 -5.18081 0.33875 4.39052 0.00855 0.14316 -0.51973 -1.77089 0 0 -0.88801 0 0 -0.09427 1.01334 -0.01136 0 -0.71458 -0.11744 0.40619 -2.99657
+GLY_102 -3.9241 0.21559 3.41353 7e-05 0 -0.01696 -1.98678 0 0 0 0 0 -0.14067 0 -1.48938 0 0.79816 -0.52397 0.28126 -3.37326
+GLU_103 -6.98605 0.33928 7.02055 0.0046 0.21548 -0.23685 -4.55294 0 0 -0.82148 0 0 0.02691 3.09325 -0.04039 0 -2.72453 -0.50906 0.36922 -4.80202
+VAL_104 -7.33188 0.55818 1.29656 0.01808 0.04362 0.02667 -1.96077 0 0 0 0 0 -0.01772 0.10475 -0.79306 0 2.64269 -0.36453 0.24259 -5.53482
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+ILE_106 -8.12699 1.21395 0.65812 0.02643 0.07679 0.15559 -2.25131 0 0 0 0 0 0.17947 0.31035 -0.7433 0 2.30374 -0.15197 0.60856 -5.74058
+ALA_107 -4.6209 0.49047 1.83101 0.00168 0 0.17131 -2.1249 0 0 0 0 0 -0.01294 0 -0.13503 0 1.32468 -0.06078 0.84359 -2.29181
+GLN_108 -6.89203 0.62729 4.82372 0.00784 0.19068 -0.39851 -2.83052 0 0 0 -0.48472 0 0.22561 2.53352 -0.09332 0 -1.45095 0.04331 0.58587 -3.11221
+PHE_109 -8.26133 0.58246 1.932 0.02209 0.24218 -0.69454 -1.13895 0 0 0 0 0 0.47087 1.7272 -0.14727 0 1.21829 -0.30418 0.7579 -3.59328
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+GLU_111 -3.87933 0.24106 4.2887 0.01271 1.13282 -0.14438 -1.77782 0 0 0 -0.71071 0 -0.09591 4.95045 -0.28819 0 -2.72453 -0.2756 0.42587 1.15515
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+THR_113 -6.92789 0.18692 5.31022 0.01164 0.06529 -0.08902 -1.19286 0 0 -0.7164 -0.92606 0 -0.05103 0.01672 0.11361 0 1.15175 0.30985 0.35891 -2.37836
+SER_114 -5.41555 0.23573 4.58622 0.00196 0.05322 -0.28724 -2.02044 0 0 0 0 0 0.02634 0.21637 -0.01645 0 -0.28969 0.14293 0.3265 -2.44009
+ALA_115 -5.70048 0.66805 1.71456 0.0012 0 0.11354 -1.47028 0 0 0 0 0 -0.00338 0 -0.48751 0 1.32468 0.02544 0.26852 -3.54566
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+LYS_117 -8.74605 0.64732 7.36954 0.00953 0.14151 -0.05652 -5.37462 0 0 0 -0.43972 0 0.02004 1.45981 0.27127 0 -0.71458 -0.18185 0.29856 -5.29576
+VAL_118 -6.55744 0.50352 0.84025 0.01793 0.04182 -0.12354 -1.97585 0 0 0 0 0 -0.01801 0.13822 -0.78189 0 2.64269 -0.20697 0.44358 -5.03569
+ARG_119 -5.82717 0.23229 5.14556 0.0125 0.19208 -0.02423 -3.35139 0 0 0 -0.4591 0 0.09407 2.364 -0.07896 0 -0.09474 -0.24844 0.3514 -1.69213
+GLY_120 -3.62182 0.12372 3.21529 0.00034 0 0.01907 -1.07403 0 0 0 0 0 -0.04753 0 -1.48141 0 0.79816 -0.01443 0.38113 -1.70153
+LYS_121 -5.75654 0.49047 4.64055 0.00813 0.13763 -0.16832 -3.11489 0 0 -0.87669 0 0 -0.03381 1.27966 0.00175 0 -0.71458 -0.07305 0.32372 -3.85597
+ALA_122 -6.17768 0.59021 2.53677 0.00132 0 0.18846 -1.8933 0 0 0 0 0 -0.01119 0 -0.48991 0 1.32468 -0.09782 0.21645 -3.81202
+TYR_123 -7.1403 0.81424 3.24187 0.02245 0.12593 0.1216 -2.51802 0 0 0 0 0 0.0905 2.10037 0.03057 0.00498 0.58223 -0.02979 0.4509 -2.10247
+ILE_124 -8.77613 0.98984 1.59441 0.03007 0.07048 0.00623 -1.9124 0 0 0 0 0 -0.03691 0.33849 -0.73247 0 2.30374 -0.20867 0.48639 -5.84692
+GLN_125 -7.53167 0.59842 4.50773 0.00742 0.23267 0.01824 -2.9846 0 0 -0.47911 0 0 -0.05888 3.22774 0.30911 0 -1.45095 -0.07758 0.36425 -3.31721
+THR_126 -6.40092 0.59721 3.39681 0.00977 0.07774 -0.36606 -1.01783 0 0 -0.97732 0 0 0.02725 0.49624 -0.74102 0 1.15175 0.04786 0.51735 -3.18116
+ARG_127 -5.47891 0.32914 5.43886 0.01799 0.39136 -0.29616 -1.02987 0 0 0 -0.3864 0 -0.07406 4.90858 -0.10203 0 -0.09474 -0.23468 0.72342 4.1125
+HIS_128 -7.38992 0.61342 5.03941 0.00713 0.50965 -0.79241 -0.9296 0 0 -1.47052 0 0 -0.0529 3.10392 -0.33298 0 -0.30065 -0.48315 0.54429 -1.9343
+GLY_129 -2.39336 0.13144 2.86455 2e-05 0 -0.08873 -1.33684 0 0 0 0 0 -0.10205 0 -1.51759 0 0.79816 0.3666 0.21128 -1.06652
+VAL_130 -3.4605 0.40013 0.74044 0.01727 0.03948 -0.05516 -0.75364 0 0 0 0 0 -0.04251 0.05113 -0.77009 0 2.64269 0.5029 0.11071 -0.57715
+ILE_131 -6.81721 0.84576 1.22184 0.0335 0.07671 -0.07966 -1.41066 0 0 0 0 0 -0.03177 0.44317 0.00661 0 2.30374 -0.09797 0.33234 -3.1736
+GLU_132 -4.0448 0.26349 2.70789 0.00576 0.26498 -0.04339 -1.38148 0 0 0 0 0 0.00013 2.43095 0.13774 0 -2.72453 0.10535 0.34593 -1.93199
+SER_133 -5.74503 0.51169 4.77712 0.00164 0.08204 0.05189 -1.81905 0 0 0 0 0 0.06088 1.08545 0.09742 0 -0.28969 0.09762 0.18939 -0.89864
+GLU_134 -4.06027 0.24688 4.02895 0.00652 0.29546 0.10672 -2.42479 0 0 0 -0.65734 0 0.10092 2.98075 0.38913 0 -2.72453 0.50365 0.25459 -0.95336
+GLY_135 -3.51986 0.29345 3.20708 6e-05 0 -0.15812 -1.10462 0 0 0 0 0 -0.05743 0 0.64469 0 0.79816 0.48554 0.1641 0.75303
+LYS_136 -1.46333 0.05754 1.57741 0.00733 0.12403 -0.1437 0.13758 0 0 0 0 0 0.07183 0.95157 -0.05494 0 -0.71458 -0.12892 0.20569 0.62751
+LYS:CtermProteinFull_137 -1.57102 0.05114 2.22426 0.00975 0.20627 -0.18206 -0.12477 0 0 0 0 0 0 1.24542 0 0 -0.71458 -0.16228 0.38448 1.3666
+SER:NtermProteinFull_138 -1.78005 0.02615 2.60658 0.00245 0.05481 -0.08274 -0.8237 0 0 -0.60706 0 0 0.02017 0.44631 0 0 -0.28969 0 0.04491 -0.38187
+ASP_139 -3.70576 0.11468 4.03304 0.00477 0.2606 0.01693 -4.00632 0 0 0 -0.3864 0 -0.02427 1.48646 0.02933 0 -2.14574 -0.19356 0.32559 -4.19065
+PHE_140 -9.06567 1.24562 2.27085 0.02681 0.47967 -0.04783 -1.43754 0 0 -0.4932 0 0 -0.00898 1.19234 -0.52253 0 1.21829 -0.24784 0.5007 -4.88932
+VAL_141 -6.97885 0.41579 1.05534 0.01988 0.05284 0.13459 -2.0918 0 0 0 0 0 -0.0207 0.03404 -0.3854 0 2.64269 -0.2335 0.29974 -5.05534
+VAL_142 -7.88789 1.18171 1.55468 0.01966 0.04655 0.20741 -2.28776 0 0 0 0 0 -0.04182 0.07242 -0.74612 0 2.64269 -0.36677 0.29566 -5.30957
+ILE_143 -8.05453 0.82644 0.45338 0.02752 0.07973 0.05288 -2.19276 0 0 0 0 0 0.00206 0.24355 -0.70767 0 2.30374 -0.34411 0.37492 -6.93484
+LYS_144 -8.35614 0.72448 6.18768 0.01804 0.21982 0.34009 -5.0238 0 0 0 -0.65734 0 -0.0581 1.23931 0.35095 0 -0.71458 -0.05265 0.45212 -5.33012
+ALA_145 -6.71108 0.66865 2.13685 0.00196 0 -0.24902 -2.53916 0 0 0 0 0 0.01525 0 0.22127 0 1.32468 -0.03222 0.48761 -4.67522
+LEU_146 -7.14316 0.58017 3.36066 0.02323 0.09136 -0.41203 -0.82218 0 0 0 0 0 0.04608 0.04648 -0.10472 0 1.66147 -0.27607 0.44581 -2.50289
+GLU_147 -6.23677 0.40192 5.6417 0.00722 0.3553 0.04302 -2.55354 0 0 -0.90491 0 0 -0.01146 2.4468 0.12851 0 -2.72453 -0.06428 0.42243 -3.04859
+ASP_148 -3.67648 0.25718 3.87257 0.00532 0.27611 -0.11862 -2.75726 0 0 -0.88515 0 0 -0.01024 1.48841 0.07099 0 -2.14574 -0.15336 0.27107 -3.50521
+GLY_149 -2.432 0.07897 2.54594 9e-05 0 0.02185 -1.20456 0 0 -0.83188 0 0 -0.1144 0 -1.38026 0 0.79816 -0.63148 0.48618 -2.66338
+VAL_150 -8.01388 0.87417 2.33099 0.0157 0.04022 0.25186 -2.55485 0 0 0 0 0 0.13672 0.18092 -0.22851 0 2.64269 -0.67915 0.63848 -4.36463
+ASN_151 -5.97478 0.38459 5.29235 0.01123 0.51212 0.21337 -2.48802 0 0 0 -0.61713 0 0.01924 1.88417 -0.14927 0 -1.34026 -0.1989 0.44681 -2.00448
+VAL_152 -7.04467 0.53274 1.32155 0.01844 0.04461 0.16758 -2.22445 0 0 0 0 0 0.28814 0.02271 -0.52685 0 2.64269 -0.08893 0.40009 -4.44635
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+GLY_154 -4.32251 0.27272 2.99969 3e-05 0 -0.02011 -3.03215 0 0 0 0 0 -0.06866 0 1.08569 0 0.79816 0.51668 0.34374 -1.42671
+LEU_155 -8.41648 0.71612 2.88963 0.01819 0.076 -0.24554 -2.85636 0 0 0 0 0 0.32087 1.88391 -0.2989 0 1.66147 0.71667 0.33256 -3.20188
+THR_156 -5.71205 0.70896 5.01735 0.00554 0.09531 0.03841 -3.14914 0 0 -1.39608 0 0 0.05966 0.5551 0.32043 0 1.15175 -0.10674 0.93793 -1.47356
+ARG_157 -7.31683 0.38439 7.0177 0.01771 0.53315 -0.158 -3.28281 0 0 -0.85037 -0.51644 0 -0.01764 2.13441 0.01156 0 -0.09474 -0.11371 0.85578 -1.39584
+GLY_158 -2.03688 0.19207 1.8411 0.0001 0 -0.40106 0.39505 0 0 0 0 0 -0.06755 0 -1.51834 0 0.79816 0.36093 0.14295 -0.29348
+ALA_159 -1.87479 0.04636 1.61177 0.00139 0 -0.22896 0.53438 0 0 0 0 0 -0.02697 0 -0.33689 0 1.32468 0.10304 0.0638 1.21782
+ASP_160 -2.95667 0.25858 4.07925 0.00352 0.28406 0.00714 -2.22922 0 0 -0.45224 -0.91924 0 0.07177 2.02698 0.52182 0 -2.14574 -0.16521 0.31033 -1.30489
+THR_161 -3.73127 0.29291 2.30411 0.01186 0.06476 -0.43481 -0.54061 0 0 0 0 0 -0.00975 0.02955 0.22223 0 1.15175 0.34435 0.39449 0.09956
+ARG_162 -4.42898 0.39779 4.83637 0.01382 0.43692 0.33984 -3.3445 0 0 -0.94384 -0.91924 0 0.09313 3.05676 -0.24193 0 -0.09474 0.08581 0.85339 0.14059
+PHE_163 -3.76938 0.46976 1.39376 0.02806 0.53675 -0.16728 -0.27903 0 0 0 0 0 0.06458 3.59115 0.10034 0 1.21829 -0.30175 1.21189 4.09714
+HIS_164 -5.99727 0.35198 4.37195 0.00802 0.78207 -0.34411 -0.49934 0 0 0 -0.92079 0 0.02355 2.8655 -0.46173 0 -0.30065 0.1464 0.65128 0.67688
+HIS_165 -6.48142 0.33798 5.63516 0.00452 0.29723 -0.12927 -1.74039 0 0 0 -0.84342 0 -0.01645 1.56844 -0.41742 0 -0.30065 0.3334 0.26309 -1.48921
+SER_166 -3.36174 0.23621 3.10691 0.00206 0.06997 -0.12263 -1.16193 0 0 0 -0.61713 0 -0.03118 0.15718 0.07631 0 -0.28969 0.38338 0.25064 -1.30165
+GLU_167 -6.44251 0.24411 6.55989 0.00912 0.59977 0.50732 -4.82491 0 0 0 -1.28314 0 -0.06355 3.62946 0.28085 0 -2.72453 0.4478 0.17806 -2.88225
+LYS_168 -3.45232 0.15555 3.52681 0.00892 0.1743 -0.25754 -1.78561 0 0 0 0 0 -0.04671 0.9777 0.14569 0 -0.71458 0.0683 0.06572 -1.13377
+LEU_169 -9.09649 0.67641 3.19409 0.01327 0.07374 -0.04125 -2.3544 0 0 0 0 0 -0.01844 0.89791 -0.24003 0 1.66147 0.07808 0.18927 -4.96638
+ASP_170 -5.7061 0.55086 6.71238 0.00492 0.23139 0.0591 -5.58998 0 0 -1.90684 0 0 0.60512 2.3907 0.0643 0 -2.14574 0.08096 0.63036 -4.01857
+LYS_171 -5.49268 0.33992 4.60795 0.00998 0.15578 -0.40074 -2.09926 0 0 -0.88515 0 0 -0.07024 0.92506 -0.02241 0 -0.71458 -0.10683 0.57956 -3.17364
+GLY_172 -4.71251 0.30286 3.68818 7e-05 0 -0.04195 -2.4781 0 0 0 0 0 -0.12183 0 -1.48107 0 0.79816 -0.49796 0.39017 -4.15397
+GLU_173 -7.52682 0.2825 7.76872 0.00342 0.17545 -0.00178 -5.73265 0 0 -1.07496 -0.4591 0 -0.00235 3.47134 -0.04163 0 -2.72453 -0.57451 0.44671 -5.9902
+VAL_174 -7.21817 0.61249 1.21599 0.01698 0.04261 0.01628 -1.86483 0 0 0 0 0 -0.04167 0.09154 -0.79103 0 2.64269 -0.38165 0.32489 -5.33389
+LEU_175 -7.94639 0.54391 1.22215 0.01699 0.09881 0.02532 -2.23466 0 0 0 0 0 -0.00869 0.4299 -0.19478 0 1.66147 -0.14185 0.24692 -6.2809
+ILE_176 -8.27266 1.38335 0.63256 0.02642 0.07991 0.19072 -2.22365 0 0 0 0 0 0.18325 0.36748 -0.71073 0 2.30374 -0.13417 0.69369 -5.4801
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+GLN_178 -7.22376 0.54452 5.01344 0.0061 0.16406 -0.13206 -3.02188 0 0 -0.60706 -0.59173 0 0.34436 2.5277 -0.07923 0 -1.45095 0.06865 0.67397 -3.76387
+PHE_179 -8.34762 0.69751 1.98826 0.02231 0.25223 -0.76593 -1.08543 0 0 0 0 0 0.59658 1.68361 -0.19549 0 1.21829 -0.28786 0.93387 -3.28967
+THR_180 -5.63575 0.52539 5.68962 0.00749 0.0721 0.06705 -1.92269 0 0 -2.14748 0 0 0.19414 0.32916 -0.75822 0 1.15175 -0.14282 0.90606 -1.66422
+GLU_181 -2.98802 0.20261 2.64723 0.0084 0.41459 -0.45339 0.24699 0 0 0 0 0 -0.09885 3.24808 -0.30274 0 -2.72453 -0.21187 0.45283 0.44131
+HIS_182 -6.16921 0.5526 5.07623 0.00366 0.43154 -0.91892 -1.49158 0 0 -0.91462 0 0 -0.02937 2.18291 -0.34374 0 -0.30065 -0.21895 0.23199 -1.90812
+THR_183 -7.17864 0.19006 5.52955 0.01262 0.0667 0.06631 -1.1682 0 0 -0.3825 -0.92079 0 -0.05434 0.02557 0.05027 0 1.15175 0.1632 0.32487 -2.12357
+SER_184 -5.39576 0.26376 4.5231 0.00258 0.05419 -0.22923 -1.86266 0 0 0 0 0 0.04586 0.22041 -0.02654 0 -0.28969 0.14996 0.43623 -2.10778
+ALA_185 -5.7263 0.62039 1.64971 0.00122 0 0.14105 -1.73783 0 0 0 0 0 -0.00852 0 -0.47175 0 1.32468 0.02814 0.36573 -3.81347
+ILE_186 -7.31291 0.41868 1.34341 0.0226 0.06988 0.00604 -2.36223 0 0 0 0 0 -0.05998 0.17711 -0.7375 0 2.30374 -0.16189 0.22767 -6.06539
+LYS_187 -8.1706 0.73105 6.45502 0.00873 0.14478 -0.10692 -5.40478 0 0 0 -0.56848 0 -0.00094 1.26832 0.29482 0 -0.71458 -0.16245 0.39982 -5.82622
+VAL_188 -6.63174 0.47085 0.68767 0.01851 0.04246 -0.06529 -1.90666 0 0 0 0 0 -0.05554 0.17322 -0.76395 0 2.64269 -0.18464 0.48693 -5.08551
+ARG_189 -4.6667 0.18127 4.44942 0.01669 0.43508 0.35132 -3.53911 0 0 0 -1.14674 0 0.02348 1.98013 0.10923 0 -0.09474 -0.18491 0.40833 -1.67725
+GLY_190 -3.86909 0.16803 2.87142 0.00031 0 -0.07389 -1.63886 0 0 -0.43204 0 0 -0.0238 0 -1.49814 0 0.79816 0.12403 0.444 -3.12986
+LYS_191 -7.20046 0.70835 6.19309 0.00861 0.19186 -0.24082 -3.81692 0 0 -0.90491 0 0 -0.04402 2.86346 0.0366 0 -0.71458 -0.01192 0.37567 -2.55599
+ALA_192 -6.44592 0.63 2.71742 0.00136 0 0.24266 -1.17779 0 0 0 0 0 0.03002 0 -0.50269 0 1.32468 -0.11474 0.32347 -2.97155
+TYR_193 -7.16784 0.58777 3.4853 0.02109 0.11687 0.06605 -2.3083 0 0 0 0 0 0.02002 1.92871 0.03625 0.02754 0.58223 -0.04455 0.41011 -2.23877
+ILE_194 -8.74989 0.86417 1.54834 0.03042 0.07491 0.03973 -2.06579 0 0 0 0 0 0.00899 0.34091 -0.75503 0 2.30374 -0.24087 0.42516 -6.17521
+GLN_195 -8.35758 0.60771 4.66297 0.00689 0.21382 -0.18666 -2.3029 0 0 0 0 0 -0.01406 3.14907 0.2729 0 -1.45095 -0.17695 0.39336 -3.18238
+THR_196 -6.5526 0.49723 3.61706 0.00856 0.08227 -0.31203 -1.59048 0 0 -0.99124 0 0 0.00895 0.43702 -0.6556 0 1.15175 -0.10516 0.43141 -3.97285
+ARG_197 -4.58257 0.2514 4.01316 0.01864 0.57718 -0.29718 0.66743 0 0 0 0 0 0.07587 3.45984 -0.11244 0 -0.09474 -0.33149 0.41835 4.06344
+HIS_198 -6.98843 0.42014 4.8223 0.00651 0.49114 -0.62869 -1.32742 0 0 -1.48044 0 0 -0.03166 3.20039 -0.32652 0 -0.30065 -0.50498 0.32874 -2.31957
+GLY_199 -2.46925 0.16851 2.87538 0.00012 0 -0.03505 -1.74284 0 0 0 0 0 -0.06016 0 -1.51727 0 0.79816 0.25552 0.21006 -1.51681
+VAL_200 -3.81776 0.35871 1.31348 0.01863 0.05029 0.07422 -1.057 0 0 -0.42332 0 0 -0.01176 0.03909 -0.38049 0 2.64269 0.39654 0.17474 -0.62196
+ILE_201 -6.71162 0.56427 1.44748 0.02525 0.07179 0.03712 -1.38293 0 0 0 0 0 0.00352 0.22069 0.27115 0 2.30374 0.07987 0.32002 -2.74966
+GLU_202 -4.08685 0.30111 3.57405 0.00439 0.22436 -0.08621 -3.2529 0 0 -0.38033 0 0 0.0292 3.29585 0.23365 0 -2.72453 0.29508 0.35252 -2.22062
+SER_203 -6.14608 0.50006 5.42024 0.00162 0.07003 0.08601 -3.28369 0 0 -0.43204 0 0 0.04682 0.15313 -0.27177 0 -0.28969 -0.00995 0.43351 -3.72181
+GLU_204 -4.75181 0.33325 4.6318 0.00617 0.25205 -0.1154 -2.75878 0 0 0 -0.87442 0 0.00238 3.23371 0.06942 0 -2.72453 -0.05392 0.44098 -2.30909
+GLY_205 -1.97358 0.2661 2.00267 9e-05 0 -0.05151 -0.31982 0 0 0 0 0 -0.09068 0 -0.97485 0 0.79816 0.13442 0.23169 0.02269
+LYS:CtermProteinFull_206 -0.4171 0.12728 0.68096 0.02043 0.42817 -0.05072 -0.19507 0 0 0 0 0 0 1.90643 0 0 -0.71458 0.10922 0.35135 2.24637
+SER:NtermProteinFull_207 -1.173 0.01328 1.78873 0.00248 0.07233 -0.36321 -0.22255 0 0 0 0 0 -0.00101 0.1277 0 0 -0.28969 0 0.02687 -0.01807
+ASP_208 -4.14676 0.18742 4.49429 0.00347 0.22627 0.07358 -4.65795 0 0 0 -1.53408 0 0.03825 2.4198 0.1543 0 -2.14574 -0.04377 0.23283 -4.69811
+PHE_209 -8.56499 1.06767 2.2818 0.0262 0.49771 -0.14509 -1.41762 0 0 -0.48919 0 0 -0.00862 1.1256 -0.4847 0 1.21829 -0.15633 0.42635 -4.6229
+VAL_210 -6.97337 0.59646 0.83167 0.02082 0.05271 0.09782 -2.06145 0 0 0 0 0 -0.01319 0.00648 -0.3521 0 2.64269 -0.31144 0.32025 -5.14266
+VAL_211 -7.86372 1.14417 1.40191 0.01804 0.04597 0.23281 -2.29375 0 0 0 0 0 0.01853 0.13804 -0.75649 0 2.64269 -0.39197 0.40176 -5.26201
+ILE_212 -8.37828 0.63741 0.35155 0.02595 0.12322 -0.03998 -2.10044 0 0 0 0 0 0.14766 2.28584 -0.71166 0 2.30374 -0.34654 0.48724 -5.21427
+LYS_213 -8.51556 0.92687 6.19311 0.01672 0.19695 0.52324 -5.59452 0 0 -0.38033 -0.87442 0 -0.04273 1.23291 0.32019 0 -0.71458 -0.1077 0.49378 -6.32609
+ALA_214 -6.64239 0.69676 2.01982 0.00194 0 -0.22004 -2.40812 0 0 0 0 0 0.04306 0 0.38067 0 1.32468 0.10239 0.41934 -4.28189
+LEU_215 -7.13641 0.79322 2.42751 0.02081 0.08771 -0.46752 -0.9397 0 0 0 0 0 0.06178 3.18292 -0.16517 0 1.66147 -0.11451 0.3125 -0.27541
+GLU_216 -6.26374 0.45335 5.60996 0.00641 0.3273 0.02416 -2.25418 0 0 -0.9024 0 0 -0.01234 2.55137 0.11168 0 -2.72453 -0.10582 0.42749 -2.75128
+ASP_217 -3.73605 0.26578 3.89627 0.00532 0.28015 -0.09795 -2.66324 0 0 -0.89469 0 0 -0.00374 1.51204 0.07113 0 -2.14574 -0.1489 0.34558 -3.31404
+GLY_218 -2.71274 0.08271 2.7548 0.00012 0 -0.11863 -1.01151 0 0 -0.83626 0 0 -0.09563 0 -1.23352 0 0.79816 -0.45299 0.47651 -2.34897
+VAL_219 -8.29291 0.72075 2.5861 0.01669 0.04383 0.08059 -2.35734 0 0 0 0 0 -0.007 0.13644 -0.41092 0 2.64269 -0.48186 0.51435 -4.80861
+ASN_220 -5.48665 0.23786 4.5717 0.00543 0.25407 -0.23935 -2.0106 0 0 0 0 0 0.12112 1.87513 0.2635 0 -1.34026 -0.15584 0.24287 -1.661
+VAL_221 -6.85866 0.57426 1.00038 0.01709 0.04548 0.16441 -2.28034 0 0 0 0 0 0.33247 0.01768 -0.55392 0 2.64269 -0.04398 0.35135 -4.5911
+ILE_222 -8.0021 0.93716 2.68008 0.03469 0.07833 0.04759 -2.37978 0 0 0 0 0 0.04851 0.30549 -0.76993 0 2.30374 -0.36659 0.46733 -4.61548
+GLY_223 -4.3273 0.22557 2.9336 3e-05 0 -0.10922 -2.92991 0 0 0 0 0 -0.05349 0 1.07393 0 0.79816 0.46695 0.36064 -1.56105
+LEU_224 -8.71754 0.68133 2.73043 0.01899 0.07678 -0.23825 -3.02162 0 0 0 0 0 0.26651 1.88601 -0.33094 0 1.66147 0.6691 0.36642 -3.95133
+THR_225 -5.7285 0.65886 4.92835 0.00609 0.09345 -0.12383 -2.16428 0 0 -0.41558 0 0 -0.02319 0.81381 0.24354 0 1.15175 -0.12151 0.57808 -0.10296
+ARG_226 -6.80262 0.29504 6.63991 0.01561 0.52584 -0.18974 -3.20021 0 0 -0.96064 -0.5459 0 -0.03185 2.09651 -0.02555 0 -0.09474 -0.18888 0.53678 -1.93044
+GLY_227 -2.05101 0.22128 1.93075 0.0001 0 -0.37504 0.30176 0 0 0 0 0 -0.05361 0 -1.51684 0 0.79816 0.23703 0.1801 -0.32732
+ALA_228 -1.92362 0.09841 1.55595 0.00139 0 -0.17475 0.4854 0 0 0 0 0 -0.03872 0 -0.35361 0 1.32468 0.01601 0.0831 1.07424
+ASP_229 -2.39476 0.16882 3.87783 0.0086 0.82189 0.15767 -1.60228 0 0 0 -1.44821 0 -0.03595 1.80857 -0.73992 0 -2.14574 -0.41783 0.29499 -1.64631
+THR_230 -3.84131 0.15333 2.98658 0.01141 0.05861 -0.45721 -0.40175 0 0 0 0 0 -0.04641 0.0567 0.00107 0 1.15175 -0.06005 0.40083 0.01356
+ARG_231 -4.67648 0.21828 5.03048 0.01672 0.45691 0.43132 -4.67265 0 0 -0.41558 -1.44821 0 -0.0081 1.98047 -0.05225 0 -0.09474 0.09335 0.41639 -2.72411
+PHE_232 -5.08429 0.47628 0.65639 0.04663 0.23131 -0.09089 -0.18059 0 0 0 0 0 0.05515 3.38578 -0.11613 0 1.21829 -0.14819 0.4349 0.88463
+HIS_233 -5.47344 0.44732 4.16846 0.00692 0.67871 -0.25092 -0.51764 0 0 0 -0.92551 0 0.01492 3.24697 -0.38741 0 -0.30065 0.10755 0.38346 1.19873
+HIS_234 -6.09179 0.39454 5.58509 0.00454 0.32549 -0.05913 -1.87377 0 0 0 -0.78514 0 -0.02078 1.49027 -0.46416 0 -0.30065 0.35407 0.31009 -1.13132
+SER_235 -3.27767 0.21771 2.80363 0.00228 0.07053 -0.51901 -0.39294 0 0 0 0 0 -0.04699 0.19585 0.1855 0 -0.28969 0.36517 0.20598 -0.47965
+GLU_236 -6.21163 0.19775 6.16975 0.0077 0.58554 0.45334 -4.55122 0 0 0 -1.35361 0 -0.07152 3.46506 0.23275 0 -2.72453 0.3659 0.1652 -3.26951
+LYS_237 -3.78996 0.13772 3.49747 0.00757 0.15843 -0.28863 -1.30423 0 0 0 0 0 -0.03897 0.97887 0.13407 0 -0.71458 0.03393 0.13487 -1.05344
+LEU_238 -9.12524 0.75224 3.18078 0.01416 0.07304 -0.02421 -2.57784 0 0 0 0 0 0.0136 0.79722 -0.23525 0 1.66147 0.0004 0.30027 -5.16936
+ASP_239 -5.50294 0.53836 6.30308 0.00465 0.23042 -0.01251 -5.22668 0 0 -1.84567 0 0 0.4166 2.19881 0.11304 0 -2.14574 0.06038 0.70543 -4.16275
+LYS_240 -5.21397 0.34862 4.40636 0.00881 0.15108 -0.46695 -1.64057 0 0 -0.89469 0 0 -0.08957 0.92033 -0.0223 0 -0.71458 -0.09255 0.51341 -2.78658
+GLY_241 -3.7444 0.17406 3.12444 7e-05 0 0.08083 -2.18472 0 0 0 0 0 -0.14666 0 -1.49503 0 0.79816 -0.46255 0.26228 -3.59352
+GLU_242 -6.98089 0.20999 7.53006 0.00397 0.19475 0.21258 -6.1357 0 0 -1.00941 -1.14674 0 -0.01073 3.33457 -0.02951 0 -2.72453 -0.45477 0.34206 -6.66429
+VAL_243 -7.26808 0.50666 1.17449 0.01665 0.04342 0.01507 -1.99468 0 0 0 0 0 -0.0423 0.05568 -0.7814 0 2.64269 -0.33575 0.20431 -5.76324
+LEU_244 -8.34141 0.68424 1.15377 0.01669 0.097 0.0166 -2.18395 0 0 0 0 0 -0.01494 0.449 -0.20551 0 1.66147 -0.15657 0.16376 -6.65984
+ILE_245 -8.22152 1.31034 0.74152 0.02791 0.08027 0.15624 -2.22635 0 0 0 0 0 0.17945 0.37477 -0.70704 0 2.30374 -0.13708 0.62572 -5.49203
+ALA_246 -4.59892 0.42183 1.81395 0.00152 0 0.16234 -2.15956 0 0 0 0 0 0.00163 0 -0.04945 0 1.32468 -0.01252 0.78907 -2.30543
+GLN_247 -6.79471 0.57245 4.79101 0.00625 0.16846 -0.48317 -2.80689 0 0 0 -0.51644 0 0.21619 2.52749 -0.09515 0 -1.45095 0.06675 0.4874 -3.31132
+PHE_248 -8.50431 0.6792 1.93931 0.02251 0.24947 -0.77606 -1.02801 0 0 0 0 0 0.61256 1.65129 -0.19658 0 1.21829 -0.27854 0.67843 -3.73245
+THR_249 -5.58092 0.54694 5.5709 0.0071 0.06884 0.01352 -1.78398 0 0 -2.7615 0 0 0.22492 0.34348 -0.75638 0 1.15175 -0.12142 0.83931 -2.23746
+GLU_250 -2.90699 0.17661 2.58079 0.00778 0.40358 -0.39855 0.15668 0 0 0 0 0 -0.10528 3.22064 -0.29529 0 -2.72453 -0.16604 0.51052 0.45992
+HIS_251 -6.08658 0.56295 5.12984 0.00332 0.41882 -0.88472 -1.50845 0 0 -0.92457 0 0 0.03369 2.21931 -0.30791 0 -0.30065 -0.0842 0.28633 -1.44281
+THR_252 -7.05792 0.15847 5.23451 0.0124 0.06676 -0.12182 -0.98121 0 0 -0.87629 -0.92551 0 -0.04264 0.01841 0.12096 0 1.15175 0.26618 0.37138 -2.60457
+SER_253 -5.40832 0.22607 4.56113 0.00193 0.05334 -0.27517 -2.03438 0 0 0 0 0 0.03911 0.21882 -0.02799 0 -0.28969 0.14073 0.32769 -2.46672
+ALA_254 -5.79731 0.69394 1.68857 0.00124 0 0.08575 -1.52682 0 0 0 0 0 -0.00854 0 -0.49444 0 1.32468 0.01214 0.23744 -3.78334
+ILE_255 -7.3716 0.58373 1.39165 0.02243 0.07026 0.00622 -2.42272 0 0 0 0 0 -0.05817 0.19693 -0.74123 0 2.30374 -0.17647 0.19958 -5.99566
+LYS_256 -8.31828 0.6576 6.65754 0.00859 0.14601 0.11888 -5.43599 0 0 0 -0.61666 0 -0.0257 1.3038 0.29304 0 -0.71458 -0.16683 0.3083 -5.78427
+VAL_257 -6.61007 0.45231 0.92166 0.01674 0.04239 0.03822 -1.98017 0 0 0 0 0 -0.01203 0.10466 -0.77882 0 2.64269 -0.19152 0.33733 -5.01661
+ARG_258 -4.16829 0.18804 4.19398 0.01594 0.36898 0.48272 -3.65484 0 0 0 -1.10593 0 -0.02158 2.00394 0.09267 0 -0.09474 -0.17504 0.28726 -1.58689
+GLY_259 -3.93754 0.17091 2.81207 0.00016 0 -0.05924 -1.72556 0 0 -0.38663 0 0 0.01438 0 -1.50011 0 0.79816 0.20779 0.25755 -3.34807
+LYS_260 -7.3807 0.79471 6.29082 0.00889 0.19577 -0.30622 -4.1145 0 0 -0.9024 0 0 -0.0443 2.19529 0.04284 0 -0.71458 -0.00758 0.23946 -3.70249
+ALA_261 -6.4137 0.79264 2.57175 0.00139 0 0.3422 -1.13072 0 0 0 0 0 0.00798 0 -0.55887 0 1.32468 -0.20975 0.27797 -2.99442
+TYR_262 -6.80516 0.42804 3.28653 0.02081 0.09226 -0.02858 -2.07548 0 0 0 0 0 0.0108 2.24422 -0.00323 0.00103 0.58223 -0.01495 0.35121 -1.91028
+ILE_263 -8.65177 1.03572 1.67519 0.02872 0.07002 0.0625 -2.16891 0 0 0 0 0 -0.04023 0.34545 -0.74834 0 2.30374 -0.18015 0.36178 -5.90629
+GLN_264 -7.89317 0.66757 4.33278 0.00604 0.21085 -0.04907 -2.65142 0 0 -0.42332 0 0 -0.04346 3.14572 0.30718 0 -1.45095 -0.10289 0.41191 -3.53223
+THR_265 -6.72965 0.48022 3.63334 0.01139 0.08841 -0.26768 -2.0065 0 0 -0.93733 0 0 -0.00056 0.71453 -0.65257 0 1.15175 -0.07483 0.5077 -4.08176
+ARG_266 -5.87044 0.34418 6.13382 0.01726 0.67037 -0.18802 -1.92876 0 0 0 -1.53408 0 -0.05803 3.78069 -0.1199 0 -0.09474 -0.39167 0.61193 1.37261
+HIS_267 -7.67472 0.57503 5.82604 0.00631 0.45492 -0.8816 -1.68182 0 0 -0.93733 -0.87211 0 -0.02352 2.17315 -0.44218 0 -0.30065 -0.4366 0.56557 -3.64951
+GLY_268 -2.87707 0.11267 3.16299 9e-05 0 -0.01643 -1.93673 0 0 0 0 0 -0.06014 0 -1.51607 0 0.79816 0.14104 0.21914 -1.97235
+VAL_269 -3.98084 0.34676 1.67839 0.02133 0.05465 0.07986 -1.30705 0 0 -0.45743 0 0 0.04589 0.13693 -0.25189 0 2.64269 0.34743 0.13524 -0.50804
+ILE_270 -7.25055 0.77826 1.40288 0.03197 0.08028 -0.05754 -1.38642 0 0 0 0 0 0.00366 0.17272 0.11822 0 2.30374 0.13819 0.37204 -3.29256
+GLU_271 -3.6847 0.30717 2.93079 0.00454 0.2516 0.19396 -2.44234 0 0 -0.39753 0 0 0.07669 3.2063 0.17208 0 -2.72453 0.1618 0.35522 -1.58895
+SER_272 -5.74618 0.44543 5.16461 0.00143 0.06664 0.12278 -2.95967 0 0 -0.38663 0 0 0.10838 0.1846 -0.23266 0 -0.28969 0.00486 0.48818 -3.02793
+GLU_273 -4.83919 0.38998 5.38323 0.00395 0.57757 -0.35174 -3.0144 0 0 -1.08383 0 0 0.01313 4.59425 0.03461 0 -2.72453 0.0053 0.76807 -0.2436
+GLY_274 -2.21142 0.25179 2.54575 0.0001 0 0.01264 -0.91023 0 0 -1.08383 0 0 -0.08226 0 -0.91876 0 0.79816 0.03175 0.37684 -1.18948
+LYS:CtermProteinFull_275 -0.30073 0.03037 0.41523 0.0089 0.36121 -0.10023 -0.33141 0 0 0 0 0 0 1.20307 0 0 -0.71458 0.00272 0.05877 0.63333
+SER:NtermProteinFull_276 -2.09739 0.01218 2.94416 0.00242 0.05236 -0.20104 -0.84793 0 0 -0.55747 0 0 -0.00014 0.54539 0 0 -0.28969 0 0.04914 -0.388
+ASP_277 -4.75204 0.49516 6.14637 0.00353 0.27275 0.41796 -5.93736 0 0 -0.84331 -1.40206 0 0.0415 3.2492 -0.08927 0 -2.14574 -0.09723 0.15506 -4.48549
+PHE_278 -9.25343 1.06094 3.27397 0.02491 0.45078 -0.52007 -1.58609 0 0 -0.84331 0 0 -0.00598 1.09338 -0.59032 0 1.21829 -0.20558 0.30058 -5.58191
+VAL_279 -6.72501 0.45385 0.77572 0.02487 0.05571 0.01848 -2.02849 0 0 0 0 0 -0.00809 0.1077 -0.38419 0 2.64269 -0.25078 0.31905 -4.99848
+VAL_280 -7.65745 1.09153 1.38571 0.01915 0.04875 0.23499 -2.23848 0 0 0 0 0 -0.03813 0.03118 -0.6866 0 2.64269 -0.31763 0.39105 -5.09325
+ILE_281 -8.16269 0.78332 0.43519 0.02635 0.07861 -0.00264 -2.22495 0 0 0 0 0 -0.04951 0.25378 -0.6997 0 2.30374 -0.3283 0.43268 -7.15415
+LYS_282 -8.1685 0.90101 5.16695 0.0172 0.2105 0.30504 -4.11838 0 0 -0.39753 0 0 -0.05193 1.32288 0.32633 0 -0.71458 -0.09076 0.44361 -4.84817
+ALA_283 -6.58472 0.78296 1.90965 0.00202 0 -0.26803 -2.22808 0 0 0 0 0 0.08723 0 0.30026 0 1.32468 0.02289 0.43754 -4.21361
+LEU_284 -7.11918 0.64988 2.44436 0.02324 0.08897 -0.54914 -1.04965 0 0 0 0 0 0.0093 3.39639 -0.14321 0 1.66147 -0.18204 0.36544 -0.40416
+GLU_285 -5.97855 0.41689 5.22936 0.00789 0.37598 -0.0192 -1.81112 0 0 -0.90222 0 0 -0.01102 2.52118 0.10008 0 -2.72453 -0.0819 0.35365 -2.5235
+ASP_286 -3.64846 0.24301 3.84616 0.00503 0.27883 -0.12102 -2.70064 0 0 -0.88101 0 0 -0.00405 1.51806 0.07573 0 -2.14574 -0.14768 0.26005 -3.42172
+GLY_287 -2.5207 0.03962 2.71485 0.00011 0 -0.18956 -1.22954 0 0 -0.78023 0 0 -0.07294 0 -1.34196 0 0.79816 -0.49532 0.50017 -2.57734
+VAL_288 -8.04492 0.78427 2.70645 0.01568 0.04109 -0.00434 -2.60329 0 0 0 0 0 -0.00705 0.12939 -0.32407 0 2.64269 -0.5084 0.60429 -4.56821
+ASN_289 -5.7029 0.21069 4.8899 0.00404 0.2588 -0.41171 -2.32051 0 0 0 0 0 -0.02678 2.0253 0.23675 0 -1.34026 -0.0756 0.34097 -1.91134
+VAL_290 -6.59648 0.51886 0.90854 0.01855 0.04622 0.10729 -2.20744 0 0 0 0 0 0.23004 0.02788 -0.51236 0 2.64269 0.00925 0.3115 -4.49549
+ILE_291 -7.72807 0.65486 2.52513 0.03143 0.07727 0.00473 -2.36513 0 0 0 0 0 0.06009 0.40057 -0.74901 0 2.30374 -0.38434 0.34618 -4.82255
+GLY_292 -4.06594 0.24239 2.68215 3e-05 0 -0.03811 -2.29748 0 0 0 0 0 -0.05941 0 1.05277 0 0.79816 0.44421 0.26073 -0.98052
+LEU_293 -8.8654 0.83613 2.63058 0.01751 0.0748 -0.21775 -3.30931 0 0 0 0 0 0.38257 1.86034 -0.32013 0 1.66147 0.66065 0.36087 -4.22766
+THR_294 -5.97787 0.67255 5.21224 0.00554 0.09234 0.10312 -3.54139 0 0 -1.28629 0 0 0.0349 0.67712 0.26241 0 1.15175 -0.10856 1.04941 -1.65273
+ARG_295 -7.04803 0.31301 6.96307 0.01745 0.55063 -0.24142 -3.33513 0 0 -0.97518 -0.62455 0 -0.02293 2.0848 -0.0403 0 -0.09474 -0.18863 0.96214 -1.6798
+GLY_296 -2.10124 0.23004 1.91282 0.00011 0 -0.39448 0.41126 0 0 0 0 0 -0.03142 0 -1.51781 0 0.79816 0.27507 0.1801 -0.23737
+ALA_297 -2.02727 0.05781 1.73669 0.00145 0 -0.26636 0.51383 0 0 0 0 0 -0.03024 0 -0.34643 0 1.32468 0.08677 0.05177 1.10268
+ASP_298 -2.82708 0.16776 3.40206 0.00345 0.28715 -0.53446 -0.94909 0 0 -0.45022 0 0 0.01673 2.80517 -0.12125 0 -2.14574 -0.28379 0.09086 -0.53845
+THR_299 -3.99943 0.28542 2.53119 0.01158 0.06387 -0.42697 -0.75051 0 0 0 0 0 -0.04217 0.02528 0.29143 0 1.15175 0.18718 0.15494 -0.51643
+ARG_300 -4.69533 0.33412 4.36589 0.01095 0.20209 -0.18146 -2.11569 0 0 -0.83607 0 0 0.04623 1.77336 -0.18449 0 -0.09474 0.09122 0.34417 -0.93977
+PHE_301 -4.60767 0.49119 0.56236 0.05351 0.2439 -0.26531 -0.03758 0 0 0 0 0 -0.01064 3.43593 -0.09839 0 1.21829 -0.27783 0.53003 1.23777
+HIS_302 -5.05294 0.35602 3.79037 0.0063 0.77102 -0.32136 -0.29804 0 0 0 -0.85681 0 -0.02153 3.12249 -0.46565 0 -0.30065 0.07728 0.47046 1.27694
+HIS_303 -5.68399 0.23547 5.08869 0.00406 0.28336 -0.17452 -1.57247 0 0 0 -0.80496 0 -0.01275 1.4512 -0.50603 0 -0.30065 0.3734 0.27098 -1.3482
+SER_304 -2.98142 0.18175 2.62999 0.00227 0.06809 -0.38658 -0.52289 0 0 0 0 0 -0.0426 0.13534 0.06082 0 -0.28969 0.44203 0.13203 -0.57087
+GLU_305 -6.31268 0.20349 6.2338 0.00821 0.59667 0.50273 -4.73169 0 0 0 -1.42162 0 -0.06994 3.51694 0.24871 0 -2.72453 0.3918 0.10731 -3.4508
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+SER:NtermProteinFull_413 -2.09977 0.06256 3.34732 0.00244 0.05596 -0.14965 -2.30314 0 0 -0.66293 0 0 0.14031 0.40822 0 0 -0.28969 0 0.09214 -1.39623
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+GLY_429 -4.031 0.27982 2.66172 3e-05 0 -0.06233 -2.66853 0 0 0 0 0 -0.05047 0 1.02488 0 0.79816 0.51004 0.24171 -1.29597
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+PHE_454 -8.12609 0.64006 1.86614 0.02249 0.24283 -0.72142 -1.22921 0 0 0 0 0 0.57252 1.70749 -0.17098 0 1.21829 -0.29624 0.84329 -3.43083
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+THR_458 -7.11621 0.19925 5.33763 0.01247 0.06563 -0.04823 -1.09379 0 0 -0.76189 -0.97464 0 -0.03914 0.01936 0.10226 0 1.15175 0.25869 0.38242 -2.50443
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+SER:NtermProteinFull_480 -1.80327 0.02329 2.83268 0.0021 0.06351 -0.16816 -1.24549 0 0 0 0 0 -0.03054 0.35174 0 0 -0.28969 0 0.05298 -0.21086
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+GLU_515 -6.9369 0.32141 7.54265 0.00368 0.19269 -0.03692 -5.44593 0 0 -0.99825 -0.42509 0 -0.00563 3.2728 -0.04234 0 -2.72453 -0.58301 0.52626 -5.3391
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+SER:NtermProteinFull_547 -1.672 0.05026 2.4007 0.00256 0.07299 -0.16368 -1.15561 0 0 0 0 0 -0.09208 0.20378 0 0 -0.28969 0 0.05343 -0.58933
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+VAL_626 -7.48904 0.68231 2.11324 0.01454 0.03973 0.11605 -2.46447 0 0 0 0 0 0.05521 0.06838 -0.37723 0 2.64269 -0.47858 0.5077 -4.56946
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+GLY_630 -4.15846 0.24866 2.88096 2e-05 0 0.00326 -3.05112 0 0 0 0 0 -0.06125 0 1.04014 0 0.79816 0.47438 0.3183 -1.50694
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+GLY_634 -2.10531 0.22923 1.95397 0.00014 0 -0.42626 0.38557 0 0 0 0 0 -0.07483 0 -1.51795 0 0.79816 0.33856 0.18855 -0.23018
+ALA_635 -1.96448 0.06419 1.7417 0.00143 0 -0.2267 0.48315 0 0 0 0 0 -0.02765 0 -0.33771 0 1.32468 0.06745 0.0377 1.16375
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+HIS_640 -6.07153 0.39773 4.23812 0.00588 0.71331 -0.29709 -0.63681 0 0 0 -1.04135 0 0.02283 3.0883 -0.44592 0 -0.30065 0.18278 0.6854 0.541
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+SER_642 -3.35044 0.111 2.76418 0.00168 0.02812 -0.29517 -0.8015 0 0 0 0 0 -0.06497 0.7498 0.43685 0 -0.28969 0.28306 0.16354 -0.26353
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+VAL_650 -7.43535 0.75082 1.24128 0.01942 0.04438 0.05541 -1.98337 0 0 0 0 0 0.1273 0.03503 -0.78338 0 2.64269 -0.2782 0.73766 -4.8263
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+GLY:CtermProteinFull_681 -1.46508 0.04644 1.49483 0.00011 0 -0.10222 -0.41819 0 0 0 0 0 0 0 0 0 0.79816 0.03752 0.1493 0.54087
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+MET_872 -8.71389 0.99116 2.20594 0.01516 0.12119 -0.60532 -1.03662 0 0 0 0 0 0.04291 2.58981 0.2547 0 1.65735 -0.04222 0.46178 -2.05804
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+SER_880 -2.89503 0.18707 2.07941 0.00133 0.02586 -0.37391 -0.56367 0 0 0 0 0 -0.00666 0.57258 0.3513 0 -0.28969 0.44929 0.30477 -0.15734
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+CYS:disulfide_891 -7.0129 0.72347 3.24442 0.00273 0.03615 0.18198 -2.13274 0 0 0 0 -0.31692 -0.05284 0.22708 -0.07834 0 3.25479 0.55292 0.32609 -1.0441
+ARG_892 -5.76057 0.31171 6.08931 0.01454 0.37028 0.64448 -5.39407 0 0 0 -1.49443 0 -0.02199 1.9518 0.07552 0 -0.09474 0.50717 0.36677 -2.4342
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+ILE_916 -9.30757 1.19891 2.7325 0.03603 0.06565 -0.18931 -1.57579 0 0 0 0 0 -0.03885 0.30159 -0.45563 0 2.30374 0.31076 0.61645 -4.00152
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+SER_935 -2.37785 0.16548 2.76915 0.0025 0.07197 0.00684 -1.69142 0 0 0 0 0 0.01206 0.09831 -0.00089 0 -0.28969 0.40822 0.70808 -0.11724
+GLY_936 -2.1172 0.12631 2.54752 6e-05 0 -0.36399 0.06707 0 0 0 0 0 -0.18625 0 -1.33603 0 0.79816 0.3539 0.30959 0.19913
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+ASP_938 -5.37563 0.29468 6.26033 0.0033 0.25836 0.26887 -4.99235 0 0 0 -1.49443 0 0.01568 2.71547 -0.01802 0 -2.14574 -0.20199 0.30503 -4.10644
+PHE_939 -9.17128 0.49159 3.02253 0.02318 0.26896 -0.01685 -3.03268 0 0 0 0 0 0.10912 1.53146 -0.266 0 1.21829 -0.10688 0.3548 -5.57375
+THR_940 -5.09181 0.63212 3.73727 0.01081 0.05302 -0.23706 -2.08034 0 0 0 0 0 0.3768 0.13511 -0.21319 0 1.15175 -0.08244 0.51997 -1.08798
+LEU_941 -8.67958 1.24079 1.40922 0.01489 0.08211 -0.10363 -2.3001 0 0 0 0 0 -0.03547 0.63274 -0.31118 0 1.66147 0.02098 0.57795 -5.7898
+THR_942 -5.61231 0.38332 4.12131 0.00917 0.0548 -0.17887 -2.23551 0 0 0 0 0 0.27565 0.05843 -0.21935 0 1.15175 0.02638 0.43018 -1.73505
+ILE_943 -8.30627 0.72874 1.92009 0.02091 0.08242 -0.07453 -1.652 0 0 0 0 0 0.08145 0.32103 -0.52321 0 2.30374 -0.01811 0.58803 -4.52769
+SER_944 -3.26552 0.08824 2.82773 0.00277 0.05273 -0.06924 -0.77074 0 0 0 0 0 -0.05394 0.18243 0.01226 0 -0.28969 -0.35514 0.56831 -1.06979
+SER_945 -4.33686 0.28814 3.99653 0.00372 0.08026 -0.19444 -1.0217 0 0 -0.48929 0 0 -0.05492 0.07782 -0.05882 0 -0.28969 0.48976 0.32549 -1.184
+LEU_946 -9.45895 1.05927 2.6004 0.02012 0.08449 -0.01225 -3.17784 0 0 0 0 0 -0.01895 0.34146 -0.15439 0 1.66147 0.56523 0.45147 -6.03847
+GLN_947 -7.37623 0.98899 6.60743 0.00884 0.60833 -0.47568 -2.23258 0 0 -1.32856 0 0 0.11646 1.52362 -0.03273 0 -1.45095 -0.3304 1.20354 -2.16994
+PRO_948 -4.38212 0.73112 1.89771 0.00242 0.03474 -0.39416 -0.62368 0 0 0 0 0 -0.1334 0.19062 -0.57905 0 -1.64321 0.01096 1.31958 -3.56848
+GLU_949 -3.90152 0.42357 4.77343 0.01049 1.03623 -0.72393 -1.52754 0 0 0 0 0 -0.04529 3.81581 -0.11056 0 -2.72453 -0.07335 0.5155 1.4683
+ASP_950 -7.47438 0.64415 8.29875 0.00683 0.36124 0.11988 -7.0662 0 0 -1.59915 -1.40647 0 0.10613 2.1231 -0.34583 0 -2.14574 -0.57177 0.38916 -8.56027
+PHE_951 -4.71421 0.3444 2.73614 0.02203 0.15955 -0.22563 -0.56008 0 0 0 0 0 0.03911 1.63127 0.11294 0 1.21829 -0.0562 0.45648 1.1641
+ALA_952 -5.58519 0.45947 2.27689 0.00136 0 -0.29572 -1.27906 0 0 0 0 0 0.11629 0 -0.4388 0 1.32468 0.45515 0.33586 -2.62906
+THR_953 -6.43423 0.54035 3.29601 0.00723 0.05203 -0.06092 -2.39731 0 0 0 0 0 -0.00034 0.06217 -0.03305 0 1.15175 0.16874 0.36487 -3.28269
+TYR_954 -11.585 1.1135 3.41315 0.02667 0.27622 0.27396 -3.5244 0 0 -0.75988 -1.03545 0 -0.00317 1.52302 -0.3291 0.06695 0.58223 -0.06976 0.48727 -9.54375
+TYR_955 -10.4753 0.65373 4.01817 0.02198 0.25994 -0.10667 -1.76113 0 0 0 0 0 0.47661 1.25068 -0.23655 0.0963 0.58223 -0.22039 0.57721 -4.86316
+CYS:disulfide_956 -6.79449 0.66818 2.43143 0.00472 0.05753 -0.19525 -1.70157 0 0 0 0 -0.31692 0.00029 2.05596 0.00248 0 3.25479 -0.12313 0.70146 0.04548
+GLN_957 -9.69127 1.37293 5.94657 0.01194 0.29815 -0.13286 -2.20508 0 0 0 0 0 0.34292 3.98125 -0.11113 0 -1.45095 0.04111 0.80674 -0.78967
+GLN_958 -10.4157 0.96934 7.85605 0.01208 1.28834 0.32524 -4.73851 0 0 -2.10406 -1.44788 0 -0.02332 4.90282 0.1051 0 -1.45095 -0.03477 1.39978 -3.35648
+HIS_959 -7.58193 0.26807 4.67411 0.01584 1.03459 -0.84624 -0.54836 0 0 0 0 0 -0.02274 3.34497 -0.59352 0 -0.30065 0.09145 1.31351 0.8491
+TYR_960 -9.49466 1.2038 3.95296 0.06447 0.27973 -0.31134 -0.46921 0 0 -1.50449 0 0 -0.00966 6.74501 -0.09543 0.04184 0.58223 0.56112 1.76614 3.31251
+THR_961 -5.48447 0.39194 3.74027 0.00914 0.06915 -0.05023 -1.1435 0 0 -0.86166 -0.50539 0 -0.0087 0.3192 -0.66135 0 1.15175 0.35224 1.73486 -0.94673
+THR_962 -4.76511 1.26463 2.35196 0.00606 0.0491 -0.66723 0.50769 0 0 0 0 0 0.06245 0.05599 -0.14558 0 1.15175 0.18174 1.41381 1.46726
+PRO_963 -4.86048 1.24086 2.25829 0.00446 0.12861 0.0497 -0.46588 0 0 -0.58316 0 0 0.42801 0.15958 -0.84249 0 -1.64321 0.05411 1.83345 -2.23814
+PRO_964 -6.73966 0.82845 2.43347 0.0053 0.12906 -0.22078 -0.88693 0 0 0 0 0 0.15129 0.22866 -0.78835 0 -1.64321 -0.35535 1.6125 -5.24555
+THR_965 -5.91134 0.71129 5.38096 0.00517 0.09342 0.14364 -2.18487 0 0 0 -0.94249 0 0.03528 0.21156 -0.1996 0 1.15175 -0.29501 1.27149 -0.52873
+PHE_966 -8.78671 0.79816 1.16858 0.01962 0.21675 -0.35352 -0.45594 0 0 0 0 0 0.0682 1.57957 -0.38877 0 1.21829 -0.20642 0.74467 -4.37752
+GLY_967 -3.5129 0.34574 2.72753 0.00031 0 -0.11339 -0.47872 0 0 0 0 0 -0.05069 0 -0.49862 0 0.79816 -0.06992 0.45483 -0.39767
+GLN_968 -1.65016 0.04215 1.57288 0.00687 0.19305 -0.06001 -0.00833 0 0 0 0 0 -0.05926 2.31116 -0.25949 0 -1.45095 -0.16256 0.25251 0.72786
+GLY_969 -3.28545 0.37039 1.87898 8e-05 0 -0.20133 0.05115 0 0 0 0 0 -0.04695 0 -1.49241 0 0.79816 0.00437 0.10788 -1.81514
+THR_970 -7.01083 0.99153 4.35971 0.04485 0.09717 -0.17875 -2.10245 0 0 0 0 0 -0.00313 1.82915 -0.22353 0 1.15175 0.23634 0.53471 -0.27346
+LYS_971 -5.87294 0.33132 5.31729 0.0121 0.44384 0.38361 -3.54042 0 0 0 -0.75379 0 -0.06048 4.71963 0.35925 0 -0.71458 0.16115 0.85257 1.63856
+VAL_972 -6.6405 0.48357 0.62619 0.01602 0.04644 -0.241 -1.235 0 0 0 0 0 -0.00295 0.00968 -0.45225 0 2.64269 -0.08462 0.43923 -4.3925
+GLU_973 -5.17463 0.26347 4.97789 0.00663 0.26394 0.2833 -3.63217 0 0 0 -0.75379 0 0.10766 2.39586 0.05051 0 -2.72453 -0.23623 0.27701 -3.89507
+ILE_974 -6.2399 0.97536 0.38293 0.03194 0.06706 -0.01306 -0.50095 0 0 0 0 0 -0.04454 0.53359 -0.76256 0 2.30374 -0.24244 0.59624 -2.91258
+LYS:CtermProteinFull_975 -4.68884 0.18325 5.01561 0.01168 0.3361 -0.33615 -3.11239 0 0 -0.50481 0 0 0 2.46729 0 0 -0.71458 -0.21729 1.14235 -0.41779
+#END_POSE_ENERGIES_TABLE ./data/my_lab_test.pdb
+
diff --git a/9_xmlObject_RosettaScript/data/my_lab_test.pdb b/9_xmlObject_RosettaScript/data/my_lab_test.pdb
deleted file mode 100644
index 0780ce2..0000000
--- a/9_xmlObject_RosettaScript/data/my_lab_test.pdb
+++ /dev/null
@@ -1,16165 +0,0 @@
-HEADER 07-MAY-21 XXXX
-EXPDTA THEORETICAL MODEL
-REMARK 220
-REMARK 220 EXPERIMENTAL DETAILS
-REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
-REMARK 220 DATE OF DATA COLLECTION : 07-MAY-21
-REMARK 220
-REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
-REMARK 220 VERSION 2020.28+release.8ecab77aa50
-SSBOND CYS H 23 CYS H 106 2.02
-SSBOND CYS L 23 CYS L 106 2.03
-ATOM 1 N SER A 7 15.327 57.505 19.380 1.00 64.53 N
-ATOM 2 CA SER A 7 15.403 57.320 20.821 1.00 66.36 C
-ATOM 3 C SER A 7 14.015 57.100 21.412 1.00 64.54 C
-ATOM 4 O SER A 7 13.224 58.039 21.533 1.00 66.07 O
-ATOM 5 CB SER A 7 16.064 58.528 21.450 1.00 66.43 C
-ATOM 6 OG SER A 7 16.124 58.408 22.840 1.00 74.70 O
-ATOM 7 1H SER A 7 16.254 57.474 18.982 1.00 0.00 H
-ATOM 8 2H SER A 7 14.760 56.772 18.979 1.00 0.00 H
-ATOM 9 3H SER A 7 14.907 58.402 19.184 1.00 0.00 H
-ATOM 10 HA SER A 7 16.011 56.437 21.027 1.00 0.00 H
-ATOM 11 1HB SER A 7 17.071 58.636 21.049 1.00 0.00 H
-ATOM 12 2HB SER A 7 15.507 59.421 21.182 1.00 0.00 H
-ATOM 13 HG SER A 7 16.611 57.598 23.017 1.00 0.00 H
-ATOM 14 N ASP A 8 13.713 55.852 21.766 1.00 62.32 N
-ATOM 15 CA ASP A 8 12.409 55.494 22.325 1.00 62.01 C
-ATOM 16 C ASP A 8 12.145 56.165 23.669 1.00 59.03 C
-ATOM 17 O ASP A 8 13.080 56.430 24.440 1.00 54.13 O
-ATOM 18 CB ASP A 8 12.259 53.973 22.477 1.00 69.50 C
-ATOM 19 CG ASP A 8 12.138 53.246 21.129 1.00 77.46 C
-ATOM 20 OD1 ASP A 8 12.021 53.914 20.128 1.00 74.21 O
-ATOM 21 OD2 ASP A 8 12.144 52.034 21.111 1.00 73.17 O
-ATOM 22 H ASP A 8 14.401 55.121 21.651 1.00 0.00 H
-ATOM 23 HA ASP A 8 11.640 55.834 21.629 1.00 0.00 H
-ATOM 24 1HB ASP A 8 13.099 53.567 23.041 1.00 0.00 H
-ATOM 25 2HB ASP A 8 11.354 53.764 23.053 1.00 0.00 H
-ATOM 26 N PHE A 9 10.860 56.378 23.949 1.00 58.56 N
-ATOM 27 CA PHE A 9 10.383 56.960 25.197 1.00 58.32 C
-ATOM 28 C PHE A 9 9.115 56.278 25.661 1.00 59.17 C
-ATOM 29 O PHE A 9 8.468 55.567 24.885 1.00 58.66 O
-ATOM 30 CB PHE A 9 10.077 58.460 25.040 1.00 55.10 C
-ATOM 31 CG PHE A 9 8.951 58.797 24.110 1.00 54.54 C
-ATOM 32 CD1 PHE A 9 7.655 58.910 24.594 1.00 49.45 C
-ATOM 33 CD2 PHE A 9 9.178 59.037 22.766 1.00 54.85 C
-ATOM 34 CE1 PHE A 9 6.611 59.251 23.762 1.00 50.77 C
-ATOM 35 CE2 PHE A 9 8.131 59.378 21.932 1.00 47.68 C
-ATOM 36 CZ PHE A 9 6.851 59.486 22.437 1.00 54.78 C
-ATOM 37 H PHE A 9 10.177 56.134 23.246 1.00 0.00 H
-ATOM 38 HA PHE A 9 11.143 56.810 25.962 1.00 0.00 H
-ATOM 39 1HB PHE A 9 9.811 58.872 26.003 1.00 0.00 H
-ATOM 40 2HB PHE A 9 10.951 58.977 24.704 1.00 0.00 H
-ATOM 41 HD1 PHE A 9 7.472 58.722 25.651 1.00 0.00 H
-ATOM 42 HD2 PHE A 9 10.194 58.957 22.368 1.00 0.00 H
-ATOM 43 HE1 PHE A 9 5.601 59.335 24.162 1.00 0.00 H
-ATOM 44 HE2 PHE A 9 8.314 59.566 20.872 1.00 0.00 H
-ATOM 45 HZ PHE A 9 6.042 59.756 21.782 1.00 0.00 H
-ATOM 46 N VAL A 10 8.759 56.500 26.922 1.00 61.75 N
-ATOM 47 CA VAL A 10 7.524 55.959 27.475 1.00 63.36 C
-ATOM 48 C VAL A 10 6.681 57.079 28.071 1.00 64.89 C
-ATOM 49 O VAL A 10 7.207 58.135 28.434 1.00 65.32 O
-ATOM 50 CB VAL A 10 7.848 54.926 28.577 1.00 65.58 C
-ATOM 51 CG1 VAL A 10 8.684 53.787 27.996 1.00 59.15 C
-ATOM 52 CG2 VAL A 10 8.591 55.617 29.711 1.00 68.39 C
-ATOM 53 H VAL A 10 9.375 57.069 27.499 1.00 0.00 H
-ATOM 54 HA VAL A 10 6.954 55.475 26.680 1.00 0.00 H
-ATOM 55 HB VAL A 10 6.915 54.498 28.957 1.00 0.00 H
-ATOM 56 1HG1 VAL A 10 8.904 53.071 28.772 1.00 0.00 H
-ATOM 57 2HG1 VAL A 10 8.135 53.301 27.191 1.00 0.00 H
-ATOM 58 3HG1 VAL A 10 9.613 54.188 27.609 1.00 0.00 H
-ATOM 59 1HG2 VAL A 10 8.815 54.894 30.497 1.00 0.00 H
-ATOM 60 2HG2 VAL A 10 9.523 56.043 29.330 1.00 0.00 H
-ATOM 61 3HG2 VAL A 10 7.967 56.415 30.118 1.00 0.00 H
-ATOM 62 N VAL A 11 5.375 56.845 28.195 1.00 65.00 N
-ATOM 63 CA VAL A 11 4.471 57.818 28.810 1.00 63.60 C
-ATOM 64 C VAL A 11 3.896 57.241 30.088 1.00 63.86 C
-ATOM 65 O VAL A 11 3.282 56.179 30.057 1.00 62.20 O
-ATOM 66 CB VAL A 11 3.287 58.142 27.880 1.00 60.82 C
-ATOM 67 CG1 VAL A 11 2.357 59.130 28.545 1.00 64.97 C
-ATOM 68 CG2 VAL A 11 3.784 58.658 26.529 1.00 60.61 C
-ATOM 69 H VAL A 11 5.001 55.959 27.858 1.00 0.00 H
-ATOM 70 HA VAL A 11 5.021 58.727 29.047 1.00 0.00 H
-ATOM 71 HB VAL A 11 2.721 57.255 27.736 1.00 0.00 H
-ATOM 72 1HG1 VAL A 11 1.518 59.302 27.880 1.00 0.00 H
-ATOM 73 2HG1 VAL A 11 1.997 58.716 29.489 1.00 0.00 H
-ATOM 74 3HG1 VAL A 11 2.873 60.060 28.736 1.00 0.00 H
-ATOM 75 1HG2 VAL A 11 2.927 58.857 25.879 1.00 0.00 H
-ATOM 76 2HG2 VAL A 11 4.341 59.559 26.661 1.00 0.00 H
-ATOM 77 3HG2 VAL A 11 4.416 57.911 26.073 1.00 0.00 H
-ATOM 78 N ILE A 12 4.087 57.929 31.208 1.00 63.21 N
-ATOM 79 CA ILE A 12 3.588 57.432 32.485 1.00 63.26 C
-ATOM 80 C ILE A 12 2.616 58.421 33.142 1.00 63.26 C
-ATOM 81 O ILE A 12 2.981 59.562 33.427 1.00 63.46 O
-ATOM 82 CB ILE A 12 4.782 57.184 33.427 1.00 62.98 C
-ATOM 83 CG1 ILE A 12 5.755 56.166 32.780 1.00 60.93 C
-ATOM 84 CG2 ILE A 12 4.268 56.654 34.776 1.00 60.06 C
-ATOM 85 CD1 ILE A 12 7.073 56.092 33.458 1.00 60.67 C
-ATOM 86 H ILE A 12 4.616 58.791 31.177 1.00 0.00 H
-ATOM 87 HA ILE A 12 3.064 56.494 32.321 1.00 0.00 H
-ATOM 88 HB ILE A 12 5.330 58.115 33.579 1.00 0.00 H
-ATOM 89 1HG1 ILE A 12 5.308 55.191 32.812 1.00 0.00 H
-ATOM 90 2HG1 ILE A 12 5.931 56.433 31.744 1.00 0.00 H
-ATOM 91 1HG2 ILE A 12 5.101 56.476 35.442 1.00 0.00 H
-ATOM 92 2HG2 ILE A 12 3.598 57.391 35.223 1.00 0.00 H
-ATOM 93 3HG2 ILE A 12 3.726 55.723 34.622 1.00 0.00 H
-ATOM 94 1HD1 ILE A 12 7.701 55.351 32.962 1.00 0.00 H
-ATOM 95 2HD1 ILE A 12 7.556 57.068 33.414 1.00 0.00 H
-ATOM 96 3HD1 ILE A 12 6.923 55.814 34.483 1.00 0.00 H
-ATOM 97 N LYS A 13 1.377 57.975 33.397 1.00 62.74 N
-ATOM 98 CA LYS A 13 0.374 58.838 34.032 1.00 62.27 C
-ATOM 99 C LYS A 13 -0.006 58.390 35.426 1.00 62.08 C
-ATOM 100 O LYS A 13 -0.513 57.286 35.636 1.00 60.11 O
-ATOM 101 CB LYS A 13 -0.912 58.902 33.224 1.00 55.20 C
-ATOM 102 CG LYS A 13 -1.973 59.744 33.913 1.00 58.93 C
-ATOM 103 CD LYS A 13 -3.239 59.810 33.140 1.00 59.61 C
-ATOM 104 CE LYS A 13 -4.317 60.485 33.977 1.00 62.37 C
-ATOM 105 NZ LYS A 13 -5.567 60.664 33.226 1.00 59.33 N
-ATOM 106 H LYS A 13 1.125 57.031 33.132 1.00 0.00 H
-ATOM 107 HA LYS A 13 0.783 59.838 34.113 1.00 0.00 H
-ATOM 108 1HB LYS A 13 -0.713 59.315 32.239 1.00 0.00 H
-ATOM 109 2HB LYS A 13 -1.310 57.912 33.095 1.00 0.00 H
-ATOM 110 1HG LYS A 13 -2.190 59.328 34.899 1.00 0.00 H
-ATOM 111 2HG LYS A 13 -1.596 60.758 34.053 1.00 0.00 H
-ATOM 112 1HD LYS A 13 -3.078 60.386 32.229 1.00 0.00 H
-ATOM 113 2HD LYS A 13 -3.560 58.803 32.873 1.00 0.00 H
-ATOM 114 1HE LYS A 13 -4.517 59.867 34.849 1.00 0.00 H
-ATOM 115 2HE LYS A 13 -3.962 61.463 34.310 1.00 0.00 H
-ATOM 116 1HZ LYS A 13 -6.270 61.113 33.828 1.00 0.00 H
-ATOM 117 2HZ LYS A 13 -5.356 61.273 32.428 1.00 0.00 H
-ATOM 118 3HZ LYS A 13 -5.919 59.780 32.910 1.00 0.00 H
-ATOM 119 N ALA A 14 0.210 59.255 36.403 1.00 64.01 N
-ATOM 120 CA ALA A 14 -0.104 58.857 37.762 1.00 62.56 C
-ATOM 121 C ALA A 14 -1.600 58.722 37.963 1.00 61.38 C
-ATOM 122 O ALA A 14 -2.360 59.659 37.692 1.00 59.00 O
-ATOM 123 CB ALA A 14 0.447 59.858 38.740 1.00 65.80 C
-ATOM 124 H ALA A 14 0.598 60.180 36.199 1.00 0.00 H
-ATOM 125 HA ALA A 14 0.348 57.883 37.937 1.00 0.00 H
-ATOM 126 1HB ALA A 14 0.234 59.546 39.760 1.00 0.00 H
-ATOM 127 2HB ALA A 14 1.499 59.917 38.597 1.00 0.00 H
-ATOM 128 3HB ALA A 14 -0.002 60.821 38.551 1.00 0.00 H
-ATOM 129 N LEU A 15 -2.035 57.591 38.500 1.00 61.85 N
-ATOM 130 CA LEU A 15 -3.448 57.404 38.778 1.00 64.15 C
-ATOM 131 C LEU A 15 -3.726 57.602 40.271 1.00 66.00 C
-ATOM 132 O LEU A 15 -4.875 57.564 40.720 1.00 65.45 O
-ATOM 133 CB LEU A 15 -3.878 56.035 38.258 1.00 57.67 C
-ATOM 134 CG LEU A 15 -3.712 55.863 36.703 1.00 59.31 C
-ATOM 135 CD1 LEU A 15 -4.058 54.432 36.282 1.00 47.95 C
-ATOM 136 CD2 LEU A 15 -4.585 56.862 36.003 1.00 47.42 C
-ATOM 137 H LEU A 15 -1.391 56.829 38.715 1.00 0.00 H
-ATOM 138 HA LEU A 15 -4.011 58.160 38.232 1.00 0.00 H
-ATOM 139 1HB LEU A 15 -3.264 55.305 38.740 1.00 0.00 H
-ATOM 140 2HB LEU A 15 -4.919 55.854 38.524 1.00 0.00 H
-ATOM 141 HG LEU A 15 -2.698 56.059 36.422 1.00 0.00 H
-ATOM 142 1HD1 LEU A 15 -3.941 54.325 35.212 1.00 0.00 H
-ATOM 143 2HD1 LEU A 15 -3.393 53.738 36.773 1.00 0.00 H
-ATOM 144 3HD1 LEU A 15 -5.088 54.204 36.550 1.00 0.00 H
-ATOM 145 1HD2 LEU A 15 -4.461 56.763 34.925 1.00 0.00 H
-ATOM 146 2HD2 LEU A 15 -5.626 56.687 36.269 1.00 0.00 H
-ATOM 147 3HD2 LEU A 15 -4.292 57.866 36.313 1.00 0.00 H
-ATOM 148 N GLU A 16 -2.654 57.858 41.021 1.00 65.91 N
-ATOM 149 CA GLU A 16 -2.726 58.136 42.454 1.00 68.71 C
-ATOM 150 C GLU A 16 -1.556 59.017 42.877 1.00 69.35 C
-ATOM 151 O GLU A 16 -0.528 59.058 42.212 1.00 70.62 O
-ATOM 152 CB GLU A 16 -2.739 56.849 43.292 1.00 62.31 C
-ATOM 153 CG GLU A 16 -1.478 55.982 43.233 1.00 77.77 C
-ATOM 154 CD GLU A 16 -1.605 54.728 44.108 1.00 83.97 C
-ATOM 155 OE1 GLU A 16 -2.511 54.680 44.906 1.00 92.63 O
-ATOM 156 OE2 GLU A 16 -0.833 53.809 43.938 1.00 81.95 O
-ATOM 157 H GLU A 16 -1.753 57.864 40.566 1.00 0.00 H
-ATOM 158 HA GLU A 16 -3.647 58.680 42.657 1.00 0.00 H
-ATOM 159 1HB GLU A 16 -2.901 57.111 44.338 1.00 0.00 H
-ATOM 160 2HB GLU A 16 -3.575 56.222 42.980 1.00 0.00 H
-ATOM 161 1HG GLU A 16 -1.289 55.694 42.207 1.00 0.00 H
-ATOM 162 2HG GLU A 16 -0.622 56.574 43.577 1.00 0.00 H
-ATOM 163 N ASP A 17 -1.712 59.742 43.976 1.00 69.28 N
-ATOM 164 CA ASP A 17 -0.584 60.510 44.487 1.00 70.34 C
-ATOM 165 C ASP A 17 0.533 59.566 44.915 1.00 70.33 C
-ATOM 166 O ASP A 17 0.267 58.567 45.580 1.00 72.91 O
-ATOM 167 CB ASP A 17 -1.005 61.360 45.693 1.00 72.39 C
-ATOM 168 CG ASP A 17 -1.911 62.557 45.362 1.00 77.07 C
-ATOM 169 OD1 ASP A 17 -2.038 62.913 44.207 1.00 75.03 O
-ATOM 170 OD2 ASP A 17 -2.470 63.104 46.279 1.00 82.23 O
-ATOM 171 H ASP A 17 -2.586 59.717 44.481 1.00 0.00 H
-ATOM 172 HA ASP A 17 -0.204 61.152 43.700 1.00 0.00 H
-ATOM 173 1HB ASP A 17 -1.523 60.729 46.416 1.00 0.00 H
-ATOM 174 2HB ASP A 17 -0.107 61.740 46.182 1.00 0.00 H
-ATOM 175 N GLY A 18 1.784 59.924 44.635 1.00 67.68 N
-ATOM 176 CA GLY A 18 2.897 59.116 45.127 1.00 66.57 C
-ATOM 177 C GLY A 18 3.457 58.120 44.111 1.00 65.43 C
-ATOM 178 O GLY A 18 4.144 57.170 44.487 1.00 64.56 O
-ATOM 179 H GLY A 18 1.969 60.732 44.040 1.00 0.00 H
-ATOM 180 1HA GLY A 18 3.698 59.783 45.442 1.00 0.00 H
-ATOM 181 2HA GLY A 18 2.578 58.578 46.018 1.00 0.00 H
-ATOM 182 N VAL A 19 3.146 58.310 42.838 1.00 62.00 N
-ATOM 183 CA VAL A 19 3.694 57.421 41.816 1.00 60.98 C
-ATOM 184 C VAL A 19 5.167 57.722 41.669 1.00 60.74 C
-ATOM 185 O VAL A 19 5.570 58.885 41.672 1.00 61.30 O
-ATOM 186 CB VAL A 19 2.928 57.531 40.495 1.00 65.68 C
-ATOM 187 CG1 VAL A 19 3.646 56.769 39.368 1.00 73.10 C
-ATOM 188 CG2 VAL A 19 1.571 56.926 40.713 1.00 65.45 C
-ATOM 189 H VAL A 19 2.591 59.119 42.574 1.00 0.00 H
-ATOM 190 HA VAL A 19 3.588 56.391 42.159 1.00 0.00 H
-ATOM 191 HB VAL A 19 2.831 58.545 40.226 1.00 0.00 H
-ATOM 192 1HG1 VAL A 19 3.079 56.860 38.448 1.00 0.00 H
-ATOM 193 2HG1 VAL A 19 4.639 57.192 39.214 1.00 0.00 H
-ATOM 194 3HG1 VAL A 19 3.736 55.715 39.639 1.00 0.00 H
-ATOM 195 1HG2 VAL A 19 0.989 56.986 39.823 1.00 0.00 H
-ATOM 196 2HG2 VAL A 19 1.683 55.884 40.993 1.00 0.00 H
-ATOM 197 3HG2 VAL A 19 1.071 57.454 41.507 1.00 0.00 H
-ATOM 198 N ASN A 20 5.978 56.678 41.610 1.00 59.70 N
-ATOM 199 CA ASN A 20 7.421 56.854 41.573 1.00 60.64 C
-ATOM 200 C ASN A 20 8.062 56.211 40.354 1.00 60.03 C
-ATOM 201 O ASN A 20 7.959 54.998 40.144 1.00 56.10 O
-ATOM 202 CB ASN A 20 8.026 56.325 42.862 1.00 63.15 C
-ATOM 203 CG ASN A 20 9.480 56.601 43.013 1.00 63.24 C
-ATOM 204 OD1 ASN A 20 10.213 55.774 43.565 1.00 59.55 O
-ATOM 205 ND2 ASN A 20 9.916 57.741 42.567 1.00 63.52 N
-ATOM 206 H ASN A 20 5.578 55.742 41.600 1.00 0.00 H
-ATOM 207 HA ASN A 20 7.636 57.921 41.511 1.00 0.00 H
-ATOM 208 1HB ASN A 20 7.499 56.759 43.714 1.00 0.00 H
-ATOM 209 2HB ASN A 20 7.884 55.257 42.910 1.00 0.00 H
-ATOM 210 1HD2 ASN A 20 10.883 57.977 42.673 1.00 0.00 H
-ATOM 211 2HD2 ASN A 20 9.288 58.393 42.137 1.00 0.00 H
-ATOM 212 N VAL A 21 8.666 57.050 39.511 1.00 60.07 N
-ATOM 213 CA VAL A 21 9.316 56.591 38.297 1.00 60.61 C
-ATOM 214 C VAL A 21 10.826 56.661 38.516 1.00 60.58 C
-ATOM 215 O VAL A 21 11.375 57.718 38.839 1.00 60.68 O
-ATOM 216 CB VAL A 21 8.898 57.457 37.102 1.00 56.51 C
-ATOM 217 CG1 VAL A 21 9.588 56.951 35.858 1.00 67.59 C
-ATOM 218 CG2 VAL A 21 7.375 57.428 36.972 1.00 45.89 C
-ATOM 219 H VAL A 21 8.699 58.042 39.736 1.00 0.00 H
-ATOM 220 HA VAL A 21 9.032 55.557 38.102 1.00 0.00 H
-ATOM 221 HB VAL A 21 9.227 58.483 37.262 1.00 0.00 H
-ATOM 222 1HG1 VAL A 21 9.311 57.560 35.008 1.00 0.00 H
-ATOM 223 2HG1 VAL A 21 10.668 56.993 35.993 1.00 0.00 H
-ATOM 224 3HG1 VAL A 21 9.284 55.926 35.683 1.00 0.00 H
-ATOM 225 1HG2 VAL A 21 7.066 58.044 36.129 1.00 0.00 H
-ATOM 226 2HG2 VAL A 21 7.049 56.406 36.817 1.00 0.00 H
-ATOM 227 3HG2 VAL A 21 6.926 57.818 37.886 1.00 0.00 H
-ATOM 228 N ILE A 22 11.489 55.521 38.393 1.00 59.37 N
-ATOM 229 CA ILE A 22 12.896 55.428 38.729 1.00 60.60 C
-ATOM 230 C ILE A 22 13.781 55.165 37.521 1.00 62.32 C
-ATOM 231 O ILE A 22 13.532 54.249 36.734 1.00 61.31 O
-ATOM 232 CB ILE A 22 13.096 54.308 39.756 1.00 61.02 C
-ATOM 233 CG1 ILE A 22 12.279 54.605 41.005 1.00 65.63 C
-ATOM 234 CG2 ILE A 22 14.559 54.186 40.113 1.00 63.20 C
-ATOM 235 CD1 ILE A 22 12.188 53.436 41.942 1.00 56.85 C
-ATOM 236 H ILE A 22 10.990 54.690 38.107 1.00 0.00 H
-ATOM 237 HA ILE A 22 13.203 56.366 39.179 1.00 0.00 H
-ATOM 238 HB ILE A 22 12.743 53.387 39.351 1.00 0.00 H
-ATOM 239 1HG1 ILE A 22 12.731 55.445 41.533 1.00 0.00 H
-ATOM 240 2HG1 ILE A 22 11.266 54.882 40.716 1.00 0.00 H
-ATOM 241 1HG2 ILE A 22 14.693 53.393 40.845 1.00 0.00 H
-ATOM 242 2HG2 ILE A 22 15.143 53.958 39.226 1.00 0.00 H
-ATOM 243 3HG2 ILE A 22 14.895 55.136 40.535 1.00 0.00 H
-ATOM 244 1HD1 ILE A 22 11.595 53.717 42.805 1.00 0.00 H
-ATOM 245 2HD1 ILE A 22 11.712 52.597 41.428 1.00 0.00 H
-ATOM 246 3HD1 ILE A 22 13.186 53.148 42.266 1.00 0.00 H
-ATOM 247 N GLY A 23 14.814 55.993 37.363 1.00 61.71 N
-ATOM 248 CA GLY A 23 15.770 55.809 36.278 1.00 59.83 C
-ATOM 249 C GLY A 23 16.909 54.909 36.741 1.00 60.23 C
-ATOM 250 O GLY A 23 17.576 55.208 37.744 1.00 60.12 O
-ATOM 251 H GLY A 23 14.957 56.732 38.046 1.00 0.00 H
-ATOM 252 1HA GLY A 23 15.273 55.363 35.415 1.00 0.00 H
-ATOM 253 2HA GLY A 23 16.167 56.775 35.966 1.00 0.00 H
-ATOM 254 N LEU A 24 17.150 53.835 35.973 1.00 59.28 N
-ATOM 255 CA LEU A 24 18.187 52.833 36.242 1.00 58.97 C
-ATOM 256 C LEU A 24 19.355 53.018 35.283 1.00 59.13 C
-ATOM 257 O LEU A 24 19.166 53.138 34.060 1.00 60.17 O
-ATOM 258 CB LEU A 24 17.619 51.418 36.088 1.00 59.13 C
-ATOM 259 CG LEU A 24 16.711 50.884 37.229 1.00 62.56 C
-ATOM 260 CD1 LEU A 24 15.348 51.568 37.162 1.00 59.34 C
-ATOM 261 CD2 LEU A 24 16.554 49.367 37.090 1.00 54.54 C
-ATOM 262 H LEU A 24 16.549 53.672 35.168 1.00 0.00 H
-ATOM 263 HA LEU A 24 18.552 52.955 37.253 1.00 0.00 H
-ATOM 264 1HB LEU A 24 17.029 51.428 35.203 1.00 0.00 H
-ATOM 265 2HB LEU A 24 18.444 50.718 35.951 1.00 0.00 H
-ATOM 266 HG LEU A 24 17.163 51.120 38.194 1.00 0.00 H
-ATOM 267 1HD1 LEU A 24 14.721 51.201 37.969 1.00 0.00 H
-ATOM 268 2HD1 LEU A 24 15.468 52.629 37.265 1.00 0.00 H
-ATOM 269 3HD1 LEU A 24 14.873 51.353 36.206 1.00 0.00 H
-ATOM 270 1HD2 LEU A 24 15.918 48.986 37.896 1.00 0.00 H
-ATOM 271 2HD2 LEU A 24 16.098 49.135 36.132 1.00 0.00 H
-ATOM 272 3HD2 LEU A 24 17.533 48.892 37.152 1.00 0.00 H
-ATOM 273 N THR A 25 20.561 53.037 35.849 1.00 57.76 N
-ATOM 274 CA THR A 25 21.767 53.365 35.102 1.00 56.48 C
-ATOM 275 C THR A 25 22.179 52.409 34.002 1.00 55.43 C
-ATOM 276 O THR A 25 22.067 51.191 34.124 1.00 56.07 O
-ATOM 277 CB THR A 25 22.976 53.481 36.046 1.00 54.68 C
-ATOM 278 OG1 THR A 25 23.153 52.240 36.785 1.00 53.29 O
-ATOM 279 CG2 THR A 25 22.801 54.638 36.981 1.00 49.72 C
-ATOM 280 H THR A 25 20.632 52.885 36.852 1.00 0.00 H
-ATOM 281 HA THR A 25 21.600 54.335 34.658 1.00 0.00 H
-ATOM 282 HB THR A 25 23.875 53.658 35.457 1.00 0.00 H
-ATOM 283 HG1 THR A 25 23.803 51.675 36.322 1.00 0.00 H
-ATOM 284 1HG2 THR A 25 23.670 54.710 37.616 1.00 0.00 H
-ATOM 285 2HG2 THR A 25 22.701 55.551 36.395 1.00 0.00 H
-ATOM 286 3HG2 THR A 25 21.913 54.500 37.587 1.00 0.00 H
-ATOM 287 N ARG A 26 22.738 53.011 32.956 1.00 50.88 N
-ATOM 288 CA ARG A 26 23.352 52.296 31.850 1.00 50.96 C
-ATOM 289 C ARG A 26 24.801 51.988 32.200 1.00 50.16 C
-ATOM 290 O ARG A 26 25.545 52.875 32.620 1.00 52.95 O
-ATOM 291 CB ARG A 26 23.310 53.133 30.573 1.00 57.08 C
-ATOM 292 CG ARG A 26 23.814 52.420 29.301 1.00 56.91 C
-ATOM 293 CD ARG A 26 23.743 53.311 28.100 1.00 52.19 C
-ATOM 294 NE ARG A 26 22.384 53.700 27.803 1.00 53.31 N
-ATOM 295 CZ ARG A 26 21.513 52.999 27.064 1.00 52.33 C
-ATOM 296 NH1 ARG A 26 21.848 51.860 26.476 1.00 42.38 N
-ATOM 297 NH2 ARG A 26 20.307 53.492 26.937 1.00 33.33 N
-ATOM 298 H ARG A 26 22.716 54.025 32.939 1.00 0.00 H
-ATOM 299 HA ARG A 26 22.819 51.359 31.691 1.00 0.00 H
-ATOM 300 1HB ARG A 26 22.294 53.480 30.390 1.00 0.00 H
-ATOM 301 2HB ARG A 26 23.931 54.020 30.710 1.00 0.00 H
-ATOM 302 1HG ARG A 26 24.855 52.122 29.435 1.00 0.00 H
-ATOM 303 2HG ARG A 26 23.208 51.536 29.106 1.00 0.00 H
-ATOM 304 1HD ARG A 26 24.328 54.203 28.272 1.00 0.00 H
-ATOM 305 2HD ARG A 26 24.137 52.786 27.234 1.00 0.00 H
-ATOM 306 HE ARG A 26 22.028 54.579 28.196 1.00 0.00 H
-ATOM 307 1HH1 ARG A 26 22.807 51.491 26.540 1.00 0.00 H
-ATOM 308 2HH1 ARG A 26 21.165 51.368 25.915 1.00 0.00 H
-ATOM 309 1HH2 ARG A 26 20.101 54.383 27.402 1.00 0.00 H
-ATOM 310 2HH2 ARG A 26 19.586 53.012 26.405 1.00 0.00 H
-ATOM 311 N GLY A 27 25.209 50.736 32.035 1.00 46.18 N
-ATOM 312 CA GLY A 27 26.584 50.354 32.334 1.00 43.60 C
-ATOM 313 C GLY A 27 26.664 49.029 33.076 1.00 45.91 C
-ATOM 314 O GLY A 27 25.650 48.384 33.339 1.00 43.71 O
-ATOM 315 H GLY A 27 24.557 50.041 31.699 1.00 0.00 H
-ATOM 316 1HA GLY A 27 27.145 50.282 31.402 1.00 0.00 H
-ATOM 317 2HA GLY A 27 27.059 51.132 32.929 1.00 0.00 H
-ATOM 318 N ALA A 28 27.886 48.615 33.401 1.00 46.85 N
-ATOM 319 CA ALA A 28 28.125 47.346 34.081 1.00 51.44 C
-ATOM 320 C ALA A 28 27.427 47.274 35.445 1.00 53.56 C
-ATOM 321 O ALA A 28 26.954 46.218 35.845 1.00 52.26 O
-ATOM 322 CB ALA A 28 29.618 47.119 34.252 1.00 55.36 C
-ATOM 323 H ALA A 28 28.676 49.198 33.161 1.00 0.00 H
-ATOM 324 HA ALA A 28 27.712 46.550 33.455 1.00 0.00 H
-ATOM 325 1HB ALA A 28 29.787 46.154 34.727 1.00 0.00 H
-ATOM 326 2HB ALA A 28 30.106 47.136 33.279 1.00 0.00 H
-ATOM 327 3HB ALA A 28 30.036 47.904 34.879 1.00 0.00 H
-ATOM 328 N ASP A 29 27.391 48.405 36.158 1.00 56.21 N
-ATOM 329 CA ASP A 29 26.765 48.456 37.480 1.00 58.82 C
-ATOM 330 C ASP A 29 25.350 49.027 37.395 1.00 59.82 C
-ATOM 331 O ASP A 29 25.164 50.181 37.009 1.00 56.73 O
-ATOM 332 CB ASP A 29 27.586 49.325 38.440 1.00 60.94 C
-ATOM 333 CG ASP A 29 28.956 48.722 38.788 1.00 63.44 C
-ATOM 334 OD1 ASP A 29 29.061 47.524 38.879 1.00 59.74 O
-ATOM 335 OD2 ASP A 29 29.884 49.477 38.946 1.00 74.04 O
-ATOM 336 H ASP A 29 27.796 49.240 35.770 1.00 0.00 H
-ATOM 337 HA ASP A 29 26.704 47.447 37.881 1.00 0.00 H
-ATOM 338 1HB ASP A 29 27.725 50.319 38.017 1.00 0.00 H
-ATOM 339 2HB ASP A 29 27.021 49.445 39.371 1.00 0.00 H
-ATOM 340 N THR A 30 24.355 48.231 37.775 1.00 60.02 N
-ATOM 341 CA THR A 30 22.982 48.721 37.698 1.00 61.53 C
-ATOM 342 C THR A 30 22.489 49.220 39.053 1.00 63.28 C
-ATOM 343 O THR A 30 22.457 48.477 40.033 1.00 62.62 O
-ATOM 344 CB THR A 30 22.023 47.626 37.196 1.00 59.84 C
-ATOM 345 OG1 THR A 30 22.415 47.201 35.885 1.00 49.99 O
-ATOM 346 CG2 THR A 30 20.586 48.157 37.149 1.00 53.90 C
-ATOM 347 H THR A 30 24.544 47.288 38.086 1.00 0.00 H
-ATOM 348 HA THR A 30 22.949 49.554 36.995 1.00 0.00 H
-ATOM 349 HB THR A 30 22.069 46.778 37.864 1.00 0.00 H
-ATOM 350 HG1 THR A 30 23.280 46.786 35.934 1.00 0.00 H
-ATOM 351 1HG2 THR A 30 19.922 47.371 36.796 1.00 0.00 H
-ATOM 352 2HG2 THR A 30 20.281 48.464 38.150 1.00 0.00 H
-ATOM 353 3HG2 THR A 30 20.527 49.014 36.473 1.00 0.00 H
-ATOM 354 N ARG A 31 22.108 50.491 39.088 1.00 63.49 N
-ATOM 355 CA ARG A 31 21.584 51.161 40.275 1.00 65.18 C
-ATOM 356 C ARG A 31 20.686 52.305 39.853 1.00 64.74 C
-ATOM 357 O ARG A 31 20.698 52.697 38.689 1.00 65.15 O
-ATOM 358 CB ARG A 31 22.717 51.620 41.195 1.00 75.69 C
-ATOM 359 CG ARG A 31 23.878 52.382 40.521 1.00 76.75 C
-ATOM 360 CD ARG A 31 23.699 53.858 40.399 1.00 87.42 C
-ATOM 361 NE ARG A 31 23.798 54.587 41.658 1.00 92.50 N
-ATOM 362 CZ ARG A 31 23.890 55.934 41.731 1.00 94.26 C
-ATOM 363 NH1 ARG A 31 23.940 56.647 40.624 1.00 99.16 N
-ATOM 364 NH2 ARG A 31 23.938 56.539 42.907 1.00 88.82 N
-ATOM 365 H ARG A 31 22.225 51.047 38.241 1.00 0.00 H
-ATOM 366 HA ARG A 31 20.981 50.447 40.835 1.00 0.00 H
-ATOM 367 1HB ARG A 31 22.305 52.276 41.965 1.00 0.00 H
-ATOM 368 2HB ARG A 31 23.142 50.752 41.700 1.00 0.00 H
-ATOM 369 1HG ARG A 31 24.780 52.215 41.111 1.00 0.00 H
-ATOM 370 2HG ARG A 31 24.031 51.983 39.514 1.00 0.00 H
-ATOM 371 1HD ARG A 31 24.475 54.231 39.736 1.00 0.00 H
-ATOM 372 2HD ARG A 31 22.722 54.066 39.964 1.00 0.00 H
-ATOM 373 HE ARG A 31 23.759 54.065 42.523 1.00 0.00 H
-ATOM 374 1HH1 ARG A 31 23.910 56.183 39.726 1.00 0.00 H
-ATOM 375 2HH1 ARG A 31 24.016 57.654 40.672 1.00 0.00 H
-ATOM 376 1HH2 ARG A 31 23.900 55.996 43.758 1.00 0.00 H
-ATOM 377 2HH2 ARG A 31 24.005 57.545 42.950 1.00 0.00 H
-ATOM 378 N PHE A 32 19.841 52.808 40.741 1.00 63.97 N
-ATOM 379 CA PHE A 32 19.048 53.934 40.283 1.00 62.82 C
-ATOM 380 C PHE A 32 19.894 55.183 40.360 1.00 62.98 C
-ATOM 381 O PHE A 32 20.803 55.261 41.187 1.00 63.26 O
-ATOM 382 CB PHE A 32 17.774 54.127 41.097 1.00 55.19 C
-ATOM 383 CG PHE A 32 17.963 54.606 42.491 1.00 59.90 C
-ATOM 384 CD1 PHE A 32 18.076 53.725 43.555 1.00 54.51 C
-ATOM 385 CD2 PHE A 32 18.008 55.967 42.744 1.00 47.78 C
-ATOM 386 CE1 PHE A 32 18.240 54.206 44.846 1.00 50.96 C
-ATOM 387 CE2 PHE A 32 18.170 56.451 44.019 1.00 53.18 C
-ATOM 388 CZ PHE A 32 18.288 55.570 45.077 1.00 56.35 C
-ATOM 389 H PHE A 32 19.784 52.465 41.689 1.00 0.00 H
-ATOM 390 HA PHE A 32 18.765 53.770 39.252 1.00 0.00 H
-ATOM 391 1HB PHE A 32 17.169 54.865 40.583 1.00 0.00 H
-ATOM 392 2HB PHE A 32 17.212 53.197 41.123 1.00 0.00 H
-ATOM 393 HD1 PHE A 32 18.033 52.653 43.371 1.00 0.00 H
-ATOM 394 HD2 PHE A 32 17.911 56.659 41.910 1.00 0.00 H
-ATOM 395 HE1 PHE A 32 18.329 53.510 45.680 1.00 0.00 H
-ATOM 396 HE2 PHE A 32 18.203 57.527 44.195 1.00 0.00 H
-ATOM 397 HZ PHE A 32 18.416 55.950 46.090 1.00 0.00 H
-ATOM 398 N HIS A 33 19.574 56.174 39.546 1.00 62.81 N
-ATOM 399 CA HIS A 33 20.277 57.442 39.640 1.00 62.14 C
-ATOM 400 C HIS A 33 19.288 58.575 39.824 1.00 61.91 C
-ATOM 401 O HIS A 33 19.661 59.685 40.201 1.00 63.67 O
-ATOM 402 CB HIS A 33 21.126 57.681 38.392 1.00 57.62 C
-ATOM 403 CG HIS A 33 20.329 57.866 37.137 1.00 51.11 C
-ATOM 404 ND1 HIS A 33 19.779 59.080 36.800 1.00 49.41 N
-ATOM 405 CD2 HIS A 33 19.969 57.006 36.150 1.00 47.03 C
-ATOM 406 CE1 HIS A 33 19.122 58.965 35.668 1.00 52.69 C
-ATOM 407 NE2 HIS A 33 19.221 57.723 35.252 1.00 47.96 N
-ATOM 408 H HIS A 33 18.837 56.028 38.863 1.00 0.00 H
-ATOM 409 HA HIS A 33 20.935 57.438 40.506 1.00 0.00 H
-ATOM 410 1HB HIS A 33 21.740 58.573 38.538 1.00 0.00 H
-ATOM 411 2HB HIS A 33 21.796 56.852 38.260 1.00 0.00 H
-ATOM 412 HD2 HIS A 33 20.216 55.950 36.079 1.00 0.00 H
-ATOM 413 HE1 HIS A 33 18.587 59.767 35.162 1.00 0.00 H
-ATOM 414 HE2 HIS A 33 18.803 57.376 34.401 1.00 0.00 H
-ATOM 415 N HIS A 34 18.011 58.276 39.606 1.00 61.22 N
-ATOM 416 CA HIS A 34 16.995 59.309 39.755 1.00 62.91 C
-ATOM 417 C HIS A 34 15.631 58.755 40.110 1.00 65.74 C
-ATOM 418 O HIS A 34 15.186 57.738 39.580 1.00 67.49 O
-ATOM 419 CB HIS A 34 16.874 60.185 38.506 1.00 55.28 C
-ATOM 420 CG HIS A 34 15.905 61.321 38.701 1.00 62.67 C
-ATOM 421 ND1 HIS A 34 16.188 62.402 39.511 1.00 64.16 N
-ATOM 422 CD2 HIS A 34 14.664 61.539 38.203 1.00 55.53 C
-ATOM 423 CE1 HIS A 34 15.159 63.239 39.500 1.00 59.90 C
-ATOM 424 NE2 HIS A 34 14.222 62.738 38.717 1.00 58.89 N
-ATOM 425 H HIS A 34 17.767 57.343 39.278 1.00 0.00 H
-ATOM 426 HA HIS A 34 17.286 59.967 40.571 1.00 0.00 H
-ATOM 427 1HB HIS A 34 17.851 60.611 38.265 1.00 0.00 H
-ATOM 428 2HB HIS A 34 16.557 59.581 37.656 1.00 0.00 H
-ATOM 429 HD2 HIS A 34 14.113 60.886 37.527 1.00 0.00 H
-ATOM 430 HE1 HIS A 34 15.101 64.180 40.043 1.00 0.00 H
-ATOM 431 HE2 HIS A 34 13.305 63.172 38.522 1.00 0.00 H
-ATOM 432 N SER A 35 14.958 59.466 41.006 1.00 64.56 N
-ATOM 433 CA SER A 35 13.620 59.112 41.458 1.00 63.21 C
-ATOM 434 C SER A 35 12.666 60.293 41.280 1.00 61.22 C
-ATOM 435 O SER A 35 12.777 61.299 41.983 1.00 60.06 O
-ATOM 436 CB SER A 35 13.717 58.711 42.917 1.00 64.59 C
-ATOM 437 OG SER A 35 12.467 58.445 43.489 1.00 68.56 O
-ATOM 438 H SER A 35 15.391 60.298 41.385 1.00 0.00 H
-ATOM 439 HA SER A 35 13.255 58.272 40.866 1.00 0.00 H
-ATOM 440 1HB SER A 35 14.350 57.828 42.992 1.00 0.00 H
-ATOM 441 2HB SER A 35 14.209 59.512 43.478 1.00 0.00 H
-ATOM 442 HG SER A 35 12.647 58.152 44.393 1.00 0.00 H
-ATOM 443 N GLU A 36 11.747 60.168 40.318 1.00 61.12 N
-ATOM 444 CA GLU A 36 10.801 61.231 39.993 1.00 60.74 C
-ATOM 445 C GLU A 36 9.417 60.910 40.551 1.00 63.17 C
-ATOM 446 O GLU A 36 8.852 59.849 40.263 1.00 64.23 O
-ATOM 447 CB GLU A 36 10.703 61.437 38.470 1.00 50.64 C
-ATOM 448 CG GLU A 36 9.804 62.603 38.049 1.00 56.96 C
-ATOM 449 CD GLU A 36 10.438 63.964 38.254 1.00 56.34 C
-ATOM 450 OE1 GLU A 36 11.642 64.058 38.417 1.00 52.58 O
-ATOM 451 OE2 GLU A 36 9.694 64.926 38.272 1.00 56.42 O
-ATOM 452 H GLU A 36 11.702 59.302 39.786 1.00 0.00 H
-ATOM 453 HA GLU A 36 11.145 62.157 40.453 1.00 0.00 H
-ATOM 454 1HB GLU A 36 11.688 61.617 38.061 1.00 0.00 H
-ATOM 455 2HB GLU A 36 10.317 60.533 38.002 1.00 0.00 H
-ATOM 456 1HG GLU A 36 9.576 62.505 36.997 1.00 0.00 H
-ATOM 457 2HG GLU A 36 8.867 62.550 38.602 1.00 0.00 H
-ATOM 458 N LYS A 37 8.876 61.792 41.383 1.00 64.07 N
-ATOM 459 CA LYS A 37 7.560 61.526 41.947 1.00 63.03 C
-ATOM 460 C LYS A 37 6.473 62.197 41.117 1.00 62.23 C
-ATOM 461 O LYS A 37 6.682 63.286 40.574 1.00 61.53 O
-ATOM 462 CB LYS A 37 7.485 62.016 43.393 1.00 60.64 C
-ATOM 463 CG LYS A 37 7.638 63.526 43.552 1.00 48.56 C
-ATOM 464 CD LYS A 37 7.605 63.942 45.024 1.00 45.00 C
-ATOM 465 CE LYS A 37 7.681 65.462 45.188 1.00 45.00 C
-ATOM 466 NZ LYS A 37 7.625 65.870 46.625 1.00 45.00 N
-ATOM 467 H LYS A 37 9.370 62.645 41.608 1.00 0.00 H
-ATOM 468 HA LYS A 37 7.384 60.453 41.933 1.00 0.00 H
-ATOM 469 1HB LYS A 37 6.523 61.732 43.820 1.00 0.00 H
-ATOM 470 2HB LYS A 37 8.265 61.534 43.983 1.00 0.00 H
-ATOM 471 1HG LYS A 37 8.585 63.841 43.110 1.00 0.00 H
-ATOM 472 2HG LYS A 37 6.823 64.025 43.024 1.00 0.00 H
-ATOM 473 1HD LYS A 37 6.683 63.580 45.482 1.00 0.00 H
-ATOM 474 2HD LYS A 37 8.450 63.492 45.543 1.00 0.00 H
-ATOM 475 1HE LYS A 37 8.614 65.821 44.754 1.00 0.00 H
-ATOM 476 2HE LYS A 37 6.845 65.921 44.657 1.00 0.00 H
-ATOM 477 1HZ LYS A 37 7.678 66.877 46.693 1.00 0.00 H
-ATOM 478 2HZ LYS A 37 6.756 65.552 47.033 1.00 0.00 H
-ATOM 479 3HZ LYS A 37 8.401 65.459 47.125 1.00 0.00 H
-ATOM 480 N LEU A 38 5.301 61.572 41.074 1.00 63.28 N
-ATOM 481 CA LEU A 38 4.152 62.162 40.413 1.00 64.65 C
-ATOM 482 C LEU A 38 2.952 62.266 41.366 1.00 64.86 C
-ATOM 483 O LEU A 38 2.650 61.333 42.130 1.00 63.90 O
-ATOM 484 CB LEU A 38 3.751 61.321 39.194 1.00 69.39 C
-ATOM 485 CG LEU A 38 4.784 61.116 38.070 1.00 68.99 C
-ATOM 486 CD1 LEU A 38 4.215 60.114 37.041 1.00 64.34 C
-ATOM 487 CD2 LEU A 38 5.082 62.429 37.414 1.00 68.85 C
-ATOM 488 H LEU A 38 5.215 60.655 41.504 1.00 0.00 H
-ATOM 489 HA LEU A 38 4.411 63.165 40.082 1.00 0.00 H
-ATOM 490 1HB LEU A 38 3.513 60.367 39.547 1.00 0.00 H
-ATOM 491 2HB LEU A 38 2.860 61.757 38.756 1.00 0.00 H
-ATOM 492 HG LEU A 38 5.703 60.700 38.491 1.00 0.00 H
-ATOM 493 1HD1 LEU A 38 4.938 59.949 36.242 1.00 0.00 H
-ATOM 494 2HD1 LEU A 38 4.004 59.168 37.537 1.00 0.00 H
-ATOM 495 3HD1 LEU A 38 3.291 60.514 36.615 1.00 0.00 H
-ATOM 496 1HD2 LEU A 38 5.811 62.287 36.637 1.00 0.00 H
-ATOM 497 2HD2 LEU A 38 4.171 62.833 36.987 1.00 0.00 H
-ATOM 498 3HD2 LEU A 38 5.472 63.114 38.159 1.00 0.00 H
-ATOM 499 N ASP A 39 2.230 63.374 41.254 1.00 66.46 N
-ATOM 500 CA ASP A 39 0.956 63.549 41.946 1.00 70.77 C
-ATOM 501 C ASP A 39 -0.118 62.981 41.034 1.00 71.03 C
-ATOM 502 O ASP A 39 0.113 62.861 39.828 1.00 71.26 O
-ATOM 503 CB ASP A 39 0.675 65.018 42.247 1.00 73.51 C
-ATOM 504 CG ASP A 39 1.639 65.652 43.273 1.00 79.26 C
-ATOM 505 OD1 ASP A 39 2.375 64.932 43.910 1.00 76.25 O
-ATOM 506 OD2 ASP A 39 1.630 66.851 43.392 1.00 79.55 O
-ATOM 507 H ASP A 39 2.570 64.112 40.630 1.00 0.00 H
-ATOM 508 HA ASP A 39 0.963 62.991 42.878 1.00 0.00 H
-ATOM 509 1HB ASP A 39 0.709 65.597 41.320 1.00 0.00 H
-ATOM 510 2HB ASP A 39 -0.345 65.102 42.641 1.00 0.00 H
-ATOM 511 N LYS A 40 -1.279 62.636 41.567 1.00 71.50 N
-ATOM 512 CA LYS A 40 -2.322 62.101 40.709 1.00 72.03 C
-ATOM 513 C LYS A 40 -2.607 63.035 39.551 1.00 70.68 C
-ATOM 514 O LYS A 40 -2.826 64.235 39.744 1.00 71.21 O
-ATOM 515 CB LYS A 40 -3.607 61.843 41.495 1.00 80.15 C
-ATOM 516 CG LYS A 40 -4.731 61.228 40.670 1.00 83.75 C
-ATOM 517 CD LYS A 40 -5.907 60.815 41.543 1.00 86.43 C
-ATOM 518 CE LYS A 40 -7.003 60.172 40.715 1.00 93.75 C
-ATOM 519 NZ LYS A 40 -8.125 59.711 41.558 1.00 93.09 N
-ATOM 520 H LYS A 40 -1.449 62.737 42.570 1.00 0.00 H
-ATOM 521 HA LYS A 40 -1.978 61.152 40.294 1.00 0.00 H
-ATOM 522 1HB LYS A 40 -3.399 61.192 42.327 1.00 0.00 H
-ATOM 523 2HB LYS A 40 -3.968 62.782 41.911 1.00 0.00 H
-ATOM 524 1HG LYS A 40 -5.086 61.965 39.946 1.00 0.00 H
-ATOM 525 2HG LYS A 40 -4.361 60.367 40.123 1.00 0.00 H
-ATOM 526 1HD LYS A 40 -5.566 60.093 42.286 1.00 0.00 H
-ATOM 527 2HD LYS A 40 -6.308 61.683 42.064 1.00 0.00 H
-ATOM 528 1HE LYS A 40 -7.375 60.896 39.994 1.00 0.00 H
-ATOM 529 2HE LYS A 40 -6.592 59.318 40.180 1.00 0.00 H
-ATOM 530 1HZ LYS A 40 -8.831 59.287 40.974 1.00 0.00 H
-ATOM 531 2HZ LYS A 40 -7.780 59.028 42.222 1.00 0.00 H
-ATOM 532 3HZ LYS A 40 -8.519 60.496 42.053 1.00 0.00 H
-ATOM 533 N GLY A 41 -2.609 62.487 38.345 1.00 70.24 N
-ATOM 534 CA GLY A 41 -2.874 63.268 37.152 1.00 68.92 C
-ATOM 535 C GLY A 41 -1.621 63.776 36.445 1.00 67.30 C
-ATOM 536 O GLY A 41 -1.714 64.257 35.314 1.00 65.89 O
-ATOM 537 H GLY A 41 -2.419 61.493 38.233 1.00 0.00 H
-ATOM 538 1HA GLY A 41 -3.462 62.667 36.460 1.00 0.00 H
-ATOM 539 2HA GLY A 41 -3.492 64.122 37.428 1.00 0.00 H
-ATOM 540 N GLU A 42 -0.451 63.695 37.074 1.00 66.36 N
-ATOM 541 CA GLU A 42 0.730 64.179 36.366 1.00 65.68 C
-ATOM 542 C GLU A 42 1.179 63.173 35.316 1.00 66.54 C
-ATOM 543 O GLU A 42 1.104 61.955 35.517 1.00 63.80 O
-ATOM 544 CB GLU A 42 1.891 64.530 37.316 1.00 69.87 C
-ATOM 545 CG GLU A 42 1.666 65.785 38.163 1.00 70.15 C
-ATOM 546 CD GLU A 42 2.885 66.210 38.992 1.00 73.10 C
-ATOM 547 OE1 GLU A 42 3.447 65.396 39.672 1.00 75.10 O
-ATOM 548 OE2 GLU A 42 3.251 67.358 38.928 1.00 75.22 O
-ATOM 549 H GLU A 42 -0.381 63.315 38.016 1.00 0.00 H
-ATOM 550 HA GLU A 42 0.456 65.097 35.841 1.00 0.00 H
-ATOM 551 1HB GLU A 42 2.052 63.715 38.002 1.00 0.00 H
-ATOM 552 2HB GLU A 42 2.806 64.675 36.737 1.00 0.00 H
-ATOM 553 1HG GLU A 42 1.389 66.604 37.498 1.00 0.00 H
-ATOM 554 2HG GLU A 42 0.829 65.606 38.839 1.00 0.00 H
-ATOM 555 N VAL A 43 1.656 63.694 34.184 1.00 66.18 N
-ATOM 556 CA VAL A 43 2.148 62.828 33.119 1.00 66.16 C
-ATOM 557 C VAL A 43 3.620 63.056 32.834 1.00 65.52 C
-ATOM 558 O VAL A 43 4.062 64.186 32.623 1.00 67.03 O
-ATOM 559 CB VAL A 43 1.336 63.025 31.812 1.00 64.68 C
-ATOM 560 CG1 VAL A 43 1.929 62.173 30.704 1.00 63.66 C
-ATOM 561 CG2 VAL A 43 -0.119 62.613 32.033 1.00 69.19 C
-ATOM 562 H VAL A 43 1.681 64.708 34.075 1.00 0.00 H
-ATOM 563 HA VAL A 43 2.023 61.797 33.434 1.00 0.00 H
-ATOM 564 HB VAL A 43 1.383 64.067 31.507 1.00 0.00 H
-ATOM 565 1HG1 VAL A 43 1.360 62.313 29.790 1.00 0.00 H
-ATOM 566 2HG1 VAL A 43 2.960 62.467 30.537 1.00 0.00 H
-ATOM 567 3HG1 VAL A 43 1.892 61.123 31.003 1.00 0.00 H
-ATOM 568 1HG2 VAL A 43 -0.687 62.750 31.111 1.00 0.00 H
-ATOM 569 2HG2 VAL A 43 -0.148 61.577 32.321 1.00 0.00 H
-ATOM 570 3HG2 VAL A 43 -0.551 63.220 32.823 1.00 0.00 H
-ATOM 571 N LEU A 44 4.384 61.975 32.848 1.00 61.32 N
-ATOM 572 CA LEU A 44 5.803 62.050 32.551 1.00 61.08 C
-ATOM 573 C LEU A 44 6.118 61.321 31.261 1.00 62.23 C
-ATOM 574 O LEU A 44 5.817 60.138 31.111 1.00 59.65 O
-ATOM 575 CB LEU A 44 6.626 61.442 33.687 1.00 47.63 C
-ATOM 576 CG LEU A 44 8.148 61.412 33.474 1.00 56.70 C
-ATOM 577 CD1 LEU A 44 8.694 62.858 33.408 1.00 51.48 C
-ATOM 578 CD2 LEU A 44 8.775 60.636 34.614 1.00 54.45 C
-ATOM 579 H LEU A 44 3.959 61.077 33.058 1.00 0.00 H
-ATOM 580 HA LEU A 44 6.084 63.092 32.430 1.00 0.00 H
-ATOM 581 1HB LEU A 44 6.444 62.019 34.570 1.00 0.00 H
-ATOM 582 2HB LEU A 44 6.286 60.420 33.861 1.00 0.00 H
-ATOM 583 HG LEU A 44 8.378 60.920 32.527 1.00 0.00 H
-ATOM 584 1HD1 LEU A 44 9.769 62.835 33.255 1.00 0.00 H
-ATOM 585 2HD1 LEU A 44 8.224 63.387 32.580 1.00 0.00 H
-ATOM 586 3HD1 LEU A 44 8.473 63.374 34.342 1.00 0.00 H
-ATOM 587 1HD2 LEU A 44 9.857 60.594 34.483 1.00 0.00 H
-ATOM 588 2HD2 LEU A 44 8.542 61.123 35.555 1.00 0.00 H
-ATOM 589 3HD2 LEU A 44 8.370 59.631 34.622 1.00 0.00 H
-ATOM 590 N ILE A 45 6.708 62.032 30.317 1.00 62.42 N
-ATOM 591 CA ILE A 45 7.082 61.418 29.063 1.00 62.97 C
-ATOM 592 C ILE A 45 8.607 61.405 29.033 1.00 62.35 C
-ATOM 593 O ILE A 45 9.237 62.458 29.109 1.00 63.74 O
-ATOM 594 CB ILE A 45 6.510 62.196 27.875 1.00 58.18 C
-ATOM 595 CG1 ILE A 45 4.978 62.300 28.041 1.00 62.85 C
-ATOM 596 CG2 ILE A 45 6.834 61.402 26.637 1.00 55.96 C
-ATOM 597 CD1 ILE A 45 4.265 63.192 27.064 1.00 53.51 C
-ATOM 598 H ILE A 45 6.905 63.012 30.472 1.00 0.00 H
-ATOM 599 HA ILE A 45 6.717 60.400 29.030 1.00 0.00 H
-ATOM 600 HB ILE A 45 6.935 63.198 27.822 1.00 0.00 H
-ATOM 601 1HG1 ILE A 45 4.568 61.318 27.966 1.00 0.00 H
-ATOM 602 2HG1 ILE A 45 4.774 62.683 29.036 1.00 0.00 H
-ATOM 603 1HG2 ILE A 45 6.437 61.886 25.754 1.00 0.00 H
-ATOM 604 2HG2 ILE A 45 7.909 61.293 26.546 1.00 0.00 H
-ATOM 605 3HG2 ILE A 45 6.396 60.424 26.742 1.00 0.00 H
-ATOM 606 1HD1 ILE A 45 3.204 63.182 27.295 1.00 0.00 H
-ATOM 607 2HD1 ILE A 45 4.644 64.213 27.143 1.00 0.00 H
-ATOM 608 3HD1 ILE A 45 4.418 62.825 26.058 1.00 0.00 H
-ATOM 609 N ALA A 46 9.219 60.228 28.969 1.00 59.08 N
-ATOM 610 CA ALA A 46 10.674 60.221 29.134 1.00 58.00 C
-ATOM 611 C ALA A 46 11.403 59.238 28.247 1.00 57.62 C
-ATOM 612 O ALA A 46 10.961 58.108 28.031 1.00 57.16 O
-ATOM 613 CB ALA A 46 11.000 59.899 30.585 1.00 37.50 C
-ATOM 614 H ALA A 46 8.675 59.375 28.855 1.00 0.00 H
-ATOM 615 HA ALA A 46 11.048 61.212 28.889 1.00 0.00 H
-ATOM 616 1HB ALA A 46 12.082 59.931 30.725 1.00 0.00 H
-ATOM 617 2HB ALA A 46 10.525 60.628 31.239 1.00 0.00 H
-ATOM 618 3HB ALA A 46 10.631 58.902 30.823 1.00 0.00 H
-ATOM 619 N GLN A 47 12.559 59.690 27.755 1.00 56.21 N
-ATOM 620 CA GLN A 47 13.424 58.908 26.883 1.00 51.34 C
-ATOM 621 C GLN A 47 14.425 58.050 27.612 1.00 51.04 C
-ATOM 622 O GLN A 47 14.859 58.371 28.721 1.00 51.15 O
-ATOM 623 CB GLN A 47 14.214 59.819 25.946 1.00 41.00 C
-ATOM 624 CG GLN A 47 13.408 60.556 24.931 1.00 48.77 C
-ATOM 625 CD GLN A 47 14.286 61.403 24.073 1.00 55.93 C
-ATOM 626 OE1 GLN A 47 15.157 62.121 24.583 1.00 47.66 O
-ATOM 627 NE2 GLN A 47 14.080 61.337 22.767 1.00 55.77 N
-ATOM 628 H GLN A 47 12.854 60.642 27.980 1.00 0.00 H
-ATOM 629 HA GLN A 47 12.808 58.252 26.283 1.00 0.00 H
-ATOM 630 1HB GLN A 47 14.753 60.558 26.540 1.00 0.00 H
-ATOM 631 2HB GLN A 47 14.960 59.226 25.409 1.00 0.00 H
-ATOM 632 1HG GLN A 47 12.940 59.829 24.276 1.00 0.00 H
-ATOM 633 2HG GLN A 47 12.660 61.177 25.424 1.00 0.00 H
-ATOM 634 1HE2 GLN A 47 14.639 61.880 22.143 1.00 0.00 H
-ATOM 635 2HE2 GLN A 47 13.362 60.729 22.408 1.00 0.00 H
-ATOM 636 N PHE A 48 14.857 57.002 26.932 1.00 50.70 N
-ATOM 637 CA PHE A 48 15.985 56.220 27.410 1.00 48.14 C
-ATOM 638 C PHE A 48 17.220 56.946 26.884 1.00 45.85 C
-ATOM 639 O PHE A 48 17.201 57.474 25.770 1.00 43.27 O
-ATOM 640 CB PHE A 48 15.906 54.794 26.913 1.00 50.53 C
-ATOM 641 CG PHE A 48 14.754 54.031 27.499 1.00 62.60 C
-ATOM 642 CD1 PHE A 48 14.851 53.395 28.730 1.00 62.69 C
-ATOM 643 CD2 PHE A 48 13.554 53.957 26.807 1.00 59.59 C
-ATOM 644 CE1 PHE A 48 13.763 52.712 29.241 1.00 61.44 C
-ATOM 645 CE2 PHE A 48 12.482 53.279 27.321 1.00 64.07 C
-ATOM 646 CZ PHE A 48 12.588 52.662 28.541 1.00 61.04 C
-ATOM 647 H PHE A 48 14.401 56.767 26.049 1.00 0.00 H
-ATOM 648 HA PHE A 48 16.010 56.223 28.502 1.00 0.00 H
-ATOM 649 1HB PHE A 48 15.806 54.795 25.833 1.00 0.00 H
-ATOM 650 2HB PHE A 48 16.829 54.273 27.171 1.00 0.00 H
-ATOM 651 HD1 PHE A 48 15.788 53.443 29.291 1.00 0.00 H
-ATOM 652 HD2 PHE A 48 13.469 54.454 25.843 1.00 0.00 H
-ATOM 653 HE1 PHE A 48 13.826 52.223 30.198 1.00 0.00 H
-ATOM 654 HE2 PHE A 48 11.550 53.236 26.764 1.00 0.00 H
-ATOM 655 HZ PHE A 48 11.745 52.144 28.954 1.00 0.00 H
-ATOM 656 N THR A 49 18.259 57.036 27.705 1.00 43.74 N
-ATOM 657 CA THR A 49 19.438 57.835 27.357 1.00 42.31 C
-ATOM 658 C THR A 49 20.741 57.102 27.565 1.00 43.90 C
-ATOM 659 O THR A 49 20.766 55.976 28.060 1.00 44.06 O
-ATOM 660 CB THR A 49 19.520 59.126 28.197 1.00 44.65 C
-ATOM 661 OG1 THR A 49 19.822 58.799 29.569 1.00 43.68 O
-ATOM 662 CG2 THR A 49 18.204 59.895 28.155 1.00 33.48 C
-ATOM 663 H THR A 49 18.233 56.518 28.577 1.00 0.00 H
-ATOM 664 HA THR A 49 19.377 58.108 26.305 1.00 0.00 H
-ATOM 665 HB THR A 49 20.317 59.756 27.801 1.00 0.00 H
-ATOM 666 HG1 THR A 49 18.993 58.579 30.013 1.00 0.00 H
-ATOM 667 1HG2 THR A 49 18.304 60.799 28.753 1.00 0.00 H
-ATOM 668 2HG2 THR A 49 17.961 60.160 27.133 1.00 0.00 H
-ATOM 669 3HG2 THR A 49 17.405 59.279 28.564 1.00 0.00 H
-ATOM 670 N GLU A 50 21.835 57.795 27.264 1.00 46.59 N
-ATOM 671 CA GLU A 50 23.176 57.298 27.529 1.00 49.74 C
-ATOM 672 C GLU A 50 23.440 57.059 29.030 1.00 52.34 C
-ATOM 673 O GLU A 50 24.425 56.408 29.378 1.00 52.44 O
-ATOM 674 CB GLU A 50 24.223 58.237 26.915 1.00 45.07 C
-ATOM 675 CG GLU A 50 24.143 59.687 27.363 1.00 46.55 C
-ATOM 676 CD GLU A 50 23.225 60.516 26.483 1.00 50.29 C
-ATOM 677 OE1 GLU A 50 22.422 59.940 25.783 1.00 42.16 O
-ATOM 678 OE2 GLU A 50 23.336 61.718 26.502 1.00 47.10 O
-ATOM 679 H GLU A 50 21.733 58.706 26.848 1.00 0.00 H
-ATOM 680 HA GLU A 50 23.277 56.338 27.022 1.00 0.00 H
-ATOM 681 1HB GLU A 50 25.220 57.874 27.171 1.00 0.00 H
-ATOM 682 2HB GLU A 50 24.140 58.215 25.828 1.00 0.00 H
-ATOM 683 1HG GLU A 50 23.761 59.712 28.376 1.00 0.00 H
-ATOM 684 2HG GLU A 50 25.142 60.125 27.367 1.00 0.00 H
-ATOM 685 N HIS A 51 22.585 57.593 29.921 1.00 53.98 N
-ATOM 686 CA HIS A 51 22.744 57.335 31.347 1.00 56.34 C
-ATOM 687 C HIS A 51 21.622 56.444 31.900 1.00 56.49 C
-ATOM 688 O HIS A 51 21.843 55.751 32.889 1.00 57.07 O
-ATOM 689 CB HIS A 51 22.827 58.634 32.170 1.00 58.09 C
-ATOM 690 CG HIS A 51 24.055 59.479 31.890 1.00 56.54 C
-ATOM 691 ND1 HIS A 51 24.066 60.501 30.971 1.00 51.61 N
-ATOM 692 CD2 HIS A 51 25.302 59.442 32.425 1.00 55.51 C
-ATOM 693 CE1 HIS A 51 25.269 61.052 30.942 1.00 55.25 C
-ATOM 694 NE2 HIS A 51 26.036 60.432 31.816 1.00 55.53 N
-ATOM 695 H HIS A 51 21.786 58.140 29.614 1.00 0.00 H
-ATOM 696 HA HIS A 51 23.679 56.799 31.506 1.00 0.00 H
-ATOM 697 1HB HIS A 51 21.939 59.241 31.985 1.00 0.00 H
-ATOM 698 2HB HIS A 51 22.830 58.381 33.231 1.00 0.00 H
-ATOM 699 HD2 HIS A 51 25.657 58.755 33.193 1.00 0.00 H
-ATOM 700 HE1 HIS A 51 25.571 61.883 30.305 1.00 0.00 H
-ATOM 701 HE2 HIS A 51 27.006 60.643 32.010 1.00 0.00 H
-ATOM 702 N THR A 52 20.440 56.431 31.248 1.00 55.95 N
-ATOM 703 CA THR A 52 19.305 55.606 31.723 1.00 55.53 C
-ATOM 704 C THR A 52 18.993 54.469 30.744 1.00 54.31 C
-ATOM 705 O THR A 52 18.587 54.715 29.607 1.00 51.75 O
-ATOM 706 CB THR A 52 17.993 56.427 31.861 1.00 54.69 C
-ATOM 707 OG1 THR A 52 18.170 57.498 32.791 1.00 51.90 O
-ATOM 708 CG2 THR A 52 16.851 55.513 32.359 1.00 59.06 C
-ATOM 709 H THR A 52 20.322 57.030 30.444 1.00 0.00 H
-ATOM 710 HA THR A 52 19.560 55.173 32.686 1.00 0.00 H
-ATOM 711 HB THR A 52 17.714 56.843 30.893 1.00 0.00 H
-ATOM 712 HG1 THR A 52 18.668 58.201 32.371 1.00 0.00 H
-ATOM 713 1HG2 THR A 52 15.931 56.087 32.456 1.00 0.00 H
-ATOM 714 2HG2 THR A 52 16.690 54.699 31.650 1.00 0.00 H
-ATOM 715 3HG2 THR A 52 17.119 55.094 33.329 1.00 0.00 H
-ATOM 716 N SER A 53 19.130 53.221 31.204 1.00 52.03 N
-ATOM 717 CA SER A 53 18.869 52.067 30.339 1.00 50.05 C
-ATOM 718 C SER A 53 17.541 51.403 30.674 1.00 51.33 C
-ATOM 719 O SER A 53 17.011 50.608 29.892 1.00 48.56 O
-ATOM 720 CB SER A 53 19.971 51.048 30.441 1.00 43.36 C
-ATOM 721 OG SER A 53 20.035 50.513 31.720 1.00 44.49 O
-ATOM 722 H SER A 53 19.425 53.084 32.171 1.00 0.00 H
-ATOM 723 HA SER A 53 18.822 52.410 29.303 1.00 0.00 H
-ATOM 724 1HB SER A 53 19.791 50.258 29.723 1.00 0.00 H
-ATOM 725 2HB SER A 53 20.911 51.512 30.186 1.00 0.00 H
-ATOM 726 HG SER A 53 19.176 50.112 31.878 1.00 0.00 H
-ATOM 727 N ALA A 54 16.998 51.724 31.844 1.00 55.98 N
-ATOM 728 CA ALA A 54 15.726 51.129 32.237 1.00 56.93 C
-ATOM 729 C ALA A 54 14.922 52.073 33.123 1.00 59.86 C
-ATOM 730 O ALA A 54 15.475 52.899 33.853 1.00 61.62 O
-ATOM 731 CB ALA A 54 15.952 49.793 32.930 1.00 52.60 C
-ATOM 732 H ALA A 54 17.492 52.362 32.469 1.00 0.00 H
-ATOM 733 HA ALA A 54 15.149 50.950 31.338 1.00 0.00 H
-ATOM 734 1HB ALA A 54 14.988 49.355 33.176 1.00 0.00 H
-ATOM 735 2HB ALA A 54 16.490 49.131 32.256 1.00 0.00 H
-ATOM 736 3HB ALA A 54 16.523 49.914 33.819 1.00 0.00 H
-ATOM 737 N ILE A 55 13.602 51.919 33.057 1.00 59.66 N
-ATOM 738 CA ILE A 55 12.674 52.690 33.869 1.00 58.59 C
-ATOM 739 C ILE A 55 11.779 51.782 34.711 1.00 60.57 C
-ATOM 740 O ILE A 55 11.139 50.861 34.202 1.00 59.82 O
-ATOM 741 CB ILE A 55 11.812 53.623 32.983 1.00 55.51 C
-ATOM 742 CG1 ILE A 55 12.724 54.640 32.233 1.00 56.38 C
-ATOM 743 CG2 ILE A 55 10.794 54.344 33.833 1.00 58.01 C
-ATOM 744 CD1 ILE A 55 12.007 55.457 31.165 1.00 44.38 C
-ATOM 745 H ILE A 55 13.233 51.215 32.427 1.00 0.00 H
-ATOM 746 HA ILE A 55 13.249 53.313 34.545 1.00 0.00 H
-ATOM 747 HB ILE A 55 11.295 53.030 32.228 1.00 0.00 H
-ATOM 748 1HG1 ILE A 55 13.157 55.325 32.965 1.00 0.00 H
-ATOM 749 2HG1 ILE A 55 13.529 54.103 31.753 1.00 0.00 H
-ATOM 750 1HG2 ILE A 55 10.190 54.993 33.204 1.00 0.00 H
-ATOM 751 2HG2 ILE A 55 10.151 53.622 34.330 1.00 0.00 H
-ATOM 752 3HG2 ILE A 55 11.317 54.940 34.582 1.00 0.00 H
-ATOM 753 1HD1 ILE A 55 12.718 56.138 30.688 1.00 0.00 H
-ATOM 754 2HD1 ILE A 55 11.590 54.789 30.413 1.00 0.00 H
-ATOM 755 3HD1 ILE A 55 11.205 56.035 31.621 1.00 0.00 H
-ATOM 756 N LYS A 56 11.750 52.035 36.011 1.00 59.42 N
-ATOM 757 CA LYS A 56 10.928 51.245 36.921 1.00 57.24 C
-ATOM 758 C LYS A 56 9.790 52.095 37.462 1.00 56.92 C
-ATOM 759 O LYS A 56 10.010 53.241 37.853 1.00 56.72 O
-ATOM 760 CB LYS A 56 11.783 50.664 38.039 1.00 56.10 C
-ATOM 761 CG LYS A 56 11.054 49.811 39.049 1.00 53.90 C
-ATOM 762 CD LYS A 56 12.042 49.282 40.070 1.00 59.89 C
-ATOM 763 CE LYS A 56 11.381 48.404 41.116 1.00 64.48 C
-ATOM 764 NZ LYS A 56 12.387 47.879 42.079 1.00 58.61 N
-ATOM 765 H LYS A 56 12.315 52.802 36.370 1.00 0.00 H
-ATOM 766 HA LYS A 56 10.488 50.418 36.369 1.00 0.00 H
-ATOM 767 1HB LYS A 56 12.555 50.037 37.597 1.00 0.00 H
-ATOM 768 2HB LYS A 56 12.280 51.447 38.569 1.00 0.00 H
-ATOM 769 1HG LYS A 56 10.294 50.405 39.562 1.00 0.00 H
-ATOM 770 2HG LYS A 56 10.563 48.976 38.541 1.00 0.00 H
-ATOM 771 1HD LYS A 56 12.818 48.698 39.562 1.00 0.00 H
-ATOM 772 2HD LYS A 56 12.522 50.125 40.571 1.00 0.00 H
-ATOM 773 1HE LYS A 56 10.634 48.984 41.657 1.00 0.00 H
-ATOM 774 2HE LYS A 56 10.890 47.569 40.625 1.00 0.00 H
-ATOM 775 1HZ LYS A 56 11.933 47.286 42.773 1.00 0.00 H
-ATOM 776 2HZ LYS A 56 13.103 47.338 41.564 1.00 0.00 H
-ATOM 777 3HZ LYS A 56 12.837 48.649 42.544 1.00 0.00 H
-ATOM 778 N VAL A 57 8.569 51.571 37.438 1.00 57.34 N
-ATOM 779 CA VAL A 57 7.435 52.355 37.907 1.00 57.15 C
-ATOM 780 C VAL A 57 6.697 51.682 39.063 1.00 56.87 C
-ATOM 781 O VAL A 57 6.337 50.498 39.003 1.00 55.15 O
-ATOM 782 CB VAL A 57 6.458 52.629 36.755 1.00 54.06 C
-ATOM 783 CG1 VAL A 57 5.283 53.500 37.261 1.00 57.42 C
-ATOM 784 CG2 VAL A 57 7.213 53.286 35.624 1.00 55.16 C
-ATOM 785 H VAL A 57 8.431 50.627 37.085 1.00 0.00 H
-ATOM 786 HA VAL A 57 7.806 53.317 38.260 1.00 0.00 H
-ATOM 787 HB VAL A 57 6.037 51.686 36.407 1.00 0.00 H
-ATOM 788 1HG1 VAL A 57 4.585 53.691 36.453 1.00 0.00 H
-ATOM 789 2HG1 VAL A 57 4.755 52.987 38.068 1.00 0.00 H
-ATOM 790 3HG1 VAL A 57 5.669 54.449 37.630 1.00 0.00 H
-ATOM 791 1HG2 VAL A 57 6.536 53.474 34.796 1.00 0.00 H
-ATOM 792 2HG2 VAL A 57 7.634 54.218 35.979 1.00 0.00 H
-ATOM 793 3HG2 VAL A 57 8.015 52.629 35.288 1.00 0.00 H
-ATOM 794 N ARG A 58 6.482 52.466 40.123 1.00 59.08 N
-ATOM 795 CA ARG A 58 5.802 52.029 41.337 1.00 60.21 C
-ATOM 796 C ARG A 58 4.556 52.883 41.615 1.00 60.83 C
-ATOM 797 O ARG A 58 4.610 54.113 41.544 1.00 58.14 O
-ATOM 798 CB ARG A 58 6.759 52.200 42.511 1.00 59.41 C
-ATOM 799 CG ARG A 58 8.077 51.439 42.396 1.00 65.47 C
-ATOM 800 CD ARG A 58 9.098 51.902 43.403 1.00 71.61 C
-ATOM 801 NE ARG A 58 8.691 51.672 44.783 1.00 73.27 N
-ATOM 802 CZ ARG A 58 9.327 52.190 45.861 1.00 72.95 C
-ATOM 803 NH1 ARG A 58 10.394 52.945 45.695 1.00 75.68 N
-ATOM 804 NH2 ARG A 58 8.879 51.940 47.083 1.00 71.22 N
-ATOM 805 H ARG A 58 6.840 53.418 40.091 1.00 0.00 H
-ATOM 806 HA ARG A 58 5.512 50.982 41.228 1.00 0.00 H
-ATOM 807 1HB ARG A 58 6.992 53.248 42.632 1.00 0.00 H
-ATOM 808 2HB ARG A 58 6.265 51.869 43.424 1.00 0.00 H
-ATOM 809 1HG ARG A 58 7.899 50.382 42.545 1.00 0.00 H
-ATOM 810 2HG ARG A 58 8.501 51.598 41.404 1.00 0.00 H
-ATOM 811 1HD ARG A 58 10.027 51.357 43.233 1.00 0.00 H
-ATOM 812 2HD ARG A 58 9.278 52.973 43.274 1.00 0.00 H
-ATOM 813 HE ARG A 58 7.876 51.090 44.945 1.00 0.00 H
-ATOM 814 1HH1 ARG A 58 10.746 53.133 44.763 1.00 0.00 H
-ATOM 815 2HH1 ARG A 58 10.868 53.335 46.499 1.00 0.00 H
-ATOM 816 1HH2 ARG A 58 8.061 51.361 47.217 1.00 0.00 H
-ATOM 817 2HH2 ARG A 58 9.360 52.330 47.883 1.00 0.00 H
-ATOM 818 N GLY A 59 3.451 52.259 42.015 1.00 62.16 N
-ATOM 819 CA GLY A 59 2.236 53.007 42.337 1.00 64.97 C
-ATOM 820 C GLY A 59 1.301 52.974 41.141 1.00 65.60 C
-ATOM 821 O GLY A 59 1.746 52.835 40.004 1.00 65.34 O
-ATOM 822 H GLY A 59 3.394 51.239 42.057 1.00 0.00 H
-ATOM 823 1HA GLY A 59 1.744 52.553 43.197 1.00 0.00 H
-ATOM 824 2HA GLY A 59 2.480 54.034 42.605 1.00 0.00 H
-ATOM 825 N LYS A 60 0.006 53.096 41.380 1.00 66.84 N
-ATOM 826 CA LYS A 60 -0.937 52.963 40.280 1.00 68.13 C
-ATOM 827 C LYS A 60 -0.671 54.003 39.198 1.00 68.47 C
-ATOM 828 O LYS A 60 -0.753 55.208 39.461 1.00 67.78 O
-ATOM 829 CB LYS A 60 -2.376 53.077 40.801 1.00 71.37 C
-ATOM 830 CG LYS A 60 -3.473 52.710 39.800 1.00 76.47 C
-ATOM 831 CD LYS A 60 -3.688 51.210 39.639 1.00 74.48 C
-ATOM 832 CE LYS A 60 -4.497 50.644 40.814 1.00 80.28 C
-ATOM 833 NZ LYS A 60 -4.995 49.240 40.578 1.00 45.00 N
-ATOM 834 H LYS A 60 -0.321 53.257 42.331 1.00 0.00 H
-ATOM 835 HA LYS A 60 -0.807 51.995 39.830 1.00 0.00 H
-ATOM 836 1HB LYS A 60 -2.486 52.439 41.677 1.00 0.00 H
-ATOM 837 2HB LYS A 60 -2.569 54.098 41.117 1.00 0.00 H
-ATOM 838 1HG LYS A 60 -4.410 53.188 40.086 1.00 0.00 H
-ATOM 839 2HG LYS A 60 -3.179 53.072 38.840 1.00 0.00 H
-ATOM 840 1HD LYS A 60 -4.202 51.002 38.703 1.00 0.00 H
-ATOM 841 2HD LYS A 60 -2.713 50.734 39.616 1.00 0.00 H
-ATOM 842 1HE LYS A 60 -3.869 50.650 41.699 1.00 0.00 H
-ATOM 843 2HE LYS A 60 -5.357 51.290 40.981 1.00 0.00 H
-ATOM 844 1HZ LYS A 60 -5.526 48.946 41.384 1.00 0.00 H
-ATOM 845 2HZ LYS A 60 -5.590 49.243 39.769 1.00 0.00 H
-ATOM 846 3HZ LYS A 60 -4.248 48.548 40.421 1.00 0.00 H
-ATOM 847 N ALA A 61 -0.389 53.540 37.980 1.00 68.39 N
-ATOM 848 CA ALA A 61 -0.099 54.462 36.878 1.00 65.65 C
-ATOM 849 C ALA A 61 -0.331 53.838 35.499 1.00 63.73 C
-ATOM 850 O ALA A 61 0.019 52.676 35.249 1.00 61.42 O
-ATOM 851 CB ALA A 61 1.332 54.965 36.980 1.00 66.40 C
-ATOM 852 H ALA A 61 -0.351 52.529 37.847 1.00 0.00 H
-ATOM 853 HA ALA A 61 -0.763 55.307 36.983 1.00 0.00 H
-ATOM 854 1HB ALA A 61 1.520 55.689 36.193 1.00 0.00 H
-ATOM 855 2HB ALA A 61 1.457 55.430 37.944 1.00 0.00 H
-ATOM 856 3HB ALA A 61 2.030 54.149 36.886 1.00 0.00 H
-ATOM 857 N TYR A 62 -0.894 54.629 34.583 1.00 63.14 N
-ATOM 858 CA TYR A 62 -1.153 54.165 33.218 1.00 61.11 C
-ATOM 859 C TYR A 62 0.116 54.356 32.404 1.00 60.20 C
-ATOM 860 O TYR A 62 0.658 55.462 32.373 1.00 58.27 O
-ATOM 861 CB TYR A 62 -2.300 54.940 32.561 1.00 61.88 C
-ATOM 862 CG TYR A 62 -2.793 54.324 31.273 1.00 63.93 C
-ATOM 863 CD1 TYR A 62 -3.651 53.247 31.355 1.00 63.12 C
-ATOM 864 CD2 TYR A 62 -2.406 54.804 30.030 1.00 66.03 C
-ATOM 865 CE1 TYR A 62 -4.139 52.649 30.220 1.00 65.22 C
-ATOM 866 CE2 TYR A 62 -2.901 54.201 28.881 1.00 66.26 C
-ATOM 867 CZ TYR A 62 -3.768 53.129 28.981 1.00 67.76 C
-ATOM 868 OH TYR A 62 -4.283 52.535 27.853 1.00 71.17 O
-ATOM 869 H TYR A 62 -1.120 55.586 34.849 1.00 0.00 H
-ATOM 870 HA TYR A 62 -1.393 53.102 33.234 1.00 0.00 H
-ATOM 871 1HB TYR A 62 -3.138 55.009 33.240 1.00 0.00 H
-ATOM 872 2HB TYR A 62 -1.981 55.947 32.342 1.00 0.00 H
-ATOM 873 HD1 TYR A 62 -3.954 52.874 32.330 1.00 0.00 H
-ATOM 874 HD2 TYR A 62 -1.723 55.647 29.957 1.00 0.00 H
-ATOM 875 HE1 TYR A 62 -4.825 51.802 30.306 1.00 0.00 H
-ATOM 876 HE2 TYR A 62 -2.613 54.571 27.907 1.00 0.00 H
-ATOM 877 HH TYR A 62 -3.996 53.019 27.079 1.00 0.00 H
-ATOM 878 N ILE A 63 0.617 53.301 31.771 1.00 58.98 N
-ATOM 879 CA ILE A 63 1.859 53.444 31.030 1.00 56.93 C
-ATOM 880 C ILE A 63 1.707 53.093 29.545 1.00 53.18 C
-ATOM 881 O ILE A 63 1.170 52.040 29.188 1.00 52.64 O
-ATOM 882 CB ILE A 63 2.943 52.552 31.641 1.00 54.48 C
-ATOM 883 CG1 ILE A 63 3.158 52.887 33.100 1.00 40.39 C
-ATOM 884 CG2 ILE A 63 4.247 52.733 30.881 1.00 48.56 C
-ATOM 885 CD1 ILE A 63 4.020 51.877 33.796 1.00 38.20 C
-ATOM 886 H ILE A 63 0.172 52.390 31.815 1.00 0.00 H
-ATOM 887 HA ILE A 63 2.181 54.467 31.109 1.00 0.00 H
-ATOM 888 HB ILE A 63 2.629 51.551 31.594 1.00 0.00 H
-ATOM 889 1HG1 ILE A 63 3.608 53.855 33.180 1.00 0.00 H
-ATOM 890 2HG1 ILE A 63 2.199 52.909 33.610 1.00 0.00 H
-ATOM 891 1HG2 ILE A 63 4.994 52.100 31.321 1.00 0.00 H
-ATOM 892 2HG2 ILE A 63 4.106 52.461 29.840 1.00 0.00 H
-ATOM 893 3HG2 ILE A 63 4.566 53.773 30.943 1.00 0.00 H
-ATOM 894 1HD1 ILE A 63 4.132 52.153 34.831 1.00 0.00 H
-ATOM 895 2HD1 ILE A 63 3.547 50.896 33.732 1.00 0.00 H
-ATOM 896 3HD1 ILE A 63 5.000 51.837 33.322 1.00 0.00 H
-ATOM 897 N GLN A 64 2.187 53.979 28.671 1.00 52.75 N
-ATOM 898 CA GLN A 64 2.141 53.703 27.239 1.00 52.69 C
-ATOM 899 C GLN A 64 3.572 53.523 26.745 1.00 51.99 C
-ATOM 900 O GLN A 64 4.451 54.319 27.091 1.00 51.83 O
-ATOM 901 CB GLN A 64 1.507 54.869 26.464 1.00 51.20 C
-ATOM 902 CG GLN A 64 0.124 55.285 26.944 1.00 47.71 C
-ATOM 903 CD GLN A 64 -0.455 56.480 26.181 1.00 51.87 C
-ATOM 904 OE1 GLN A 64 0.225 57.485 25.967 1.00 55.93 O
-ATOM 905 NE2 GLN A 64 -1.725 56.362 25.800 1.00 41.18 N
-ATOM 906 H GLN A 64 2.598 54.839 29.022 1.00 0.00 H
-ATOM 907 HA GLN A 64 1.590 52.783 27.055 1.00 0.00 H
-ATOM 908 1HB GLN A 64 2.169 55.705 26.436 1.00 0.00 H
-ATOM 909 2HB GLN A 64 1.375 54.554 25.428 1.00 0.00 H
-ATOM 910 1HG GLN A 64 -0.553 54.453 26.829 1.00 0.00 H
-ATOM 911 2HG GLN A 64 0.190 55.572 27.997 1.00 0.00 H
-ATOM 912 1HE2 GLN A 64 -2.208 57.127 25.330 1.00 0.00 H
-ATOM 913 2HE2 GLN A 64 -2.236 55.531 26.002 1.00 0.00 H
-ATOM 914 N THR A 65 3.818 52.493 25.941 1.00 52.25 N
-ATOM 915 CA THR A 65 5.153 52.287 25.385 1.00 49.88 C
-ATOM 916 C THR A 65 5.007 51.951 23.908 1.00 51.14 C
-ATOM 917 O THR A 65 3.900 51.772 23.400 1.00 50.70 O
-ATOM 918 CB THR A 65 5.932 51.130 26.050 1.00 50.66 C
-ATOM 919 OG1 THR A 65 5.422 49.888 25.572 1.00 49.41 O
-ATOM 920 CG2 THR A 65 5.770 51.162 27.571 1.00 52.37 C
-ATOM 921 H THR A 65 3.073 51.840 25.700 1.00 0.00 H
-ATOM 922 HA THR A 65 5.731 53.206 25.473 1.00 0.00 H
-ATOM 923 HB THR A 65 6.984 51.219 25.802 1.00 0.00 H
-ATOM 924 HG1 THR A 65 5.325 49.958 24.625 1.00 0.00 H
-ATOM 925 1HG2 THR A 65 6.327 50.338 28.011 1.00 0.00 H
-ATOM 926 2HG2 THR A 65 6.145 52.104 27.966 1.00 0.00 H
-ATOM 927 3HG2 THR A 65 4.716 51.057 27.827 1.00 0.00 H
-ATOM 928 N ARG A 66 6.127 51.777 23.230 1.00 51.49 N
-ATOM 929 CA ARG A 66 6.112 51.408 21.818 1.00 49.78 C
-ATOM 930 C ARG A 66 5.432 50.050 21.561 1.00 51.30 C
-ATOM 931 O ARG A 66 5.036 49.767 20.431 1.00 48.96 O
-ATOM 932 CB ARG A 66 7.523 51.438 21.222 1.00 61.30 C
-ATOM 933 CG ARG A 66 7.552 51.357 19.695 1.00 63.38 C
-ATOM 934 CD ARG A 66 8.867 51.820 19.086 1.00 72.82 C
-ATOM 935 NE ARG A 66 10.011 50.960 19.370 1.00 83.35 N
-ATOM 936 CZ ARG A 66 10.277 49.816 18.722 1.00 87.82 C
-ATOM 937 NH1 ARG A 66 11.361 49.147 19.011 1.00 92.65 N
-ATOM 938 NH2 ARG A 66 9.449 49.374 17.782 1.00 87.89 N
-ATOM 939 H ARG A 66 7.010 51.937 23.692 1.00 0.00 H
-ATOM 940 HA ARG A 66 5.531 52.159 21.286 1.00 0.00 H
-ATOM 941 1HB ARG A 66 8.055 52.338 21.533 1.00 0.00 H
-ATOM 942 2HB ARG A 66 8.082 50.579 21.585 1.00 0.00 H
-ATOM 943 1HG ARG A 66 7.376 50.325 19.385 1.00 0.00 H
-ATOM 944 2HG ARG A 66 6.762 51.993 19.289 1.00 0.00 H
-ATOM 945 1HD ARG A 66 8.753 51.873 18.004 1.00 0.00 H
-ATOM 946 2HD ARG A 66 9.097 52.818 19.466 1.00 0.00 H
-ATOM 947 HE ARG A 66 10.706 51.284 20.065 1.00 0.00 H
-ATOM 948 1HH1 ARG A 66 11.993 49.503 19.719 1.00 0.00 H
-ATOM 949 2HH1 ARG A 66 11.577 48.294 18.516 1.00 0.00 H
-ATOM 950 1HH2 ARG A 66 8.613 49.897 17.557 1.00 0.00 H
-ATOM 951 2HH2 ARG A 66 9.653 48.520 17.290 1.00 0.00 H
-ATOM 952 N HIS A 67 5.329 49.188 22.588 1.00 51.67 N
-ATOM 953 CA HIS A 67 4.767 47.855 22.386 1.00 51.85 C
-ATOM 954 C HIS A 67 3.296 47.749 22.812 1.00 54.61 C
-ATOM 955 O HIS A 67 2.749 46.645 22.869 1.00 53.97 O
-ATOM 956 CB HIS A 67 5.546 46.815 23.197 1.00 48.05 C
-ATOM 957 CG HIS A 67 6.983 46.755 22.875 1.00 44.79 C
-ATOM 958 ND1 HIS A 67 7.468 46.811 21.587 1.00 43.66 N
-ATOM 959 CD2 HIS A 67 8.053 46.610 23.676 1.00 44.93 C
-ATOM 960 CE1 HIS A 67 8.784 46.725 21.621 1.00 44.66 C
-ATOM 961 NE2 HIS A 67 9.156 46.592 22.878 1.00 48.35 N
-ATOM 962 H HIS A 67 5.616 49.458 23.524 1.00 0.00 H
-ATOM 963 HA HIS A 67 4.829 47.589 21.332 1.00 0.00 H
-ATOM 964 1HB HIS A 67 5.442 47.034 24.264 1.00 0.00 H
-ATOM 965 2HB HIS A 67 5.123 45.821 23.026 1.00 0.00 H
-ATOM 966 HD2 HIS A 67 8.045 46.516 24.759 1.00 0.00 H
-ATOM 967 HE1 HIS A 67 9.443 46.742 20.758 1.00 0.00 H
-ATOM 968 HE2 HIS A 67 10.107 46.482 23.232 1.00 0.00 H
-ATOM 969 N GLY A 68 2.653 48.876 23.129 1.00 57.44 N
-ATOM 970 CA GLY A 68 1.269 48.827 23.599 1.00 59.51 C
-ATOM 971 C GLY A 68 1.154 49.500 24.959 1.00 59.71 C
-ATOM 972 O GLY A 68 1.916 50.415 25.271 1.00 55.34 O
-ATOM 973 H GLY A 68 3.124 49.776 23.059 1.00 0.00 H
-ATOM 974 1HA GLY A 68 0.618 49.326 22.881 1.00 0.00 H
-ATOM 975 2HA GLY A 68 0.938 47.793 23.676 1.00 0.00 H
-ATOM 976 N VAL A 69 0.173 49.094 25.756 1.00 60.78 N
-ATOM 977 CA VAL A 69 0.003 49.735 27.056 1.00 59.06 C
-ATOM 978 C VAL A 69 0.020 48.716 28.183 1.00 59.19 C
-ATOM 979 O VAL A 69 -0.275 47.534 27.969 1.00 58.03 O
-ATOM 980 CB VAL A 69 -1.311 50.529 27.113 1.00 59.08 C
-ATOM 981 CG1 VAL A 69 -1.303 51.611 26.048 1.00 43.09 C
-ATOM 982 CG2 VAL A 69 -2.486 49.589 26.935 1.00 63.61 C
-ATOM 983 H VAL A 69 -0.442 48.346 25.468 1.00 0.00 H
-ATOM 984 HA VAL A 69 0.829 50.427 27.215 1.00 0.00 H
-ATOM 985 HB VAL A 69 -1.383 51.025 28.086 1.00 0.00 H
-ATOM 986 1HG1 VAL A 69 -2.220 52.189 26.107 1.00 0.00 H
-ATOM 987 2HG1 VAL A 69 -0.458 52.258 26.211 1.00 0.00 H
-ATOM 988 3HG1 VAL A 69 -1.227 51.161 25.064 1.00 0.00 H
-ATOM 989 1HG2 VAL A 69 -3.416 50.153 26.994 1.00 0.00 H
-ATOM 990 2HG2 VAL A 69 -2.420 49.098 25.966 1.00 0.00 H
-ATOM 991 3HG2 VAL A 69 -2.466 48.839 27.727 1.00 0.00 H
-ATOM 992 N ILE A 70 0.359 49.201 29.373 1.00 59.78 N
-ATOM 993 CA ILE A 70 0.408 48.406 30.593 1.00 60.63 C
-ATOM 994 C ILE A 70 -0.007 49.283 31.770 1.00 62.36 C
-ATOM 995 O ILE A 70 0.218 50.491 31.756 1.00 62.17 O
-ATOM 996 CB ILE A 70 1.841 47.831 30.803 1.00 51.34 C
-ATOM 997 CG1 ILE A 70 1.886 46.774 31.910 1.00 47.26 C
-ATOM 998 CG2 ILE A 70 2.807 48.922 31.143 1.00 41.48 C
-ATOM 999 CD1 ILE A 70 1.207 45.513 31.519 1.00 47.39 C
-ATOM 1000 H ILE A 70 0.600 50.189 29.428 1.00 0.00 H
-ATOM 1001 HA ILE A 70 -0.299 47.581 30.509 1.00 0.00 H
-ATOM 1002 HB ILE A 70 2.162 47.354 29.887 1.00 0.00 H
-ATOM 1003 1HG1 ILE A 70 2.930 46.545 32.126 1.00 0.00 H
-ATOM 1004 2HG1 ILE A 70 1.437 47.155 32.815 1.00 0.00 H
-ATOM 1005 1HG2 ILE A 70 3.800 48.506 31.263 1.00 0.00 H
-ATOM 1006 2HG2 ILE A 70 2.817 49.661 30.341 1.00 0.00 H
-ATOM 1007 3HG2 ILE A 70 2.491 49.383 32.077 1.00 0.00 H
-ATOM 1008 1HD1 ILE A 70 1.285 44.785 32.322 1.00 0.00 H
-ATOM 1009 2HD1 ILE A 70 0.155 45.712 31.310 1.00 0.00 H
-ATOM 1010 3HD1 ILE A 70 1.689 45.130 30.625 1.00 0.00 H
-ATOM 1011 N GLU A 71 -0.618 48.693 32.782 1.00 61.90 N
-ATOM 1012 CA GLU A 71 -0.941 49.461 33.974 1.00 58.08 C
-ATOM 1013 C GLU A 71 -0.141 48.965 35.160 1.00 55.86 C
-ATOM 1014 O GLU A 71 -0.189 47.776 35.503 1.00 53.48 O
-ATOM 1015 CB GLU A 71 -2.438 49.398 34.302 1.00 57.19 C
-ATOM 1016 CG GLU A 71 -3.335 50.053 33.274 1.00 74.92 C
-ATOM 1017 CD GLU A 71 -4.793 50.089 33.679 1.00 76.05 C
-ATOM 1018 OE1 GLU A 71 -5.110 49.616 34.745 1.00 66.43 O
-ATOM 1019 OE2 GLU A 71 -5.583 50.603 32.922 1.00 77.41 O
-ATOM 1020 H GLU A 71 -0.822 47.704 32.738 1.00 0.00 H
-ATOM 1021 HA GLU A 71 -0.671 50.506 33.808 1.00 0.00 H
-ATOM 1022 1HB GLU A 71 -2.745 48.356 34.388 1.00 0.00 H
-ATOM 1023 2HB GLU A 71 -2.621 49.876 35.271 1.00 0.00 H
-ATOM 1024 1HG GLU A 71 -2.975 51.059 33.119 1.00 0.00 H
-ATOM 1025 2HG GLU A 71 -3.242 49.515 32.330 1.00 0.00 H
-ATOM 1026 N SER A 72 0.611 49.873 35.772 1.00 54.55 N
-ATOM 1027 CA SER A 72 1.409 49.542 36.940 1.00 55.99 C
-ATOM 1028 C SER A 72 0.533 49.715 38.163 1.00 57.19 C
-ATOM 1029 O SER A 72 -0.438 50.479 38.106 1.00 56.40 O
-ATOM 1030 CB SER A 72 2.635 50.421 36.982 1.00 47.81 C
-ATOM 1031 OG SER A 72 2.274 51.754 37.090 1.00 49.56 O
-ATOM 1032 H SER A 72 0.590 50.837 35.444 1.00 0.00 H
-ATOM 1033 HA SER A 72 1.716 48.498 36.889 1.00 0.00 H
-ATOM 1034 1HB SER A 72 3.270 50.138 37.826 1.00 0.00 H
-ATOM 1035 2HB SER A 72 3.208 50.274 36.087 1.00 0.00 H
-ATOM 1036 HG SER A 72 1.648 51.916 36.365 1.00 0.00 H
-ATOM 1037 N GLU A 73 0.866 49.016 39.249 1.00 58.13 N
-ATOM 1038 CA GLU A 73 0.070 49.104 40.464 1.00 59.63 C
-ATOM 1039 C GLU A 73 0.920 49.260 41.723 1.00 59.65 C
-ATOM 1040 O GLU A 73 2.052 49.754 41.687 1.00 59.10 O
-ATOM 1041 OXT GLU A 73 0.390 49.046 42.823 1.00 0.00 O
-ATOM 1042 CB GLU A 73 -0.846 47.879 40.553 1.00 65.04 C
-ATOM 1043 CG GLU A 73 -1.745 47.687 39.306 1.00 65.54 C
-ATOM 1044 CD GLU A 73 -2.705 46.568 39.423 1.00 67.13 C
-ATOM 1045 OE1 GLU A 73 -3.709 46.771 40.069 1.00 64.78 O
-ATOM 1046 OE2 GLU A 73 -2.480 45.528 38.832 1.00 66.11 O
-ATOM 1047 H GLU A 73 1.679 48.404 39.213 1.00 0.00 H
-ATOM 1048 HA GLU A 73 -0.561 49.974 40.398 1.00 0.00 H
-ATOM 1049 1HB GLU A 73 -0.267 46.985 40.691 1.00 0.00 H
-ATOM 1050 2HB GLU A 73 -1.504 47.984 41.414 1.00 0.00 H
-ATOM 1051 1HG GLU A 73 -2.299 48.594 39.112 1.00 0.00 H
-ATOM 1052 2HG GLU A 73 -1.105 47.505 38.441 1.00 0.00 H
-TER
-ATOM 1054 N SER B 7 17.179 51.371 19.923 1.00 67.09 N
-ATOM 1055 CA SER B 7 17.520 50.074 20.485 1.00 65.59 C
-ATOM 1056 C SER B 7 16.331 49.496 21.236 1.00 64.33 C
-ATOM 1057 O SER B 7 15.642 50.199 21.976 1.00 65.75 O
-ATOM 1058 CB SER B 7 18.713 50.182 21.405 1.00 56.39 C
-ATOM 1059 OG SER B 7 18.995 48.942 21.982 1.00 58.65 O
-ATOM 1060 1H SER B 7 17.822 51.598 19.178 1.00 0.00 H
-ATOM 1061 2H SER B 7 16.237 51.327 19.554 1.00 0.00 H
-ATOM 1062 3H SER B 7 17.228 52.079 20.639 1.00 0.00 H
-ATOM 1063 HA SER B 7 17.768 49.396 19.667 1.00 0.00 H
-ATOM 1064 1HB SER B 7 19.580 50.539 20.849 1.00 0.00 H
-ATOM 1065 2HB SER B 7 18.502 50.906 22.187 1.00 0.00 H
-ATOM 1066 HG SER B 7 18.184 48.670 22.428 1.00 0.00 H
-ATOM 1067 N ASP B 8 16.086 48.213 21.024 1.00 59.93 N
-ATOM 1068 CA ASP B 8 14.940 47.518 21.601 1.00 59.90 C
-ATOM 1069 C ASP B 8 14.924 47.425 23.118 1.00 57.45 C
-ATOM 1070 O ASP B 8 15.973 47.381 23.774 1.00 56.50 O
-ATOM 1071 CB ASP B 8 14.819 46.119 21.015 1.00 59.76 C
-ATOM 1072 CG ASP B 8 14.388 46.171 19.585 1.00 69.30 C
-ATOM 1073 OD1 ASP B 8 14.018 47.238 19.149 1.00 70.12 O
-ATOM 1074 OD2 ASP B 8 14.434 45.166 18.928 1.00 68.27 O
-ATOM 1075 H ASP B 8 16.704 47.689 20.419 1.00 0.00 H
-ATOM 1076 HA ASP B 8 14.045 48.071 21.307 1.00 0.00 H
-ATOM 1077 1HB ASP B 8 15.767 45.589 21.088 1.00 0.00 H
-ATOM 1078 2HB ASP B 8 14.078 45.555 21.587 1.00 0.00 H
-ATOM 1079 N PHE B 9 13.694 47.342 23.632 1.00 56.18 N
-ATOM 1080 CA PHE B 9 13.396 47.187 25.048 1.00 56.49 C
-ATOM 1081 C PHE B 9 12.231 46.241 25.239 1.00 56.07 C
-ATOM 1082 O PHE B 9 11.496 45.948 24.291 1.00 53.32 O
-ATOM 1083 CB PHE B 9 13.005 48.529 25.691 1.00 48.81 C
-ATOM 1084 CG PHE B 9 11.717 49.099 25.203 1.00 48.03 C
-ATOM 1085 CD1 PHE B 9 10.536 48.820 25.868 1.00 41.68 C
-ATOM 1086 CD2 PHE B 9 11.674 49.915 24.091 1.00 38.81 C
-ATOM 1087 CE1 PHE B 9 9.341 49.344 25.438 1.00 40.04 C
-ATOM 1088 CE2 PHE B 9 10.477 50.437 23.655 1.00 41.75 C
-ATOM 1089 CZ PHE B 9 9.310 50.148 24.332 1.00 44.13 C
-ATOM 1090 H PHE B 9 12.919 47.403 22.991 1.00 0.00 H
-ATOM 1091 HA PHE B 9 14.259 46.756 25.541 1.00 0.00 H
-ATOM 1092 1HB PHE B 9 12.914 48.408 26.765 1.00 0.00 H
-ATOM 1093 2HB PHE B 9 13.761 49.248 25.515 1.00 0.00 H
-ATOM 1094 HD1 PHE B 9 10.566 48.175 26.743 1.00 0.00 H
-ATOM 1095 HD2 PHE B 9 12.597 50.148 23.550 1.00 0.00 H
-ATOM 1096 HE1 PHE B 9 8.423 49.114 25.971 1.00 0.00 H
-ATOM 1097 HE2 PHE B 9 10.458 51.077 22.771 1.00 0.00 H
-ATOM 1098 HZ PHE B 9 8.379 50.550 23.990 1.00 0.00 H
-ATOM 1099 N VAL B 10 12.067 45.778 26.472 1.00 55.59 N
-ATOM 1100 CA VAL B 10 10.946 44.915 26.821 1.00 56.12 C
-ATOM 1101 C VAL B 10 10.201 45.507 28.017 1.00 55.38 C
-ATOM 1102 O VAL B 10 10.785 46.242 28.817 1.00 54.22 O
-ATOM 1103 CB VAL B 10 11.476 43.517 27.200 1.00 61.62 C
-ATOM 1104 CG1 VAL B 10 12.264 42.906 26.019 1.00 57.06 C
-ATOM 1105 CG2 VAL B 10 12.346 43.633 28.436 1.00 61.62 C
-ATOM 1106 H VAL B 10 12.749 46.043 27.175 1.00 0.00 H
-ATOM 1107 HA VAL B 10 10.264 44.840 25.975 1.00 0.00 H
-ATOM 1108 HB VAL B 10 10.628 42.858 27.411 1.00 0.00 H
-ATOM 1109 1HG1 VAL B 10 12.627 41.933 26.296 1.00 0.00 H
-ATOM 1110 2HG1 VAL B 10 11.618 42.824 25.145 1.00 0.00 H
-ATOM 1111 3HG1 VAL B 10 13.116 43.541 25.782 1.00 0.00 H
-ATOM 1112 1HG2 VAL B 10 12.710 42.647 28.719 1.00 0.00 H
-ATOM 1113 2HG2 VAL B 10 13.193 44.291 28.224 1.00 0.00 H
-ATOM 1114 3HG2 VAL B 10 11.758 44.052 29.256 1.00 0.00 H
-ATOM 1115 N VAL B 11 8.919 45.159 28.163 1.00 52.56 N
-ATOM 1116 CA VAL B 11 8.137 45.618 29.319 1.00 51.69 C
-ATOM 1117 C VAL B 11 7.746 44.426 30.174 1.00 52.00 C
-ATOM 1118 O VAL B 11 7.144 43.477 29.676 1.00 51.38 O
-ATOM 1119 CB VAL B 11 6.834 46.304 28.870 1.00 54.10 C
-ATOM 1120 CG1 VAL B 11 6.041 46.776 30.094 1.00 61.24 C
-ATOM 1121 CG2 VAL B 11 7.132 47.426 27.897 1.00 51.44 C
-ATOM 1122 H VAL B 11 8.476 44.573 27.462 1.00 0.00 H
-ATOM 1123 HA VAL B 11 8.733 46.306 29.913 1.00 0.00 H
-ATOM 1124 HB VAL B 11 6.225 45.584 28.391 1.00 0.00 H
-ATOM 1125 1HG1 VAL B 11 5.107 47.221 29.755 1.00 0.00 H
-ATOM 1126 2HG1 VAL B 11 5.822 45.924 30.739 1.00 0.00 H
-ATOM 1127 3HG1 VAL B 11 6.609 47.505 30.652 1.00 0.00 H
-ATOM 1128 1HG2 VAL B 11 6.193 47.878 27.571 1.00 0.00 H
-ATOM 1129 2HG2 VAL B 11 7.742 48.173 28.363 1.00 0.00 H
-ATOM 1130 3HG2 VAL B 11 7.655 47.021 27.036 1.00 0.00 H
-ATOM 1131 N ILE B 12 8.093 44.466 31.460 1.00 52.57 N
-ATOM 1132 CA ILE B 12 7.769 43.351 32.344 1.00 51.84 C
-ATOM 1133 C ILE B 12 6.955 43.792 33.572 1.00 52.68 C
-ATOM 1134 O ILE B 12 7.380 44.658 34.337 1.00 52.44 O
-ATOM 1135 CB ILE B 12 9.076 42.673 32.801 1.00 46.20 C
-ATOM 1136 CG1 ILE B 12 9.870 42.185 31.557 1.00 48.03 C
-ATOM 1137 CG2 ILE B 12 8.736 41.486 33.720 1.00 34.35 C
-ATOM 1138 CD1 ILE B 12 11.245 41.766 31.866 1.00 46.36 C
-ATOM 1139 H ILE B 12 8.608 45.262 31.817 1.00 0.00 H
-ATOM 1140 HA ILE B 12 7.180 42.624 31.793 1.00 0.00 H
-ATOM 1141 HB ILE B 12 9.704 43.391 33.336 1.00 0.00 H
-ATOM 1142 1HG1 ILE B 12 9.355 41.354 31.122 1.00 0.00 H
-ATOM 1143 2HG1 ILE B 12 9.933 42.978 30.822 1.00 0.00 H
-ATOM 1144 1HG2 ILE B 12 9.644 40.991 34.040 1.00 0.00 H
-ATOM 1145 2HG2 ILE B 12 8.192 41.846 34.594 1.00 0.00 H
-ATOM 1146 3HG2 ILE B 12 8.115 40.778 33.176 1.00 0.00 H
-ATOM 1147 1HD1 ILE B 12 11.741 41.426 30.955 1.00 0.00 H
-ATOM 1148 2HD1 ILE B 12 11.785 42.611 32.282 1.00 0.00 H
-ATOM 1149 3HD1 ILE B 12 11.212 40.972 32.584 1.00 0.00 H
-ATOM 1150 N LYS B 13 5.778 43.174 33.760 1.00 53.99 N
-ATOM 1151 CA LYS B 13 4.918 43.484 34.909 1.00 52.15 C
-ATOM 1152 C LYS B 13 4.778 42.316 35.870 1.00 50.26 C
-ATOM 1153 O LYS B 13 4.338 41.226 35.501 1.00 49.60 O
-ATOM 1154 CB LYS B 13 3.515 43.895 34.479 1.00 53.58 C
-ATOM 1155 CG LYS B 13 2.622 44.168 35.676 1.00 55.43 C
-ATOM 1156 CD LYS B 13 1.235 44.593 35.308 1.00 49.75 C
-ATOM 1157 CE LYS B 13 0.408 44.717 36.577 1.00 52.51 C
-ATOM 1158 NZ LYS B 13 -0.948 45.233 36.334 1.00 50.82 N
-ATOM 1159 H LYS B 13 5.470 42.482 33.083 1.00 0.00 H
-ATOM 1160 HA LYS B 13 5.361 44.308 35.461 1.00 0.00 H
-ATOM 1161 1HB LYS B 13 3.558 44.782 33.856 1.00 0.00 H
-ATOM 1162 2HB LYS B 13 3.069 43.114 33.902 1.00 0.00 H
-ATOM 1163 1HG LYS B 13 2.545 43.265 36.283 1.00 0.00 H
-ATOM 1164 2HG LYS B 13 3.077 44.947 36.292 1.00 0.00 H
-ATOM 1165 1HD LYS B 13 1.265 45.560 34.802 1.00 0.00 H
-ATOM 1166 2HD LYS B 13 0.782 43.855 34.647 1.00 0.00 H
-ATOM 1167 1HE LYS B 13 0.337 43.735 37.045 1.00 0.00 H
-ATOM 1168 2HE LYS B 13 0.918 45.396 37.250 1.00 0.00 H
-ATOM 1169 1HZ LYS B 13 -1.459 45.312 37.232 1.00 0.00 H
-ATOM 1170 2HZ LYS B 13 -0.848 46.167 35.919 1.00 0.00 H
-ATOM 1171 3HZ LYS B 13 -1.454 44.631 35.712 1.00 0.00 H
-ATOM 1172 N ALA B 14 5.156 42.531 37.121 1.00 49.79 N
-ATOM 1173 CA ALA B 14 5.069 41.434 38.079 1.00 52.25 C
-ATOM 1174 C ALA B 14 3.620 41.036 38.339 1.00 52.57 C
-ATOM 1175 O ALA B 14 2.780 41.881 38.657 1.00 53.81 O
-ATOM 1176 CB ALA B 14 5.721 41.844 39.375 1.00 44.95 C
-ATOM 1177 H ALA B 14 5.496 43.452 37.404 1.00 0.00 H
-ATOM 1178 HA ALA B 14 5.589 40.575 37.660 1.00 0.00 H
-ATOM 1179 1HB ALA B 14 5.681 41.029 40.094 1.00 0.00 H
-ATOM 1180 2HB ALA B 14 6.735 42.098 39.176 1.00 0.00 H
-ATOM 1181 3HB ALA B 14 5.198 42.700 39.765 1.00 0.00 H
-ATOM 1182 N LEU B 15 3.349 39.729 38.312 1.00 52.32 N
-ATOM 1183 CA LEU B 15 2.007 39.243 38.635 1.00 56.14 C
-ATOM 1184 C LEU B 15 1.947 38.695 40.060 1.00 57.85 C
-ATOM 1185 O LEU B 15 0.878 38.335 40.562 1.00 56.48 O
-ATOM 1186 CB LEU B 15 1.587 38.195 37.609 1.00 51.10 C
-ATOM 1187 CG LEU B 15 1.498 38.728 36.164 1.00 52.46 C
-ATOM 1188 CD1 LEU B 15 1.188 37.575 35.214 1.00 47.68 C
-ATOM 1189 CD2 LEU B 15 0.445 39.812 36.092 1.00 42.91 C
-ATOM 1190 H LEU B 15 4.062 39.054 38.042 1.00 0.00 H
-ATOM 1191 HA LEU B 15 1.312 40.076 38.568 1.00 0.00 H
-ATOM 1192 1HB LEU B 15 2.312 37.393 37.627 1.00 0.00 H
-ATOM 1193 2HB LEU B 15 0.615 37.794 37.890 1.00 0.00 H
-ATOM 1194 HG LEU B 15 2.430 39.160 35.883 1.00 0.00 H
-ATOM 1195 1HD1 LEU B 15 1.134 37.947 34.190 1.00 0.00 H
-ATOM 1196 2HD1 LEU B 15 1.974 36.823 35.282 1.00 0.00 H
-ATOM 1197 3HD1 LEU B 15 0.234 37.128 35.485 1.00 0.00 H
-ATOM 1198 1HD2 LEU B 15 0.385 40.203 35.081 1.00 0.00 H
-ATOM 1199 2HD2 LEU B 15 -0.522 39.398 36.378 1.00 0.00 H
-ATOM 1200 3HD2 LEU B 15 0.710 40.623 36.775 1.00 0.00 H
-ATOM 1201 N GLU B 16 3.104 38.662 40.708 1.00 58.79 N
-ATOM 1202 CA GLU B 16 3.240 38.185 42.082 1.00 60.90 C
-ATOM 1203 C GLU B 16 4.444 38.841 42.746 1.00 62.57 C
-ATOM 1204 O GLU B 16 5.298 39.412 42.079 1.00 63.73 O
-ATOM 1205 CB GLU B 16 3.365 36.658 42.140 1.00 58.19 C
-ATOM 1206 CG GLU B 16 4.592 36.080 41.468 1.00 68.84 C
-ATOM 1207 CD GLU B 16 4.613 34.575 41.523 1.00 68.24 C
-ATOM 1208 OE1 GLU B 16 3.759 34.002 42.157 1.00 74.86 O
-ATOM 1209 OE2 GLU B 16 5.458 33.994 40.885 1.00 68.18 O
-ATOM 1210 H GLU B 16 3.925 38.977 40.215 1.00 0.00 H
-ATOM 1211 HA GLU B 16 2.348 38.471 42.637 1.00 0.00 H
-ATOM 1212 1HB GLU B 16 3.376 36.336 43.182 1.00 0.00 H
-ATOM 1213 2HB GLU B 16 2.492 36.202 41.667 1.00 0.00 H
-ATOM 1214 1HG GLU B 16 4.628 36.411 40.432 1.00 0.00 H
-ATOM 1215 2HG GLU B 16 5.478 36.466 41.973 1.00 0.00 H
-ATOM 1216 N ASP B 17 4.495 38.810 44.068 1.00 62.48 N
-ATOM 1217 CA ASP B 17 5.665 39.343 44.755 1.00 63.09 C
-ATOM 1218 C ASP B 17 6.910 38.496 44.476 1.00 61.66 C
-ATOM 1219 O ASP B 17 6.841 37.271 44.546 1.00 62.13 O
-ATOM 1220 CB ASP B 17 5.408 39.396 46.261 1.00 66.47 C
-ATOM 1221 CG ASP B 17 4.357 40.438 46.650 1.00 67.63 C
-ATOM 1222 OD1 ASP B 17 4.026 41.271 45.825 1.00 69.96 O
-ATOM 1223 OD2 ASP B 17 3.892 40.395 47.765 1.00 75.30 O
-ATOM 1224 H ASP B 17 3.753 38.367 44.592 1.00 0.00 H
-ATOM 1225 HA ASP B 17 5.846 40.341 44.395 1.00 0.00 H
-ATOM 1226 1HB ASP B 17 5.086 38.414 46.615 1.00 0.00 H
-ATOM 1227 2HB ASP B 17 6.341 39.640 46.771 1.00 0.00 H
-ATOM 1228 N GLY B 18 8.069 39.135 44.275 1.00 59.00 N
-ATOM 1229 CA GLY B 18 9.316 38.372 44.142 1.00 58.72 C
-ATOM 1230 C GLY B 18 9.695 38.011 42.705 1.00 60.16 C
-ATOM 1231 O GLY B 18 10.421 37.047 42.470 1.00 59.28 O
-ATOM 1232 H GLY B 18 8.091 40.150 44.168 1.00 0.00 H
-ATOM 1233 1HA GLY B 18 10.125 38.956 44.583 1.00 0.00 H
-ATOM 1234 2HA GLY B 18 9.238 37.461 44.732 1.00 0.00 H
-ATOM 1235 N VAL B 19 9.188 38.766 41.749 1.00 58.93 N
-ATOM 1236 CA VAL B 19 9.508 38.552 40.342 1.00 57.00 C
-ATOM 1237 C VAL B 19 10.909 39.058 40.073 1.00 56.03 C
-ATOM 1238 O VAL B 19 11.288 40.118 40.560 1.00 56.37 O
-ATOM 1239 CB VAL B 19 8.453 39.225 39.462 1.00 56.48 C
-ATOM 1240 CG1 VAL B 19 8.847 39.227 37.988 1.00 51.53 C
-ATOM 1241 CG2 VAL B 19 7.177 38.458 39.632 1.00 47.81 C
-ATOM 1242 H VAL B 19 8.610 39.560 42.012 1.00 0.00 H
-ATOM 1243 HA VAL B 19 9.482 37.481 40.134 1.00 0.00 H
-ATOM 1244 HB VAL B 19 8.314 40.225 39.789 1.00 0.00 H
-ATOM 1245 1HG1 VAL B 19 8.065 39.710 37.415 1.00 0.00 H
-ATOM 1246 2HG1 VAL B 19 9.779 39.777 37.857 1.00 0.00 H
-ATOM 1247 3HG1 VAL B 19 8.978 38.201 37.638 1.00 0.00 H
-ATOM 1248 1HG2 VAL B 19 6.395 38.909 39.054 1.00 0.00 H
-ATOM 1249 2HG2 VAL B 19 7.324 37.434 39.300 1.00 0.00 H
-ATOM 1250 3HG2 VAL B 19 6.905 38.455 40.673 1.00 0.00 H
-ATOM 1251 N ASN B 20 11.701 38.281 39.354 1.00 53.73 N
-ATOM 1252 CA ASN B 20 13.086 38.666 39.109 1.00 53.06 C
-ATOM 1253 C ASN B 20 13.434 38.783 37.647 1.00 53.54 C
-ATOM 1254 O ASN B 20 13.317 37.826 36.877 1.00 49.12 O
-ATOM 1255 CB ASN B 20 14.044 37.710 39.799 1.00 59.78 C
-ATOM 1256 CG ASN B 20 14.056 37.866 41.290 1.00 66.90 C
-ATOM 1257 OD1 ASN B 20 14.719 38.772 41.791 1.00 68.80 O
-ATOM 1258 ND2 ASN B 20 13.352 37.022 42.000 1.00 54.63 N
-ATOM 1259 H ASN B 20 11.327 37.423 38.959 1.00 0.00 H
-ATOM 1260 HA ASN B 20 13.243 39.653 39.540 1.00 0.00 H
-ATOM 1261 1HB ASN B 20 13.772 36.690 39.560 1.00 0.00 H
-ATOM 1262 2HB ASN B 20 15.055 37.879 39.421 1.00 0.00 H
-ATOM 1263 1HD2 ASN B 20 13.331 37.094 42.995 1.00 0.00 H
-ATOM 1264 2HD2 ASN B 20 12.816 36.303 41.551 1.00 0.00 H
-ATOM 1265 N VAL B 21 13.863 39.983 37.267 1.00 53.64 N
-ATOM 1266 CA VAL B 21 14.273 40.233 35.899 1.00 53.67 C
-ATOM 1267 C VAL B 21 15.790 40.281 35.880 1.00 53.02 C
-ATOM 1268 O VAL B 21 16.413 41.111 36.547 1.00 54.01 O
-ATOM 1269 CB VAL B 21 13.667 41.534 35.379 1.00 49.42 C
-ATOM 1270 CG1 VAL B 21 14.127 41.758 33.958 1.00 47.65 C
-ATOM 1271 CG2 VAL B 21 12.150 41.439 35.484 1.00 47.64 C
-ATOM 1272 H VAL B 21 13.908 40.735 37.957 1.00 0.00 H
-ATOM 1273 HA VAL B 21 13.941 39.411 35.261 1.00 0.00 H
-ATOM 1274 HB VAL B 21 14.020 42.372 35.977 1.00 0.00 H
-ATOM 1275 1HG1 VAL B 21 13.713 42.680 33.573 1.00 0.00 H
-ATOM 1276 2HG1 VAL B 21 15.216 41.816 33.932 1.00 0.00 H
-ATOM 1277 3HG1 VAL B 21 13.794 40.926 33.345 1.00 0.00 H
-ATOM 1278 1HG2 VAL B 21 11.695 42.357 35.118 1.00 0.00 H
-ATOM 1279 2HG2 VAL B 21 11.806 40.596 34.892 1.00 0.00 H
-ATOM 1280 3HG2 VAL B 21 11.865 41.288 36.528 1.00 0.00 H
-ATOM 1281 N ILE B 22 16.384 39.339 35.170 1.00 49.94 N
-ATOM 1282 CA ILE B 22 17.813 39.127 35.235 1.00 50.83 C
-ATOM 1283 C ILE B 22 18.554 39.513 33.971 1.00 51.39 C
-ATOM 1284 O ILE B 22 18.203 39.090 32.868 1.00 48.31 O
-ATOM 1285 CB ILE B 22 18.076 37.648 35.537 1.00 50.32 C
-ATOM 1286 CG1 ILE B 22 17.429 37.264 36.863 1.00 49.65 C
-ATOM 1287 CG2 ILE B 22 19.550 37.374 35.585 1.00 53.96 C
-ATOM 1288 CD1 ILE B 22 17.413 35.782 37.114 1.00 46.20 C
-ATOM 1289 H ILE B 22 15.822 38.710 34.615 1.00 0.00 H
-ATOM 1290 HA ILE B 22 18.201 39.719 36.051 1.00 0.00 H
-ATOM 1291 HB ILE B 22 17.622 37.050 34.778 1.00 0.00 H
-ATOM 1292 1HG1 ILE B 22 17.971 37.746 37.669 1.00 0.00 H
-ATOM 1293 2HG1 ILE B 22 16.399 37.616 36.874 1.00 0.00 H
-ATOM 1294 1HG2 ILE B 22 19.681 36.329 35.795 1.00 0.00 H
-ATOM 1295 2HG2 ILE B 22 20.012 37.617 34.635 1.00 0.00 H
-ATOM 1296 3HG2 ILE B 22 20.012 37.972 36.375 1.00 0.00 H
-ATOM 1297 1HD1 ILE B 22 16.939 35.592 38.072 1.00 0.00 H
-ATOM 1298 2HD1 ILE B 22 16.851 35.283 36.321 1.00 0.00 H
-ATOM 1299 3HD1 ILE B 22 18.432 35.405 37.130 1.00 0.00 H
-ATOM 1300 N GLY B 23 19.588 40.333 34.128 1.00 51.56 N
-ATOM 1301 CA GLY B 23 20.394 40.722 32.978 1.00 49.00 C
-ATOM 1302 C GLY B 23 21.536 39.733 32.780 1.00 50.00 C
-ATOM 1303 O GLY B 23 22.264 39.417 33.730 1.00 49.43 O
-ATOM 1304 H GLY B 23 19.827 40.652 35.065 1.00 0.00 H
-ATOM 1305 1HA GLY B 23 19.772 40.751 32.082 1.00 0.00 H
-ATOM 1306 2HA GLY B 23 20.795 41.722 33.131 1.00 0.00 H
-ATOM 1307 N LEU B 24 21.699 39.277 31.532 1.00 47.40 N
-ATOM 1308 CA LEU B 24 22.756 38.350 31.128 1.00 47.58 C
-ATOM 1309 C LEU B 24 23.821 39.089 30.321 1.00 46.16 C
-ATOM 1310 O LEU B 24 23.504 39.799 29.347 1.00 44.75 O
-ATOM 1311 CB LEU B 24 22.169 37.209 30.295 1.00 51.58 C
-ATOM 1312 CG LEU B 24 21.456 36.077 31.069 1.00 52.71 C
-ATOM 1313 CD1 LEU B 24 20.127 36.588 31.623 1.00 51.51 C
-ATOM 1314 CD2 LEU B 24 21.218 34.890 30.144 1.00 45.67 C
-ATOM 1315 H LEU B 24 21.029 39.566 30.824 1.00 0.00 H
-ATOM 1316 HA LEU B 24 23.213 37.933 32.020 1.00 0.00 H
-ATOM 1317 1HB LEU B 24 21.440 37.647 29.657 1.00 0.00 H
-ATOM 1318 2HB LEU B 24 22.952 36.774 29.679 1.00 0.00 H
-ATOM 1319 HG LEU B 24 22.078 35.766 31.897 1.00 0.00 H
-ATOM 1320 1HD1 LEU B 24 19.641 35.791 32.175 1.00 0.00 H
-ATOM 1321 2HD1 LEU B 24 20.298 37.414 32.281 1.00 0.00 H
-ATOM 1322 3HD1 LEU B 24 19.484 36.909 30.804 1.00 0.00 H
-ATOM 1323 1HD2 LEU B 24 20.719 34.089 30.697 1.00 0.00 H
-ATOM 1324 2HD2 LEU B 24 20.591 35.197 29.314 1.00 0.00 H
-ATOM 1325 3HD2 LEU B 24 22.170 34.522 29.765 1.00 0.00 H
-ATOM 1326 N THR B 25 25.084 38.905 30.717 1.00 46.51 N
-ATOM 1327 CA THR B 25 26.182 39.678 30.141 1.00 45.74 C
-ATOM 1328 C THR B 25 26.424 39.446 28.661 1.00 45.19 C
-ATOM 1329 O THR B 25 26.272 38.333 28.150 1.00 41.73 O
-ATOM 1330 CB THR B 25 27.520 39.405 30.861 1.00 43.63 C
-ATOM 1331 OG1 THR B 25 27.859 38.024 30.744 1.00 49.37 O
-ATOM 1332 CG2 THR B 25 27.440 39.787 32.321 1.00 45.65 C
-ATOM 1333 H THR B 25 25.261 38.277 31.497 1.00 0.00 H
-ATOM 1334 HA THR B 25 25.942 40.723 30.289 1.00 0.00 H
-ATOM 1335 HB THR B 25 28.308 39.997 30.392 1.00 0.00 H
-ATOM 1336 HG1 THR B 25 28.435 37.899 29.960 1.00 0.00 H
-ATOM 1337 1HG2 THR B 25 28.399 39.588 32.795 1.00 0.00 H
-ATOM 1338 2HG2 THR B 25 27.207 40.846 32.397 1.00 0.00 H
-ATOM 1339 3HG2 THR B 25 26.669 39.216 32.816 1.00 0.00 H
-ATOM 1340 N ARG B 26 26.853 40.525 28.005 1.00 44.20 N
-ATOM 1341 CA ARG B 26 27.250 40.551 26.604 1.00 44.83 C
-ATOM 1342 C ARG B 26 28.750 40.313 26.457 1.00 45.73 C
-ATOM 1343 O ARG B 26 29.554 40.977 27.112 1.00 48.43 O
-ATOM 1344 CB ARG B 26 26.925 41.906 25.975 1.00 40.26 C
-ATOM 1345 CG ARG B 26 27.175 41.987 24.475 1.00 39.08 C
-ATOM 1346 CD ARG B 26 26.946 43.359 23.915 1.00 33.33 C
-ATOM 1347 NE ARG B 26 25.577 43.831 24.096 1.00 44.58 N
-ATOM 1348 CZ ARG B 26 24.537 43.499 23.320 1.00 45.60 C
-ATOM 1349 NH1 ARG B 26 24.692 42.674 22.313 1.00 46.84 N
-ATOM 1350 NH2 ARG B 26 23.365 44.023 23.594 1.00 38.84 N
-ATOM 1351 H ARG B 26 26.881 41.396 28.527 1.00 0.00 H
-ATOM 1352 HA ARG B 26 26.718 39.762 26.072 1.00 0.00 H
-ATOM 1353 1HB ARG B 26 25.885 42.167 26.164 1.00 0.00 H
-ATOM 1354 2HB ARG B 26 27.539 42.680 26.441 1.00 0.00 H
-ATOM 1355 1HG ARG B 26 28.209 41.713 24.277 1.00 0.00 H
-ATOM 1356 2HG ARG B 26 26.514 41.295 23.958 1.00 0.00 H
-ATOM 1357 1HD ARG B 26 27.614 44.059 24.404 1.00 0.00 H
-ATOM 1358 2HD ARG B 26 27.159 43.347 22.850 1.00 0.00 H
-ATOM 1359 HE ARG B 26 25.378 44.497 24.853 1.00 0.00 H
-ATOM 1360 1HH1 ARG B 26 25.603 42.292 22.122 1.00 0.00 H
-ATOM 1361 2HH1 ARG B 26 23.904 42.433 21.727 1.00 0.00 H
-ATOM 1362 1HH2 ARG B 26 23.308 44.674 24.379 1.00 0.00 H
-ATOM 1363 2HH2 ARG B 26 22.536 43.792 23.047 1.00 0.00 H
-ATOM 1364 N GLY B 27 29.131 39.381 25.592 1.00 43.30 N
-ATOM 1365 CA GLY B 27 30.546 39.113 25.355 1.00 40.81 C
-ATOM 1366 C GLY B 27 30.812 37.632 25.163 1.00 45.39 C
-ATOM 1367 O GLY B 27 29.886 36.841 25.000 1.00 43.49 O
-ATOM 1368 H GLY B 27 28.433 38.848 25.091 1.00 0.00 H
-ATOM 1369 1HA GLY B 27 30.871 39.659 24.469 1.00 0.00 H
-ATOM 1370 2HA GLY B 27 31.134 39.485 26.193 1.00 0.00 H
-ATOM 1371 N ALA B 28 32.091 37.257 25.161 1.00 46.13 N
-ATOM 1372 CA ALA B 28 32.464 35.856 24.965 1.00 49.26 C
-ATOM 1373 C ALA B 28 31.893 34.982 26.081 1.00 49.95 C
-ATOM 1374 O ALA B 28 31.494 33.844 25.838 1.00 51.55 O
-ATOM 1375 CB ALA B 28 33.980 35.716 24.916 1.00 43.06 C
-ATOM 1376 H ALA B 28 32.808 37.951 25.295 1.00 0.00 H
-ATOM 1377 HA ALA B 28 32.041 35.519 24.021 1.00 0.00 H
-ATOM 1378 1HB ALA B 28 34.239 34.671 24.749 1.00 0.00 H
-ATOM 1379 2HB ALA B 28 34.379 36.323 24.103 1.00 0.00 H
-ATOM 1380 3HB ALA B 28 34.412 36.046 25.861 1.00 0.00 H
-ATOM 1381 N ASP B 29 31.872 35.523 27.301 1.00 51.36 N
-ATOM 1382 CA ASP B 29 31.341 34.835 28.472 1.00 49.84 C
-ATOM 1383 C ASP B 29 29.958 35.377 28.833 1.00 45.16 C
-ATOM 1384 O ASP B 29 29.763 36.595 28.863 1.00 38.10 O
-ATOM 1385 CB ASP B 29 32.273 35.022 29.674 1.00 60.54 C
-ATOM 1386 CG ASP B 29 33.630 34.346 29.513 1.00 68.43 C
-ATOM 1387 OD1 ASP B 29 33.692 33.278 28.955 1.00 71.52 O
-ATOM 1388 OD2 ASP B 29 34.600 34.917 29.949 1.00 73.31 O
-ATOM 1389 H ASP B 29 32.228 36.461 27.411 1.00 0.00 H
-ATOM 1390 HA ASP B 29 31.250 33.772 28.245 1.00 0.00 H
-ATOM 1391 1HB ASP B 29 32.432 36.086 29.846 1.00 0.00 H
-ATOM 1392 2HB ASP B 29 31.788 34.617 30.564 1.00 0.00 H
-ATOM 1393 N THR B 30 29.027 34.491 29.177 1.00 44.66 N
-ATOM 1394 CA THR B 30 27.702 34.936 29.614 1.00 51.85 C
-ATOM 1395 C THR B 30 27.404 34.545 31.059 1.00 54.28 C
-ATOM 1396 O THR B 30 27.537 33.382 31.442 1.00 54.73 O
-ATOM 1397 CB THR B 30 26.586 34.412 28.690 1.00 46.78 C
-ATOM 1398 OG1 THR B 30 26.781 34.927 27.367 1.00 52.10 O
-ATOM 1399 CG2 THR B 30 25.218 34.847 29.206 1.00 48.80 C
-ATOM 1400 H THR B 30 29.234 33.501 29.125 1.00 0.00 H
-ATOM 1401 HA THR B 30 27.671 36.016 29.545 1.00 0.00 H
-ATOM 1402 HB THR B 30 26.626 33.328 28.653 1.00 0.00 H
-ATOM 1403 HG1 THR B 30 26.816 35.899 27.408 1.00 0.00 H
-ATOM 1404 1HG2 THR B 30 24.446 34.469 28.539 1.00 0.00 H
-ATOM 1405 2HG2 THR B 30 25.056 34.448 30.206 1.00 0.00 H
-ATOM 1406 3HG2 THR B 30 25.175 35.939 29.237 1.00 0.00 H
-ATOM 1407 N ARG B 31 26.976 35.525 31.852 1.00 54.86 N
-ATOM 1408 CA ARG B 31 26.618 35.305 33.252 1.00 57.45 C
-ATOM 1409 C ARG B 31 25.585 36.305 33.723 1.00 55.95 C
-ATOM 1410 O ARG B 31 25.271 37.269 33.031 1.00 56.12 O
-ATOM 1411 CB ARG B 31 27.818 35.441 34.169 1.00 63.75 C
-ATOM 1412 CG ARG B 31 28.447 36.833 34.194 1.00 68.26 C
-ATOM 1413 CD ARG B 31 29.470 36.933 35.258 1.00 66.27 C
-ATOM 1414 NE ARG B 31 30.207 38.195 35.233 1.00 73.90 N
-ATOM 1415 CZ ARG B 31 29.837 39.356 35.830 1.00 69.51 C
-ATOM 1416 NH1 ARG B 31 28.703 39.480 36.503 1.00 65.31 N
-ATOM 1417 NH2 ARG B 31 30.644 40.401 35.740 1.00 61.42 N
-ATOM 1418 H ARG B 31 26.956 36.464 31.469 1.00 0.00 H
-ATOM 1419 HA ARG B 31 26.204 34.302 33.352 1.00 0.00 H
-ATOM 1420 1HB ARG B 31 27.527 35.196 35.189 1.00 0.00 H
-ATOM 1421 2HB ARG B 31 28.589 34.734 33.868 1.00 0.00 H
-ATOM 1422 1HG ARG B 31 28.916 37.040 33.231 1.00 0.00 H
-ATOM 1423 2HG ARG B 31 27.674 37.577 34.394 1.00 0.00 H
-ATOM 1424 1HD ARG B 31 28.976 36.848 36.227 1.00 0.00 H
-ATOM 1425 2HD ARG B 31 30.184 36.122 35.142 1.00 0.00 H
-ATOM 1426 HE ARG B 31 31.091 38.194 34.743 1.00 0.00 H
-ATOM 1427 1HH1 ARG B 31 28.028 38.708 36.583 1.00 0.00 H
-ATOM 1428 2HH1 ARG B 31 28.489 40.360 36.945 1.00 0.00 H
-ATOM 1429 1HH2 ARG B 31 31.515 40.322 35.233 1.00 0.00 H
-ATOM 1430 2HH2 ARG B 31 30.393 41.274 36.179 1.00 0.00 H
-ATOM 1431 N PHE B 32 25.037 36.085 34.907 1.00 56.09 N
-ATOM 1432 CA PHE B 32 24.116 37.069 35.452 1.00 55.79 C
-ATOM 1433 C PHE B 32 24.939 38.232 35.986 1.00 55.17 C
-ATOM 1434 O PHE B 32 26.005 38.009 36.574 1.00 55.08 O
-ATOM 1435 CB PHE B 32 23.302 36.471 36.598 1.00 50.81 C
-ATOM 1436 CG PHE B 32 22.354 35.418 36.165 1.00 65.81 C
-ATOM 1437 CD1 PHE B 32 21.672 34.654 37.101 1.00 63.47 C
-ATOM 1438 CD2 PHE B 32 22.146 35.172 34.821 1.00 67.31 C
-ATOM 1439 CE1 PHE B 32 20.800 33.669 36.700 1.00 64.63 C
-ATOM 1440 CE2 PHE B 32 21.275 34.186 34.414 1.00 59.04 C
-ATOM 1441 CZ PHE B 32 20.602 33.436 35.355 1.00 62.38 C
-ATOM 1442 H PHE B 32 25.277 35.262 35.442 1.00 0.00 H
-ATOM 1443 HA PHE B 32 23.449 37.426 34.667 1.00 0.00 H
-ATOM 1444 1HB PHE B 32 23.971 36.049 37.345 1.00 0.00 H
-ATOM 1445 2HB PHE B 32 22.727 37.264 37.081 1.00 0.00 H
-ATOM 1446 HD1 PHE B 32 21.833 34.842 38.164 1.00 0.00 H
-ATOM 1447 HD2 PHE B 32 22.681 35.770 34.087 1.00 0.00 H
-ATOM 1448 HE1 PHE B 32 20.269 33.075 37.442 1.00 0.00 H
-ATOM 1449 HE2 PHE B 32 21.115 33.990 33.352 1.00 0.00 H
-ATOM 1450 HZ PHE B 32 19.922 32.661 35.035 1.00 0.00 H
-ATOM 1451 N HIS B 33 24.446 39.459 35.816 1.00 54.25 N
-ATOM 1452 CA HIS B 33 25.146 40.597 36.411 1.00 56.09 C
-ATOM 1453 C HIS B 33 24.221 41.453 37.280 1.00 58.11 C
-ATOM 1454 O HIS B 33 24.680 42.324 38.019 1.00 57.70 O
-ATOM 1455 CB HIS B 33 25.788 41.466 35.324 1.00 42.53 C
-ATOM 1456 CG HIS B 33 24.827 42.211 34.450 1.00 47.39 C
-ATOM 1457 ND1 HIS B 33 24.259 43.401 34.846 1.00 42.29 N
-ATOM 1458 CD2 HIS B 33 24.339 41.960 33.208 1.00 45.29 C
-ATOM 1459 CE1 HIS B 33 23.464 43.847 33.902 1.00 45.18 C
-ATOM 1460 NE2 HIS B 33 23.495 42.999 32.894 1.00 45.01 N
-ATOM 1461 H HIS B 33 23.602 39.583 35.260 1.00 0.00 H
-ATOM 1462 HA HIS B 33 25.941 40.234 37.059 1.00 0.00 H
-ATOM 1463 1HB HIS B 33 26.452 42.197 35.790 1.00 0.00 H
-ATOM 1464 2HB HIS B 33 26.399 40.837 34.696 1.00 0.00 H
-ATOM 1465 HD2 HIS B 33 24.571 41.103 32.578 1.00 0.00 H
-ATOM 1466 HE1 HIS B 33 22.885 44.769 33.946 1.00 0.00 H
-ATOM 1467 HE2 HIS B 33 22.976 43.120 32.033 1.00 0.00 H
-ATOM 1468 N HIS B 34 22.919 41.196 37.192 1.00 58.98 N
-ATOM 1469 CA HIS B 34 21.925 41.948 37.955 1.00 56.77 C
-ATOM 1470 C HIS B 34 20.578 41.252 37.987 1.00 56.67 C
-ATOM 1471 O HIS B 34 20.094 40.760 36.969 1.00 56.03 O
-ATOM 1472 CB HIS B 34 21.721 43.364 37.405 1.00 40.70 C
-ATOM 1473 CG HIS B 34 20.774 44.196 38.246 1.00 64.48 C
-ATOM 1474 ND1 HIS B 34 21.108 44.671 39.501 1.00 61.09 N
-ATOM 1475 CD2 HIS B 34 19.511 44.630 38.004 1.00 63.07 C
-ATOM 1476 CE1 HIS B 34 20.084 45.362 39.992 1.00 60.10 C
-ATOM 1477 NE2 HIS B 34 19.109 45.352 39.103 1.00 65.54 N
-ATOM 1478 H HIS B 34 22.613 40.462 36.576 1.00 0.00 H
-ATOM 1479 HA HIS B 34 22.264 42.043 38.985 1.00 0.00 H
-ATOM 1480 1HB HIS B 34 22.680 43.884 37.348 1.00 0.00 H
-ATOM 1481 2HB HIS B 34 21.320 43.307 36.394 1.00 0.00 H
-ATOM 1482 HD2 HIS B 34 18.925 44.443 37.107 1.00 0.00 H
-ATOM 1483 HE1 HIS B 34 20.051 45.857 40.962 1.00 0.00 H
-ATOM 1484 HE2 HIS B 34 18.191 45.811 39.212 1.00 0.00 H
-ATOM 1485 N SER B 35 19.950 41.256 39.158 1.00 54.59 N
-ATOM 1486 CA SER B 35 18.603 40.712 39.305 1.00 53.61 C
-ATOM 1487 C SER B 35 17.686 41.778 39.901 1.00 53.74 C
-ATOM 1488 O SER B 35 17.840 42.153 41.065 1.00 58.10 O
-ATOM 1489 CB SER B 35 18.631 39.491 40.211 1.00 48.67 C
-ATOM 1490 OG SER B 35 19.426 38.464 39.667 1.00 62.25 O
-ATOM 1491 H SER B 35 20.404 41.672 39.960 1.00 0.00 H
-ATOM 1492 HA SER B 35 18.217 40.432 38.327 1.00 0.00 H
-ATOM 1493 1HB SER B 35 19.016 39.772 41.191 1.00 0.00 H
-ATOM 1494 2HB SER B 35 17.611 39.128 40.350 1.00 0.00 H
-ATOM 1495 HG SER B 35 20.336 38.747 39.764 1.00 0.00 H
-ATOM 1496 N GLU B 36 16.747 42.282 39.102 1.00 55.10 N
-ATOM 1497 CA GLU B 36 15.862 43.332 39.591 1.00 54.70 C
-ATOM 1498 C GLU B 36 14.600 42.726 40.175 1.00 56.19 C
-ATOM 1499 O GLU B 36 13.834 42.070 39.463 1.00 55.35 O
-ATOM 1500 CB GLU B 36 15.491 44.322 38.476 1.00 50.06 C
-ATOM 1501 CG GLU B 36 14.642 45.523 38.958 1.00 57.95 C
-ATOM 1502 CD GLU B 36 15.409 46.485 39.844 1.00 62.92 C
-ATOM 1503 OE1 GLU B 36 16.605 46.611 39.668 1.00 48.49 O
-ATOM 1504 OE2 GLU B 36 14.795 47.109 40.699 1.00 68.63 O
-ATOM 1505 H GLU B 36 16.648 41.933 38.155 1.00 0.00 H
-ATOM 1506 HA GLU B 36 16.375 43.882 40.378 1.00 0.00 H
-ATOM 1507 1HB GLU B 36 16.394 44.709 38.007 1.00 0.00 H
-ATOM 1508 2HB GLU B 36 14.924 43.802 37.705 1.00 0.00 H
-ATOM 1509 1HG GLU B 36 14.272 46.075 38.102 1.00 0.00 H
-ATOM 1510 2HG GLU B 36 13.780 45.142 39.510 1.00 0.00 H
-ATOM 1511 N LYS B 37 14.394 42.914 41.475 1.00 55.39 N
-ATOM 1512 CA LYS B 37 13.212 42.357 42.112 1.00 52.87 C
-ATOM 1513 C LYS B 37 12.006 43.250 41.913 1.00 49.24 C
-ATOM 1514 O LYS B 37 12.074 44.459 42.154 1.00 46.19 O
-ATOM 1515 CB LYS B 37 13.402 42.157 43.616 1.00 57.12 C
-ATOM 1516 CG LYS B 37 14.367 41.074 44.034 1.00 58.32 C
-ATOM 1517 CD LYS B 37 14.411 40.954 45.551 1.00 45.00 C
-ATOM 1518 CE LYS B 37 15.353 39.859 45.998 1.00 45.00 C
-ATOM 1519 NZ LYS B 37 15.377 39.710 47.478 1.00 45.00 N
-ATOM 1520 H LYS B 37 15.060 43.450 42.015 1.00 0.00 H
-ATOM 1521 HA LYS B 37 12.999 41.388 41.661 1.00 0.00 H
-ATOM 1522 1HB LYS B 37 13.754 43.087 44.055 1.00 0.00 H
-ATOM 1523 2HB LYS B 37 12.433 41.933 44.068 1.00 0.00 H
-ATOM 1524 1HG LYS B 37 14.009 40.128 43.648 1.00 0.00 H
-ATOM 1525 2HG LYS B 37 15.366 41.261 43.630 1.00 0.00 H
-ATOM 1526 1HD LYS B 37 14.733 41.905 45.980 1.00 0.00 H
-ATOM 1527 2HD LYS B 37 13.408 40.731 45.920 1.00 0.00 H
-ATOM 1528 1HE LYS B 37 15.037 38.917 45.553 1.00 0.00 H
-ATOM 1529 2HE LYS B 37 16.358 40.096 45.653 1.00 0.00 H
-ATOM 1530 1HZ LYS B 37 16.018 38.971 47.731 1.00 0.00 H
-ATOM 1531 2HZ LYS B 37 15.678 40.577 47.899 1.00 0.00 H
-ATOM 1532 3HZ LYS B 37 14.450 39.480 47.809 1.00 0.00 H
-ATOM 1533 N LEU B 38 10.899 42.645 41.518 1.00 48.71 N
-ATOM 1534 CA LEU B 38 9.643 43.349 41.384 1.00 53.35 C
-ATOM 1535 C LEU B 38 8.616 42.755 42.355 1.00 55.32 C
-ATOM 1536 O LEU B 38 8.499 41.528 42.502 1.00 55.24 O
-ATOM 1537 CB LEU B 38 9.109 43.239 39.943 1.00 46.52 C
-ATOM 1538 CG LEU B 38 10.002 43.742 38.786 1.00 51.52 C
-ATOM 1539 CD1 LEU B 38 9.277 43.467 37.438 1.00 41.97 C
-ATOM 1540 CD2 LEU B 38 10.284 45.207 38.966 1.00 45.70 C
-ATOM 1541 H LEU B 38 10.937 41.657 41.307 1.00 0.00 H
-ATOM 1542 HA LEU B 38 9.789 44.399 41.634 1.00 0.00 H
-ATOM 1543 1HB LEU B 38 8.942 42.217 39.748 1.00 0.00 H
-ATOM 1544 2HB LEU B 38 8.160 43.760 39.885 1.00 0.00 H
-ATOM 1545 HG LEU B 38 10.949 43.191 38.788 1.00 0.00 H
-ATOM 1546 1HD1 LEU B 38 9.895 43.806 36.607 1.00 0.00 H
-ATOM 1547 2HD1 LEU B 38 9.090 42.398 37.333 1.00 0.00 H
-ATOM 1548 3HD1 LEU B 38 8.324 44.004 37.419 1.00 0.00 H
-ATOM 1549 1HD2 LEU B 38 10.918 45.552 38.168 1.00 0.00 H
-ATOM 1550 2HD2 LEU B 38 9.347 45.762 38.957 1.00 0.00 H
-ATOM 1551 3HD2 LEU B 38 10.789 45.354 39.918 1.00 0.00 H
-ATOM 1552 N ASP B 39 7.835 43.621 42.977 1.00 57.07 N
-ATOM 1553 CA ASP B 39 6.716 43.154 43.788 1.00 61.04 C
-ATOM 1554 C ASP B 39 5.468 43.180 42.921 1.00 61.83 C
-ATOM 1555 O ASP B 39 5.493 43.790 41.853 1.00 64.22 O
-ATOM 1556 CB ASP B 39 6.573 43.950 45.081 1.00 64.21 C
-ATOM 1557 CG ASP B 39 7.712 43.617 46.070 1.00 62.92 C
-ATOM 1558 OD1 ASP B 39 8.289 42.553 45.934 1.00 60.59 O
-ATOM 1559 OD2 ASP B 39 7.984 44.404 46.941 1.00 56.34 O
-ATOM 1560 H ASP B 39 8.009 44.621 42.855 1.00 0.00 H
-ATOM 1561 HA ASP B 39 6.910 42.132 44.075 1.00 0.00 H
-ATOM 1562 1HB ASP B 39 6.586 45.023 44.863 1.00 0.00 H
-ATOM 1563 2HB ASP B 39 5.613 43.713 45.551 1.00 0.00 H
-ATOM 1564 N LYS B 40 4.400 42.501 43.328 1.00 60.74 N
-ATOM 1565 CA LYS B 40 3.223 42.451 42.468 1.00 58.62 C
-ATOM 1566 C LYS B 40 2.786 43.845 42.066 1.00 56.96 C
-ATOM 1567 O LYS B 40 2.622 44.723 42.911 1.00 57.08 O
-ATOM 1568 CB LYS B 40 2.069 41.718 43.155 1.00 56.58 C
-ATOM 1569 CG LYS B 40 0.830 41.544 42.287 1.00 60.54 C
-ATOM 1570 CD LYS B 40 -0.204 40.654 42.961 1.00 56.43 C
-ATOM 1571 CE LYS B 40 -1.404 40.424 42.050 1.00 62.55 C
-ATOM 1572 NZ LYS B 40 -2.403 39.496 42.657 1.00 62.73 N
-ATOM 1573 H LYS B 40 4.393 42.010 44.225 1.00 0.00 H
-ATOM 1574 HA LYS B 40 3.481 41.904 41.561 1.00 0.00 H
-ATOM 1575 1HB LYS B 40 2.398 40.744 43.476 1.00 0.00 H
-ATOM 1576 2HB LYS B 40 1.775 42.263 44.052 1.00 0.00 H
-ATOM 1577 1HG LYS B 40 0.383 42.520 42.101 1.00 0.00 H
-ATOM 1578 2HG LYS B 40 1.111 41.110 41.334 1.00 0.00 H
-ATOM 1579 1HD LYS B 40 0.253 39.691 43.190 1.00 0.00 H
-ATOM 1580 2HD LYS B 40 -0.536 41.112 43.894 1.00 0.00 H
-ATOM 1581 1HE LYS B 40 -1.885 41.380 41.850 1.00 0.00 H
-ATOM 1582 2HE LYS B 40 -1.056 39.998 41.108 1.00 0.00 H
-ATOM 1583 1HZ LYS B 40 -3.177 39.371 42.017 1.00 0.00 H
-ATOM 1584 2HZ LYS B 40 -1.964 38.600 42.833 1.00 0.00 H
-ATOM 1585 3HZ LYS B 40 -2.742 39.882 43.526 1.00 0.00 H
-ATOM 1586 N GLY B 41 2.600 44.045 40.763 1.00 55.53 N
-ATOM 1587 CA GLY B 41 2.171 45.329 40.233 1.00 50.55 C
-ATOM 1588 C GLY B 41 3.315 46.231 39.764 1.00 48.74 C
-ATOM 1589 O GLY B 41 3.086 47.217 39.061 1.00 49.05 O
-ATOM 1590 H GLY B 41 2.754 43.279 40.108 1.00 0.00 H
-ATOM 1591 1HA GLY B 41 1.480 45.160 39.414 1.00 0.00 H
-ATOM 1592 2HA GLY B 41 1.615 45.850 41.007 1.00 0.00 H
-ATOM 1593 N GLU B 42 4.553 45.925 40.128 1.00 49.35 N
-ATOM 1594 CA GLU B 42 5.630 46.798 39.675 1.00 52.15 C
-ATOM 1595 C GLU B 42 5.950 46.547 38.209 1.00 54.51 C
-ATOM 1596 O GLU B 42 5.908 45.408 37.727 1.00 52.52 O
-ATOM 1597 CB GLU B 42 6.874 46.668 40.562 1.00 60.62 C
-ATOM 1598 CG GLU B 42 6.686 47.257 41.966 1.00 67.42 C
-ATOM 1599 CD GLU B 42 7.933 47.260 42.805 1.00 67.67 C
-ATOM 1600 OE1 GLU B 42 8.674 46.317 42.755 1.00 56.96 O
-ATOM 1601 OE2 GLU B 42 8.130 48.209 43.515 1.00 69.61 O
-ATOM 1602 H GLU B 42 4.745 45.116 40.715 1.00 0.00 H
-ATOM 1603 HA GLU B 42 5.290 47.832 39.761 1.00 0.00 H
-ATOM 1604 1HB GLU B 42 7.123 45.621 40.682 1.00 0.00 H
-ATOM 1605 2HB GLU B 42 7.723 47.166 40.092 1.00 0.00 H
-ATOM 1606 1HG GLU B 42 6.334 48.286 41.863 1.00 0.00 H
-ATOM 1607 2HG GLU B 42 5.909 46.689 42.481 1.00 0.00 H
-ATOM 1608 N VAL B 43 6.268 47.629 37.493 1.00 55.33 N
-ATOM 1609 CA VAL B 43 6.601 47.517 36.076 1.00 56.62 C
-ATOM 1610 C VAL B 43 8.014 47.964 35.763 1.00 57.77 C
-ATOM 1611 O VAL B 43 8.453 49.037 36.179 1.00 57.24 O
-ATOM 1612 CB VAL B 43 5.602 48.327 35.208 1.00 56.38 C
-ATOM 1613 CG1 VAL B 43 6.030 48.295 33.740 1.00 47.09 C
-ATOM 1614 CG2 VAL B 43 4.207 47.706 35.323 1.00 48.60 C
-ATOM 1615 H VAL B 43 6.282 48.546 37.944 1.00 0.00 H
-ATOM 1616 HA VAL B 43 6.510 46.472 35.792 1.00 0.00 H
-ATOM 1617 HB VAL B 43 5.587 49.363 35.547 1.00 0.00 H
-ATOM 1618 1HG1 VAL B 43 5.324 48.864 33.139 1.00 0.00 H
-ATOM 1619 2HG1 VAL B 43 7.020 48.732 33.635 1.00 0.00 H
-ATOM 1620 3HG1 VAL B 43 6.050 47.259 33.396 1.00 0.00 H
-ATOM 1621 1HG2 VAL B 43 3.496 48.266 34.714 1.00 0.00 H
-ATOM 1622 2HG2 VAL B 43 4.256 46.690 34.971 1.00 0.00 H
-ATOM 1623 3HG2 VAL B 43 3.886 47.715 36.362 1.00 0.00 H
-ATOM 1624 N LEU B 44 8.727 47.126 35.022 1.00 58.51 N
-ATOM 1625 CA LEU B 44 10.077 47.450 34.597 1.00 57.62 C
-ATOM 1626 C LEU B 44 10.168 47.493 33.081 1.00 57.58 C
-ATOM 1627 O LEU B 44 9.812 46.531 32.397 1.00 57.35 O
-ATOM 1628 CB LEU B 44 11.073 46.418 35.128 1.00 51.60 C
-ATOM 1629 CG LEU B 44 12.534 46.621 34.700 1.00 46.63 C
-ATOM 1630 CD1 LEU B 44 13.079 47.929 35.306 1.00 45.64 C
-ATOM 1631 CD2 LEU B 44 13.340 45.422 35.152 1.00 45.25 C
-ATOM 1632 H LEU B 44 8.309 46.242 34.737 1.00 0.00 H
-ATOM 1633 HA LEU B 44 10.347 48.429 34.984 1.00 0.00 H
-ATOM 1634 1HB LEU B 44 11.047 46.456 36.198 1.00 0.00 H
-ATOM 1635 2HB LEU B 44 10.755 45.424 34.806 1.00 0.00 H
-ATOM 1636 HG LEU B 44 12.591 46.708 33.614 1.00 0.00 H
-ATOM 1637 1HD1 LEU B 44 14.108 48.071 34.994 1.00 0.00 H
-ATOM 1638 2HD1 LEU B 44 12.477 48.766 34.957 1.00 0.00 H
-ATOM 1639 3HD1 LEU B 44 13.033 47.877 36.393 1.00 0.00 H
-ATOM 1640 1HD2 LEU B 44 14.381 45.540 34.853 1.00 0.00 H
-ATOM 1641 2HD2 LEU B 44 13.281 45.327 36.230 1.00 0.00 H
-ATOM 1642 3HD2 LEU B 44 12.928 44.533 34.694 1.00 0.00 H
-ATOM 1643 N ILE B 45 10.623 48.614 32.554 1.00 56.16 N
-ATOM 1644 CA ILE B 45 10.797 48.742 31.120 1.00 55.45 C
-ATOM 1645 C ILE B 45 12.290 48.843 30.874 1.00 55.07 C
-ATOM 1646 O ILE B 45 12.951 49.727 31.420 1.00 53.59 O
-ATOM 1647 CB ILE B 45 10.061 49.966 30.572 1.00 50.31 C
-ATOM 1648 CG1 ILE B 45 8.583 49.848 30.929 1.00 50.29 C
-ATOM 1649 CG2 ILE B 45 10.218 49.958 29.066 1.00 43.88 C
-ATOM 1650 CD1 ILE B 45 7.770 51.063 30.683 1.00 43.38 C
-ATOM 1651 H ILE B 45 10.866 49.393 33.158 1.00 0.00 H
-ATOM 1652 HA ILE B 45 10.421 47.852 30.626 1.00 0.00 H
-ATOM 1653 HB ILE B 45 10.460 50.884 31.001 1.00 0.00 H
-ATOM 1654 1HG1 ILE B 45 8.171 49.047 30.357 1.00 0.00 H
-ATOM 1655 2HG1 ILE B 45 8.500 49.599 31.981 1.00 0.00 H
-ATOM 1656 1HG2 ILE B 45 9.691 50.795 28.623 1.00 0.00 H
-ATOM 1657 2HG2 ILE B 45 11.273 50.009 28.806 1.00 0.00 H
-ATOM 1658 3HG2 ILE B 45 9.810 49.032 28.690 1.00 0.00 H
-ATOM 1659 1HD1 ILE B 45 6.749 50.849 30.966 1.00 0.00 H
-ATOM 1660 2HD1 ILE B 45 8.151 51.896 31.277 1.00 0.00 H
-ATOM 1661 3HD1 ILE B 45 7.811 51.314 29.636 1.00 0.00 H
-ATOM 1662 N ALA B 46 12.853 47.931 30.092 1.00 53.64 N
-ATOM 1663 CA ALA B 46 14.309 47.946 30.009 1.00 52.67 C
-ATOM 1664 C ALA B 46 14.868 47.631 28.646 1.00 51.13 C
-ATOM 1665 O ALA B 46 14.372 46.759 27.929 1.00 50.62 O
-ATOM 1666 CB ALA B 46 14.861 46.940 31.003 1.00 45.40 C
-ATOM 1667 H ALA B 46 12.280 47.235 29.617 1.00 0.00 H
-ATOM 1668 HA ALA B 46 14.649 48.943 30.271 1.00 0.00 H
-ATOM 1669 1HB ALA B 46 15.950 46.974 30.978 1.00 0.00 H
-ATOM 1670 2HB ALA B 46 14.509 47.182 32.004 1.00 0.00 H
-ATOM 1671 3HB ALA B 46 14.521 45.942 30.728 1.00 0.00 H
-ATOM 1672 N GLN B 47 15.947 48.339 28.316 1.00 47.94 N
-ATOM 1673 CA GLN B 47 16.658 48.175 27.060 1.00 45.03 C
-ATOM 1674 C GLN B 47 17.778 47.170 27.121 1.00 43.49 C
-ATOM 1675 O GLN B 47 18.367 46.926 28.174 1.00 43.28 O
-ATOM 1676 CB GLN B 47 17.261 49.496 26.587 1.00 43.09 C
-ATOM 1677 CG GLN B 47 16.278 50.549 26.208 1.00 41.15 C
-ATOM 1678 CD GLN B 47 16.950 51.754 25.661 1.00 46.46 C
-ATOM 1679 OE1 GLN B 47 18.034 52.147 26.112 1.00 46.02 O
-ATOM 1680 NE2 GLN B 47 16.322 52.362 24.662 1.00 37.01 N
-ATOM 1681 H GLN B 47 16.290 49.048 28.963 1.00 0.00 H
-ATOM 1682 HA GLN B 47 15.958 47.838 26.311 1.00 0.00 H
-ATOM 1683 1HB GLN B 47 17.891 49.903 27.378 1.00 0.00 H
-ATOM 1684 2HB GLN B 47 17.901 49.307 25.723 1.00 0.00 H
-ATOM 1685 1HG GLN B 47 15.660 50.163 25.418 1.00 0.00 H
-ATOM 1686 2HG GLN B 47 15.678 50.831 27.078 1.00 0.00 H
-ATOM 1687 1HE2 GLN B 47 16.712 53.180 24.242 1.00 0.00 H
-ATOM 1688 2HE2 GLN B 47 15.442 51.999 24.335 1.00 0.00 H
-ATOM 1689 N PHE B 48 18.115 46.647 25.952 1.00 42.91 N
-ATOM 1690 CA PHE B 48 19.305 45.822 25.819 1.00 41.43 C
-ATOM 1691 C PHE B 48 20.465 46.809 25.751 1.00 37.30 C
-ATOM 1692 O PHE B 48 20.290 47.920 25.245 1.00 35.34 O
-ATOM 1693 CB PHE B 48 19.219 44.949 24.579 1.00 38.32 C
-ATOM 1694 CG PHE B 48 18.166 43.893 24.704 1.00 32.68 C
-ATOM 1695 CD1 PHE B 48 18.394 42.740 25.443 1.00 32.00 C
-ATOM 1696 CD2 PHE B 48 16.925 44.068 24.100 1.00 39.56 C
-ATOM 1697 CE1 PHE B 48 17.400 41.795 25.570 1.00 38.56 C
-ATOM 1698 CE2 PHE B 48 15.938 43.124 24.233 1.00 33.39 C
-ATOM 1699 CZ PHE B 48 16.179 41.996 24.971 1.00 33.53 C
-ATOM 1700 H PHE B 48 17.536 46.860 25.139 1.00 0.00 H
-ATOM 1701 HA PHE B 48 19.423 45.189 26.702 1.00 0.00 H
-ATOM 1702 1HB PHE B 48 19.006 45.558 23.701 1.00 0.00 H
-ATOM 1703 2HB PHE B 48 20.177 44.461 24.430 1.00 0.00 H
-ATOM 1704 HD1 PHE B 48 19.365 42.594 25.926 1.00 0.00 H
-ATOM 1705 HD2 PHE B 48 16.739 44.973 23.523 1.00 0.00 H
-ATOM 1706 HE1 PHE B 48 17.575 40.899 26.149 1.00 0.00 H
-ATOM 1707 HE2 PHE B 48 14.966 43.273 23.761 1.00 0.00 H
-ATOM 1708 HZ PHE B 48 15.411 41.274 25.088 1.00 0.00 H
-ATOM 1709 N THR B 49 21.616 46.463 26.318 1.00 37.44 N
-ATOM 1710 CA THR B 49 22.710 47.435 26.400 1.00 39.95 C
-ATOM 1711 C THR B 49 24.045 46.890 25.956 1.00 42.10 C
-ATOM 1712 O THR B 49 24.178 45.737 25.553 1.00 41.13 O
-ATOM 1713 CB THR B 49 22.923 47.962 27.827 1.00 33.68 C
-ATOM 1714 OG1 THR B 49 23.495 46.920 28.635 1.00 33.77 O
-ATOM 1715 CG2 THR B 49 21.604 48.412 28.438 1.00 26.33 C
-ATOM 1716 H THR B 49 21.731 45.514 26.672 1.00 0.00 H
-ATOM 1717 HA THR B 49 22.473 48.281 25.754 1.00 0.00 H
-ATOM 1718 HB THR B 49 23.604 48.813 27.806 1.00 0.00 H
-ATOM 1719 HG1 THR B 49 24.171 46.467 28.116 1.00 0.00 H
-ATOM 1720 1HG2 THR B 49 21.779 48.785 29.446 1.00 0.00 H
-ATOM 1721 2HG2 THR B 49 21.173 49.206 27.824 1.00 0.00 H
-ATOM 1722 3HG2 THR B 49 20.907 47.575 28.483 1.00 0.00 H
-ATOM 1723 N GLU B 50 25.056 47.730 26.098 1.00 42.88 N
-ATOM 1724 CA GLU B 50 26.439 47.386 25.825 1.00 45.72 C
-ATOM 1725 C GLU B 50 26.897 46.224 26.716 1.00 48.76 C
-ATOM 1726 O GLU B 50 27.847 45.520 26.385 1.00 51.37 O
-ATOM 1727 CB GLU B 50 27.316 48.610 26.082 1.00 41.16 C
-ATOM 1728 CG GLU B 50 26.886 49.852 25.312 1.00 45.73 C
-ATOM 1729 CD GLU B 50 25.811 50.624 26.063 1.00 46.95 C
-ATOM 1730 OE1 GLU B 50 24.667 50.604 25.658 1.00 32.40 O
-ATOM 1731 OE2 GLU B 50 26.143 51.229 27.048 1.00 46.85 O
-ATOM 1732 H GLU B 50 24.863 48.666 26.421 1.00 0.00 H
-ATOM 1733 HA GLU B 50 26.527 47.084 24.780 1.00 0.00 H
-ATOM 1734 1HB GLU B 50 27.292 48.856 27.144 1.00 0.00 H
-ATOM 1735 2HB GLU B 50 28.348 48.383 25.822 1.00 0.00 H
-ATOM 1736 1HG GLU B 50 27.747 50.502 25.156 1.00 0.00 H
-ATOM 1737 2HG GLU B 50 26.504 49.552 24.337 1.00 0.00 H
-ATOM 1738 N HIS B 51 26.229 46.050 27.867 1.00 47.25 N
-ATOM 1739 CA HIS B 51 26.589 45.011 28.814 1.00 48.66 C
-ATOM 1740 C HIS B 51 25.531 43.902 28.924 1.00 46.78 C
-ATOM 1741 O HIS B 51 25.878 42.784 29.299 1.00 45.51 O
-ATOM 1742 CB HIS B 51 26.847 45.632 30.196 1.00 45.43 C
-ATOM 1743 CG HIS B 51 28.010 46.595 30.199 1.00 42.00 C
-ATOM 1744 ND1 HIS B 51 27.885 47.915 29.818 1.00 44.83 N
-ATOM 1745 CD2 HIS B 51 29.312 46.424 30.530 1.00 35.54 C
-ATOM 1746 CE1 HIS B 51 29.060 48.512 29.910 1.00 40.55 C
-ATOM 1747 NE2 HIS B 51 29.943 47.632 30.342 1.00 43.91 N
-ATOM 1748 H HIS B 51 25.434 46.636 28.086 1.00 0.00 H
-ATOM 1749 HA HIS B 51 27.517 44.539 28.490 1.00 0.00 H
-ATOM 1750 1HB HIS B 51 25.955 46.172 30.526 1.00 0.00 H
-ATOM 1751 2HB HIS B 51 27.041 44.845 30.923 1.00 0.00 H
-ATOM 1752 HD2 HIS B 51 29.777 45.502 30.880 1.00 0.00 H
-ATOM 1753 HE1 HIS B 51 29.264 49.556 29.670 1.00 0.00 H
-ATOM 1754 HE2 HIS B 51 30.926 47.809 30.507 1.00 0.00 H
-ATOM 1755 N THR B 52 24.264 44.189 28.573 1.00 45.69 N
-ATOM 1756 CA THR B 52 23.194 43.173 28.665 1.00 45.80 C
-ATOM 1757 C THR B 52 22.738 42.692 27.284 1.00 46.38 C
-ATOM 1758 O THR B 52 22.187 43.467 26.496 1.00 42.34 O
-ATOM 1759 CB THR B 52 21.939 43.711 29.398 1.00 46.43 C
-ATOM 1760 OG1 THR B 52 22.278 44.104 30.732 1.00 43.19 O
-ATOM 1761 CG2 THR B 52 20.837 42.629 29.438 1.00 40.79 C
-ATOM 1762 H THR B 52 24.028 45.130 28.287 1.00 0.00 H
-ATOM 1763 HA THR B 52 23.574 42.314 29.212 1.00 0.00 H
-ATOM 1764 HB THR B 52 21.556 44.583 28.868 1.00 0.00 H
-ATOM 1765 HG1 THR B 52 22.746 44.946 30.703 1.00 0.00 H
-ATOM 1766 1HG2 THR B 52 19.957 43.017 29.952 1.00 0.00 H
-ATOM 1767 2HG2 THR B 52 20.562 42.344 28.422 1.00 0.00 H
-ATOM 1768 3HG2 THR B 52 21.207 41.752 29.968 1.00 0.00 H
-ATOM 1769 N SER B 53 22.925 41.394 27.018 1.00 43.15 N
-ATOM 1770 CA SER B 53 22.554 40.806 25.726 1.00 48.14 C
-ATOM 1771 C SER B 53 21.267 40.009 25.816 1.00 48.90 C
-ATOM 1772 O SER B 53 20.626 39.709 24.802 1.00 48.38 O
-ATOM 1773 CB SER B 53 23.653 39.909 25.207 1.00 42.51 C
-ATOM 1774 OG SER B 53 23.865 38.809 26.049 1.00 36.13 O
-ATOM 1775 H SER B 53 23.346 40.807 27.736 1.00 0.00 H
-ATOM 1776 HA SER B 53 22.398 41.612 25.008 1.00 0.00 H
-ATOM 1777 1HB SER B 53 23.382 39.559 24.214 1.00 0.00 H
-ATOM 1778 2HB SER B 53 24.555 40.477 25.115 1.00 0.00 H
-ATOM 1779 HG SER B 53 23.893 39.156 26.953 1.00 0.00 H
-ATOM 1780 N ALA B 54 20.886 39.660 27.037 1.00 44.60 N
-ATOM 1781 CA ALA B 54 19.668 38.887 27.206 1.00 45.74 C
-ATOM 1782 C ALA B 54 19.020 39.186 28.544 1.00 47.05 C
-ATOM 1783 O ALA B 54 19.686 39.535 29.522 1.00 45.69 O
-ATOM 1784 CB ALA B 54 19.958 37.400 27.053 1.00 35.57 C
-ATOM 1785 H ALA B 54 21.469 39.904 27.833 1.00 0.00 H
-ATOM 1786 HA ALA B 54 18.969 39.182 26.431 1.00 0.00 H
-ATOM 1787 1HB ALA B 54 19.030 36.841 27.151 1.00 0.00 H
-ATOM 1788 2HB ALA B 54 20.390 37.223 26.069 1.00 0.00 H
-ATOM 1789 3HB ALA B 54 20.645 37.068 27.791 1.00 0.00 H
-ATOM 1790 N ILE B 55 17.702 39.021 28.571 1.00 47.54 N
-ATOM 1791 CA ILE B 55 16.905 39.206 29.771 1.00 48.40 C
-ATOM 1792 C ILE B 55 16.172 37.922 30.143 1.00 49.36 C
-ATOM 1793 O ILE B 55 15.463 37.332 29.329 1.00 48.13 O
-ATOM 1794 CB ILE B 55 15.899 40.359 29.582 1.00 47.64 C
-ATOM 1795 CG1 ILE B 55 16.665 41.680 29.309 1.00 41.75 C
-ATOM 1796 CG2 ILE B 55 15.018 40.482 30.807 1.00 49.48 C
-ATOM 1797 CD1 ILE B 55 15.781 42.830 28.877 1.00 37.17 C
-ATOM 1798 H ILE B 55 17.242 38.730 27.715 1.00 0.00 H
-ATOM 1799 HA ILE B 55 17.569 39.468 30.589 1.00 0.00 H
-ATOM 1800 HB ILE B 55 15.275 40.159 28.714 1.00 0.00 H
-ATOM 1801 1HG1 ILE B 55 17.199 41.971 30.216 1.00 0.00 H
-ATOM 1802 2HG1 ILE B 55 17.391 41.510 28.525 1.00 0.00 H
-ATOM 1803 1HG2 ILE B 55 14.307 41.293 30.666 1.00 0.00 H
-ATOM 1804 2HG2 ILE B 55 14.475 39.550 30.965 1.00 0.00 H
-ATOM 1805 3HG2 ILE B 55 15.646 40.687 31.673 1.00 0.00 H
-ATOM 1806 1HD1 ILE B 55 16.392 43.718 28.698 1.00 0.00 H
-ATOM 1807 2HD1 ILE B 55 15.258 42.560 27.957 1.00 0.00 H
-ATOM 1808 3HD1 ILE B 55 15.056 43.043 29.660 1.00 0.00 H
-ATOM 1809 N LYS B 56 16.361 37.478 31.372 1.00 50.40 N
-ATOM 1810 CA LYS B 56 15.709 36.260 31.834 1.00 53.00 C
-ATOM 1811 C LYS B 56 14.695 36.603 32.907 1.00 56.12 C
-ATOM 1812 O LYS B 56 14.972 37.417 33.784 1.00 54.77 O
-ATOM 1813 CB LYS B 56 16.743 35.261 32.326 1.00 44.27 C
-ATOM 1814 CG LYS B 56 16.192 33.949 32.796 1.00 51.57 C
-ATOM 1815 CD LYS B 56 17.327 33.027 33.167 1.00 49.79 C
-ATOM 1816 CE LYS B 56 16.835 31.681 33.647 1.00 51.83 C
-ATOM 1817 NZ LYS B 56 17.965 30.743 33.845 1.00 48.80 N
-ATOM 1818 H LYS B 56 16.969 38.001 31.996 1.00 0.00 H
-ATOM 1819 HA LYS B 56 15.173 35.811 31.003 1.00 0.00 H
-ATOM 1820 1HB LYS B 56 17.435 35.045 31.517 1.00 0.00 H
-ATOM 1821 2HB LYS B 56 17.312 35.686 33.130 1.00 0.00 H
-ATOM 1822 1HG LYS B 56 15.544 34.097 33.664 1.00 0.00 H
-ATOM 1823 2HG LYS B 56 15.600 33.502 31.990 1.00 0.00 H
-ATOM 1824 1HD LYS B 56 17.980 32.873 32.301 1.00 0.00 H
-ATOM 1825 2HD LYS B 56 17.909 33.492 33.960 1.00 0.00 H
-ATOM 1826 1HE LYS B 56 16.302 31.799 34.589 1.00 0.00 H
-ATOM 1827 2HE LYS B 56 16.157 31.272 32.916 1.00 0.00 H
-ATOM 1828 1HZ LYS B 56 17.629 29.832 34.150 1.00 0.00 H
-ATOM 1829 2HZ LYS B 56 18.476 30.637 32.970 1.00 0.00 H
-ATOM 1830 3HZ LYS B 56 18.594 31.111 34.531 1.00 0.00 H
-ATOM 1831 N VAL B 57 13.497 36.037 32.816 1.00 58.42 N
-ATOM 1832 CA VAL B 57 12.483 36.379 33.798 1.00 58.41 C
-ATOM 1833 C VAL B 57 12.001 35.174 34.605 1.00 58.61 C
-ATOM 1834 O VAL B 57 11.603 34.136 34.054 1.00 60.18 O
-ATOM 1835 CB VAL B 57 11.292 37.064 33.100 1.00 55.01 C
-ATOM 1836 CG1 VAL B 57 10.220 37.447 34.138 1.00 48.61 C
-ATOM 1837 CG2 VAL B 57 11.794 38.280 32.339 1.00 53.24 C
-ATOM 1838 H VAL B 57 13.296 35.387 32.061 1.00 0.00 H
-ATOM 1839 HA VAL B 57 12.911 37.095 34.497 1.00 0.00 H
-ATOM 1840 HB VAL B 57 10.833 36.367 32.399 1.00 0.00 H
-ATOM 1841 1HG1 VAL B 57 9.384 37.923 33.640 1.00 0.00 H
-ATOM 1842 2HG1 VAL B 57 9.866 36.553 34.658 1.00 0.00 H
-ATOM 1843 3HG1 VAL B 57 10.647 38.141 34.865 1.00 0.00 H
-ATOM 1844 1HG2 VAL B 57 10.957 38.758 31.838 1.00 0.00 H
-ATOM 1845 2HG2 VAL B 57 12.253 38.973 33.042 1.00 0.00 H
-ATOM 1846 3HG2 VAL B 57 12.530 37.977 31.596 1.00 0.00 H
-ATOM 1847 N ARG B 58 12.051 35.346 35.932 1.00 58.62 N
-ATOM 1848 CA ARG B 58 11.607 34.365 36.922 1.00 58.47 C
-ATOM 1849 C ARG B 58 10.421 34.890 37.720 1.00 58.73 C
-ATOM 1850 O ARG B 58 10.321 36.086 38.004 1.00 59.49 O
-ATOM 1851 CB ARG B 58 12.723 34.006 37.889 1.00 57.46 C
-ATOM 1852 CG ARG B 58 13.812 33.134 37.338 1.00 64.89 C
-ATOM 1853 CD ARG B 58 14.855 32.875 38.364 1.00 76.16 C
-ATOM 1854 NE ARG B 58 15.815 31.882 37.923 1.00 86.50 N
-ATOM 1855 CZ ARG B 58 17.022 31.680 38.492 1.00 86.67 C
-ATOM 1856 NH1 ARG B 58 17.416 32.445 39.487 1.00 87.01 N
-ATOM 1857 NH2 ARG B 58 17.809 30.710 38.057 1.00 74.41 N
-ATOM 1858 H ARG B 58 12.428 36.226 36.275 1.00 0.00 H
-ATOM 1859 HA ARG B 58 11.297 33.460 36.401 1.00 0.00 H
-ATOM 1860 1HB ARG B 58 13.198 34.913 38.239 1.00 0.00 H
-ATOM 1861 2HB ARG B 58 12.302 33.497 38.764 1.00 0.00 H
-ATOM 1862 1HG ARG B 58 13.379 32.180 37.039 1.00 0.00 H
-ATOM 1863 2HG ARG B 58 14.277 33.617 36.476 1.00 0.00 H
-ATOM 1864 1HD ARG B 58 15.388 33.796 38.590 1.00 0.00 H
-ATOM 1865 2HD ARG B 58 14.375 32.505 39.274 1.00 0.00 H
-ATOM 1866 HE ARG B 58 15.522 31.264 37.155 1.00 0.00 H
-ATOM 1867 1HH1 ARG B 58 16.811 33.183 39.823 1.00 0.00 H
-ATOM 1868 2HH1 ARG B 58 18.315 32.294 39.917 1.00 0.00 H
-ATOM 1869 1HH2 ARG B 58 17.494 30.102 37.311 1.00 0.00 H
-ATOM 1870 2HH2 ARG B 58 18.708 30.556 38.488 1.00 0.00 H
-ATOM 1871 N GLY B 59 9.538 33.981 38.105 1.00 58.71 N
-ATOM 1872 CA GLY B 59 8.339 34.335 38.843 1.00 56.97 C
-ATOM 1873 C GLY B 59 7.273 34.640 37.814 1.00 57.35 C
-ATOM 1874 O GLY B 59 7.578 34.760 36.628 1.00 58.85 O
-ATOM 1875 H GLY B 59 9.678 33.006 37.873 1.00 0.00 H
-ATOM 1876 1HA GLY B 59 8.028 33.505 39.480 1.00 0.00 H
-ATOM 1877 2HA GLY B 59 8.519 35.200 39.479 1.00 0.00 H
-ATOM 1878 N LYS B 60 6.028 34.750 38.238 1.00 56.67 N
-ATOM 1879 CA LYS B 60 4.983 35.029 37.264 1.00 55.89 C
-ATOM 1880 C LYS B 60 5.035 36.487 36.821 1.00 55.27 C
-ATOM 1881 O LYS B 60 5.092 37.394 37.656 1.00 55.90 O
-ATOM 1882 CB LYS B 60 3.608 34.705 37.845 1.00 50.21 C
-ATOM 1883 CG LYS B 60 3.379 33.234 38.111 1.00 45.51 C
-ATOM 1884 CD LYS B 60 2.009 32.992 38.691 1.00 49.27 C
-ATOM 1885 CE LYS B 60 1.781 31.514 38.957 1.00 45.00 C
-ATOM 1886 NZ LYS B 60 0.440 31.260 39.549 1.00 45.00 N
-ATOM 1887 H LYS B 60 5.812 34.619 39.226 1.00 0.00 H
-ATOM 1888 HA LYS B 60 5.152 34.403 36.393 1.00 0.00 H
-ATOM 1889 1HB LYS B 60 3.457 35.246 38.774 1.00 0.00 H
-ATOM 1890 2HB LYS B 60 2.840 35.031 37.148 1.00 0.00 H
-ATOM 1891 1HG LYS B 60 3.468 32.679 37.185 1.00 0.00 H
-ATOM 1892 2HG LYS B 60 4.138 32.869 38.809 1.00 0.00 H
-ATOM 1893 1HD LYS B 60 1.921 33.541 39.634 1.00 0.00 H
-ATOM 1894 2HD LYS B 60 1.252 33.358 38.001 1.00 0.00 H
-ATOM 1895 1HE LYS B 60 1.866 30.966 38.019 1.00 0.00 H
-ATOM 1896 2HE LYS B 60 2.546 31.155 39.648 1.00 0.00 H
-ATOM 1897 1HZ LYS B 60 0.325 30.271 39.712 1.00 0.00 H
-ATOM 1898 2HZ LYS B 60 0.362 31.759 40.425 1.00 0.00 H
-ATOM 1899 3HZ LYS B 60 -0.276 31.582 38.913 1.00 0.00 H
-ATOM 1900 N ALA B 61 4.986 36.716 35.514 1.00 54.80 N
-ATOM 1901 CA ALA B 61 5.026 38.092 35.014 1.00 53.31 C
-ATOM 1902 C ALA B 61 4.396 38.219 33.634 1.00 53.65 C
-ATOM 1903 O ALA B 61 4.465 37.304 32.809 1.00 55.36 O
-ATOM 1904 CB ALA B 61 6.453 38.602 34.973 1.00 38.63 C
-ATOM 1905 H ALA B 61 4.933 35.918 34.883 1.00 0.00 H
-ATOM 1906 HA ALA B 61 4.479 38.714 35.706 1.00 0.00 H
-ATOM 1907 1HB ALA B 61 6.453 39.640 34.646 1.00 0.00 H
-ATOM 1908 2HB ALA B 61 6.873 38.531 35.963 1.00 0.00 H
-ATOM 1909 3HB ALA B 61 7.045 38.014 34.293 1.00 0.00 H
-ATOM 1910 N TYR B 62 3.835 39.392 33.367 1.00 52.84 N
-ATOM 1911 CA TYR B 62 3.253 39.709 32.067 1.00 52.44 C
-ATOM 1912 C TYR B 62 4.315 40.433 31.253 1.00 53.22 C
-ATOM 1913 O TYR B 62 4.852 41.447 31.705 1.00 51.46 O
-ATOM 1914 CB TYR B 62 2.015 40.579 32.263 1.00 49.73 C
-ATOM 1915 CG TYR B 62 1.254 40.947 31.029 1.00 47.95 C
-ATOM 1916 CD1 TYR B 62 0.385 40.048 30.447 1.00 45.76 C
-ATOM 1917 CD2 TYR B 62 1.419 42.193 30.485 1.00 51.06 C
-ATOM 1918 CE1 TYR B 62 -0.331 40.411 29.330 1.00 45.50 C
-ATOM 1919 CE2 TYR B 62 0.707 42.563 29.369 1.00 48.31 C
-ATOM 1920 CZ TYR B 62 -0.166 41.684 28.795 1.00 49.24 C
-ATOM 1921 OH TYR B 62 -0.888 42.063 27.688 1.00 52.40 O
-ATOM 1922 H TYR B 62 3.830 40.100 34.100 1.00 0.00 H
-ATOM 1923 HA TYR B 62 2.985 38.788 31.551 1.00 0.00 H
-ATOM 1924 1HB TYR B 62 1.330 40.067 32.932 1.00 0.00 H
-ATOM 1925 2HB TYR B 62 2.301 41.486 32.748 1.00 0.00 H
-ATOM 1926 HD1 TYR B 62 0.251 39.058 30.878 1.00 0.00 H
-ATOM 1927 HD2 TYR B 62 2.112 42.889 30.949 1.00 0.00 H
-ATOM 1928 HE1 TYR B 62 -1.026 39.704 28.877 1.00 0.00 H
-ATOM 1929 HE2 TYR B 62 0.833 43.552 28.949 1.00 0.00 H
-ATOM 1930 HH TYR B 62 -0.741 42.996 27.514 1.00 0.00 H
-ATOM 1931 N ILE B 63 4.663 39.901 30.083 1.00 52.41 N
-ATOM 1932 CA ILE B 63 5.759 40.480 29.320 1.00 51.57 C
-ATOM 1933 C ILE B 63 5.342 40.951 27.914 1.00 51.09 C
-ATOM 1934 O ILE B 63 4.699 40.222 27.153 1.00 51.02 O
-ATOM 1935 CB ILE B 63 6.884 39.445 29.191 1.00 49.30 C
-ATOM 1936 CG1 ILE B 63 7.341 38.975 30.572 1.00 37.36 C
-ATOM 1937 CG2 ILE B 63 8.054 40.054 28.448 1.00 36.83 C
-ATOM 1938 CD1 ILE B 63 8.241 37.774 30.516 1.00 34.70 C
-ATOM 1939 H ILE B 63 4.213 39.066 29.720 1.00 0.00 H
-ATOM 1940 HA ILE B 63 6.139 41.335 29.867 1.00 0.00 H
-ATOM 1941 HB ILE B 63 6.523 38.595 28.666 1.00 0.00 H
-ATOM 1942 1HG1 ILE B 63 7.851 39.775 31.062 1.00 0.00 H
-ATOM 1943 2HG1 ILE B 63 6.472 38.705 31.165 1.00 0.00 H
-ATOM 1944 1HG2 ILE B 63 8.831 39.315 28.361 1.00 0.00 H
-ATOM 1945 2HG2 ILE B 63 7.734 40.362 27.464 1.00 0.00 H
-ATOM 1946 3HG2 ILE B 63 8.428 40.920 28.992 1.00 0.00 H
-ATOM 1947 1HD1 ILE B 63 8.522 37.488 31.522 1.00 0.00 H
-ATOM 1948 2HD1 ILE B 63 7.712 36.945 30.038 1.00 0.00 H
-ATOM 1949 3HD1 ILE B 63 9.135 38.011 29.944 1.00 0.00 H
-ATOM 1950 N GLN B 64 5.709 42.185 27.570 1.00 51.25 N
-ATOM 1951 CA GLN B 64 5.406 42.726 26.244 1.00 50.78 C
-ATOM 1952 C GLN B 64 6.715 42.997 25.514 1.00 49.87 C
-ATOM 1953 O GLN B 64 7.597 43.692 26.034 1.00 49.47 O
-ATOM 1954 CB GLN B 64 4.602 44.028 26.356 1.00 46.36 C
-ATOM 1955 CG GLN B 64 3.289 43.888 27.104 1.00 41.46 C
-ATOM 1956 CD GLN B 64 2.606 45.227 27.394 1.00 45.11 C
-ATOM 1957 OE1 GLN B 64 3.204 46.105 28.012 1.00 52.94 O
-ATOM 1958 NE2 GLN B 64 1.358 45.366 26.965 1.00 35.56 N
-ATOM 1959 H GLN B 64 6.223 42.748 28.245 1.00 0.00 H
-ATOM 1960 HA GLN B 64 4.839 41.993 25.671 1.00 0.00 H
-ATOM 1961 1HB GLN B 64 5.188 44.795 26.784 1.00 0.00 H
-ATOM 1962 2HB GLN B 64 4.349 44.362 25.345 1.00 0.00 H
-ATOM 1963 1HG GLN B 64 2.610 43.287 26.516 1.00 0.00 H
-ATOM 1964 2HG GLN B 64 3.487 43.399 28.056 1.00 0.00 H
-ATOM 1965 1HE2 GLN B 64 0.838 46.224 27.163 1.00 0.00 H
-ATOM 1966 2HE2 GLN B 64 0.919 44.624 26.461 1.00 0.00 H
-ATOM 1967 N THR B 65 6.871 42.428 24.324 1.00 49.40 N
-ATOM 1968 CA THR B 65 8.103 42.624 23.568 1.00 44.79 C
-ATOM 1969 C THR B 65 7.777 43.007 22.138 1.00 45.54 C
-ATOM 1970 O THR B 65 6.618 43.045 21.723 1.00 46.02 O
-ATOM 1971 CB THR B 65 8.998 41.362 23.495 1.00 41.51 C
-ATOM 1972 OG1 THR B 65 8.414 40.413 22.593 1.00 42.56 O
-ATOM 1973 CG2 THR B 65 9.141 40.705 24.854 1.00 30.44 C
-ATOM 1974 H THR B 65 6.121 41.858 23.930 1.00 0.00 H
-ATOM 1975 HA THR B 65 8.672 43.442 24.013 1.00 0.00 H
-ATOM 1976 HB THR B 65 9.978 41.645 23.138 1.00 0.00 H
-ATOM 1977 HG1 THR B 65 8.025 40.887 21.855 1.00 0.00 H
-ATOM 1978 1HG2 THR B 65 9.774 39.824 24.762 1.00 0.00 H
-ATOM 1979 2HG2 THR B 65 9.585 41.401 25.562 1.00 0.00 H
-ATOM 1980 3HG2 THR B 65 8.158 40.405 25.207 1.00 0.00 H
-ATOM 1981 N ARG B 66 8.821 43.209 21.362 1.00 45.57 N
-ATOM 1982 CA ARG B 66 8.725 43.504 19.941 1.00 44.88 C
-ATOM 1983 C ARG B 66 7.992 42.418 19.155 1.00 42.37 C
-ATOM 1984 O ARG B 66 7.493 42.682 18.062 1.00 37.24 O
-ATOM 1985 CB ARG B 66 10.118 43.752 19.381 1.00 57.08 C
-ATOM 1986 CG ARG B 66 10.231 44.125 17.913 1.00 65.35 C
-ATOM 1987 CD ARG B 66 11.569 44.778 17.666 1.00 68.86 C
-ATOM 1988 NE ARG B 66 11.806 45.169 16.269 1.00 81.83 N
-ATOM 1989 CZ ARG B 66 12.627 44.524 15.407 1.00 82.73 C
-ATOM 1990 NH1 ARG B 66 13.310 43.484 15.807 1.00 80.14 N
-ATOM 1991 NH2 ARG B 66 12.774 44.970 14.167 1.00 83.95 N
-ATOM 1992 H ARG B 66 9.739 43.170 21.782 1.00 0.00 H
-ATOM 1993 HA ARG B 66 8.157 44.429 19.832 1.00 0.00 H
-ATOM 1994 1HB ARG B 66 10.619 44.525 19.963 1.00 0.00 H
-ATOM 1995 2HB ARG B 66 10.692 42.839 19.484 1.00 0.00 H
-ATOM 1996 1HG ARG B 66 10.168 43.219 17.307 1.00 0.00 H
-ATOM 1997 2HG ARG B 66 9.435 44.815 17.633 1.00 0.00 H
-ATOM 1998 1HD ARG B 66 11.635 45.676 18.281 1.00 0.00 H
-ATOM 1999 2HD ARG B 66 12.366 44.090 17.960 1.00 0.00 H
-ATOM 2000 HE ARG B 66 11.315 45.981 15.925 1.00 0.00 H
-ATOM 2001 1HH1 ARG B 66 13.224 43.162 16.762 1.00 0.00 H
-ATOM 2002 2HH1 ARG B 66 13.978 43.028 15.170 1.00 0.00 H
-ATOM 2003 1HH2 ARG B 66 12.263 45.783 13.859 1.00 0.00 H
-ATOM 2004 2HH2 ARG B 66 13.428 44.516 13.541 1.00 0.00 H
-ATOM 2005 N HIS B 67 7.943 41.189 19.689 1.00 42.79 N
-ATOM 2006 CA HIS B 67 7.315 40.107 18.951 1.00 45.84 C
-ATOM 2007 C HIS B 67 5.904 39.781 19.460 1.00 47.97 C
-ATOM 2008 O HIS B 67 5.327 38.763 19.068 1.00 49.04 O
-ATOM 2009 CB HIS B 67 8.176 38.849 19.032 1.00 38.96 C
-ATOM 2010 CG HIS B 67 9.552 39.070 18.525 1.00 38.65 C
-ATOM 2011 ND1 HIS B 67 9.824 39.838 17.412 1.00 38.30 N
-ATOM 2012 CD2 HIS B 67 10.738 38.605 18.958 1.00 37.02 C
-ATOM 2013 CE1 HIS B 67 11.125 39.855 17.212 1.00 40.31 C
-ATOM 2014 NE2 HIS B 67 11.690 39.107 18.130 1.00 38.64 N
-ATOM 2015 H HIS B 67 8.322 40.999 20.614 1.00 0.00 H
-ATOM 2016 HA HIS B 67 7.228 40.387 17.902 1.00 0.00 H
-ATOM 2017 1HB HIS B 67 8.236 38.511 20.072 1.00 0.00 H
-ATOM 2018 2HB HIS B 67 7.721 38.052 18.448 1.00 0.00 H
-ATOM 2019 HD2 HIS B 67 10.911 37.951 19.800 1.00 0.00 H
-ATOM 2020 HE1 HIS B 67 11.643 40.385 16.413 1.00 0.00 H
-ATOM 2021 HE2 HIS B 67 12.679 38.915 18.222 1.00 0.00 H
-ATOM 2022 N GLY B 68 5.341 40.629 20.332 1.00 48.01 N
-ATOM 2023 CA GLY B 68 4.003 40.359 20.854 1.00 48.18 C
-ATOM 2024 C GLY B 68 3.963 40.242 22.378 1.00 49.51 C
-ATOM 2025 O GLY B 68 4.746 40.866 23.094 1.00 49.53 O
-ATOM 2026 H GLY B 68 5.835 41.466 20.635 1.00 0.00 H
-ATOM 2027 1HA GLY B 68 3.335 41.165 20.543 1.00 0.00 H
-ATOM 2028 2HA GLY B 68 3.613 39.445 20.412 1.00 0.00 H
-ATOM 2029 N VAL B 69 2.991 39.482 22.875 1.00 49.56 N
-ATOM 2030 CA VAL B 69 2.800 39.349 24.319 1.00 49.87 C
-ATOM 2031 C VAL B 69 2.985 37.908 24.769 1.00 50.31 C
-ATOM 2032 O VAL B 69 2.501 36.976 24.121 1.00 48.49 O
-ATOM 2033 CB VAL B 69 1.410 39.854 24.731 1.00 48.13 C
-ATOM 2034 CG1 VAL B 69 1.211 39.673 26.228 1.00 52.98 C
-ATOM 2035 CG2 VAL B 69 1.281 41.319 24.352 1.00 45.45 C
-ATOM 2036 H VAL B 69 2.374 38.990 22.246 1.00 0.00 H
-ATOM 2037 HA VAL B 69 3.546 39.959 24.827 1.00 0.00 H
-ATOM 2038 HB VAL B 69 0.643 39.271 24.225 1.00 0.00 H
-ATOM 2039 1HG1 VAL B 69 0.225 40.028 26.489 1.00 0.00 H
-ATOM 2040 2HG1 VAL B 69 1.293 38.623 26.498 1.00 0.00 H
-ATOM 2041 3HG1 VAL B 69 1.967 40.247 26.771 1.00 0.00 H
-ATOM 2042 1HG2 VAL B 69 0.296 41.683 24.646 1.00 0.00 H
-ATOM 2043 2HG2 VAL B 69 2.047 41.885 24.863 1.00 0.00 H
-ATOM 2044 3HG2 VAL B 69 1.403 41.435 23.278 1.00 0.00 H
-ATOM 2045 N ILE B 70 3.721 37.735 25.861 1.00 49.16 N
-ATOM 2046 CA ILE B 70 4.000 36.413 26.398 1.00 48.44 C
-ATOM 2047 C ILE B 70 3.967 36.502 27.918 1.00 48.84 C
-ATOM 2048 O ILE B 70 4.285 37.545 28.486 1.00 47.75 O
-ATOM 2049 CB ILE B 70 5.390 35.922 25.926 1.00 36.30 C
-ATOM 2050 CG1 ILE B 70 5.580 34.442 26.218 1.00 37.71 C
-ATOM 2051 CG2 ILE B 70 6.479 36.713 26.632 1.00 48.43 C
-ATOM 2052 CD1 ILE B 70 6.764 33.871 25.490 1.00 36.58 C
-ATOM 2053 H ILE B 70 4.089 38.556 26.340 1.00 0.00 H
-ATOM 2054 HA ILE B 70 3.233 35.719 26.067 1.00 0.00 H
-ATOM 2055 HB ILE B 70 5.478 36.062 24.848 1.00 0.00 H
-ATOM 2056 1HG1 ILE B 70 5.721 34.284 27.289 1.00 0.00 H
-ATOM 2057 2HG1 ILE B 70 4.687 33.903 25.897 1.00 0.00 H
-ATOM 2058 1HG2 ILE B 70 7.453 36.381 26.305 1.00 0.00 H
-ATOM 2059 2HG2 ILE B 70 6.359 37.774 26.403 1.00 0.00 H
-ATOM 2060 3HG2 ILE B 70 6.387 36.551 27.705 1.00 0.00 H
-ATOM 2061 1HD1 ILE B 70 6.841 32.827 25.707 1.00 0.00 H
-ATOM 2062 2HD1 ILE B 70 6.639 34.007 24.416 1.00 0.00 H
-ATOM 2063 3HD1 ILE B 70 7.659 34.379 25.820 1.00 0.00 H
-ATOM 2064 N GLU B 71 3.556 35.438 28.582 1.00 46.28 N
-ATOM 2065 CA GLU B 71 3.589 35.465 30.035 1.00 45.11 C
-ATOM 2066 C GLU B 71 4.588 34.445 30.543 1.00 43.92 C
-ATOM 2067 O GLU B 71 4.709 33.355 29.979 1.00 42.85 O
-ATOM 2068 CB GLU B 71 2.202 35.188 30.627 1.00 55.17 C
-ATOM 2069 CG GLU B 71 1.153 36.243 30.290 1.00 61.70 C
-ATOM 2070 CD GLU B 71 -0.189 35.981 30.941 1.00 67.98 C
-ATOM 2071 OE1 GLU B 71 -0.326 34.983 31.604 1.00 58.93 O
-ATOM 2072 OE2 GLU B 71 -1.074 36.785 30.770 1.00 71.81 O
-ATOM 2073 H GLU B 71 3.262 34.610 28.087 1.00 0.00 H
-ATOM 2074 HA GLU B 71 3.918 36.448 30.371 1.00 0.00 H
-ATOM 2075 1HB GLU B 71 1.839 34.223 30.275 1.00 0.00 H
-ATOM 2076 2HB GLU B 71 2.279 35.132 31.716 1.00 0.00 H
-ATOM 2077 1HG GLU B 71 1.523 37.206 30.617 1.00 0.00 H
-ATOM 2078 2HG GLU B 71 1.023 36.283 29.210 1.00 0.00 H
-ATOM 2079 N SER B 72 5.276 34.799 31.622 1.00 42.77 N
-ATOM 2080 CA SER B 72 6.210 33.898 32.274 1.00 45.59 C
-ATOM 2081 C SER B 72 5.533 33.277 33.475 1.00 46.58 C
-ATOM 2082 O SER B 72 4.709 33.921 34.133 1.00 45.54 O
-ATOM 2083 CB SER B 72 7.454 34.663 32.667 1.00 40.36 C
-ATOM 2084 OG SER B 72 7.126 35.715 33.497 1.00 41.30 O
-ATOM 2085 H SER B 72 5.116 35.720 32.023 1.00 0.00 H
-ATOM 2086 HA SER B 72 6.482 33.099 31.583 1.00 0.00 H
-ATOM 2087 1HB SER B 72 8.160 33.998 33.168 1.00 0.00 H
-ATOM 2088 2HB SER B 72 7.934 35.048 31.787 1.00 0.00 H
-ATOM 2089 HG SER B 72 6.460 36.225 33.012 1.00 0.00 H
-ATOM 2090 N GLU B 73 5.878 32.022 33.748 1.00 48.58 N
-ATOM 2091 CA GLU B 73 5.311 31.255 34.851 1.00 52.70 C
-ATOM 2092 C GLU B 73 6.365 30.530 35.681 1.00 54.29 C
-ATOM 2093 O GLU B 73 6.040 29.611 36.432 1.00 54.46 O
-ATOM 2094 CB GLU B 73 4.302 30.242 34.296 1.00 52.94 C
-ATOM 2095 CG GLU B 73 3.073 30.873 33.605 1.00 53.03 C
-ATOM 2096 CD GLU B 73 2.109 29.856 33.028 1.00 58.58 C
-ATOM 2097 OE1 GLU B 73 0.989 29.809 33.471 1.00 69.91 O
-ATOM 2098 OE2 GLU B 73 2.482 29.168 32.093 1.00 65.29 O
-ATOM 2099 H GLU B 73 6.592 31.584 33.172 1.00 0.00 H
-ATOM 2100 HA GLU B 73 4.792 31.944 35.510 1.00 0.00 H
-ATOM 2101 1HB GLU B 73 4.802 29.601 33.571 1.00 0.00 H
-ATOM 2102 2HB GLU B 73 3.946 29.605 35.104 1.00 0.00 H
-ATOM 2103 1HG GLU B 73 2.543 31.496 34.327 1.00 0.00 H
-ATOM 2104 2HG GLU B 73 3.418 31.520 32.798 1.00 0.00 H
-ATOM 2105 N GLY B 74 7.627 30.899 35.513 1.00 56.06 N
-ATOM 2106 CA GLY B 74 8.711 30.183 36.181 1.00 60.26 C
-ATOM 2107 C GLY B 74 8.557 30.264 37.684 1.00 63.39 C
-ATOM 2108 O GLY B 74 8.090 31.272 38.207 1.00 64.27 O
-ATOM 2109 H GLY B 74 7.841 31.672 34.893 1.00 0.00 H
-ATOM 2110 1HA GLY B 74 8.711 29.142 35.864 1.00 0.00 H
-ATOM 2111 2HA GLY B 74 9.667 30.609 35.881 1.00 0.00 H
-ATOM 2112 N LYS B 75 8.963 29.208 38.379 1.00 66.55 N
-ATOM 2113 CA LYS B 75 8.843 29.167 39.832 1.00 70.43 C
-ATOM 2114 C LYS B 75 9.943 29.948 40.530 1.00 74.20 C
-ATOM 2115 O LYS B 75 11.092 29.932 40.086 1.00 75.05 O
-ATOM 2116 CB LYS B 75 8.899 27.721 40.329 1.00 66.09 C
-ATOM 2117 CG LYS B 75 7.737 26.843 39.896 1.00 69.42 C
-ATOM 2118 CD LYS B 75 7.873 25.436 40.477 1.00 15.00 C
-ATOM 2119 CE LYS B 75 6.731 24.531 40.047 1.00 15.00 C
-ATOM 2120 NZ LYS B 75 6.924 23.131 40.514 1.00 15.00 N
-ATOM 2121 H LYS B 75 9.341 28.409 37.888 1.00 0.00 H
-ATOM 2122 HA LYS B 75 7.887 29.606 40.115 1.00 0.00 H
-ATOM 2123 1HB LYS B 75 9.825 27.256 39.987 1.00 0.00 H
-ATOM 2124 2HB LYS B 75 8.923 27.721 41.419 1.00 0.00 H
-ATOM 2125 1HG LYS B 75 6.793 27.288 40.221 1.00 0.00 H
-ATOM 2126 2HG LYS B 75 7.728 26.777 38.807 1.00 0.00 H
-ATOM 2127 1HD LYS B 75 8.814 24.996 40.146 1.00 0.00 H
-ATOM 2128 2HD LYS B 75 7.885 25.498 41.568 1.00 0.00 H
-ATOM 2129 1HE LYS B 75 5.798 24.915 40.461 1.00 0.00 H
-ATOM 2130 2HE LYS B 75 6.665 24.535 38.960 1.00 0.00 H
-ATOM 2131 1HZ LYS B 75 6.145 22.562 40.206 1.00 0.00 H
-ATOM 2132 2HZ LYS B 75 7.785 22.766 40.123 1.00 0.00 H
-ATOM 2133 3HZ LYS B 75 6.978 23.114 41.524 1.00 0.00 H
-ATOM 2134 N LYS B 76 9.578 30.552 41.661 1.00 78.02 N
-ATOM 2135 CA LYS B 76 10.503 31.234 42.561 1.00 81.92 C
-ATOM 2136 C LYS B 76 11.447 32.185 41.835 1.00 85.15 C
-ATOM 2137 O LYS B 76 10.984 33.099 41.151 1.00 87.28 O
-ATOM 2138 OXT LYS B 76 12.611 32.261 42.231 1.00 98.40 O
-ATOM 2139 CB LYS B 76 11.285 30.196 43.367 1.00 77.13 C
-ATOM 2140 CG LYS B 76 10.405 29.399 44.341 1.00 83.33 C
-ATOM 2141 CD LYS B 76 11.199 28.377 45.144 1.00 85.83 C
-ATOM 2142 CE LYS B 76 10.279 27.588 46.081 1.00 80.64 C
-ATOM 2143 NZ LYS B 76 11.009 26.521 46.824 1.00 88.34 N
-ATOM 2144 H LYS B 76 8.601 30.526 41.915 1.00 0.00 H
-ATOM 2145 HA LYS B 76 9.912 31.829 43.260 1.00 0.00 H
-ATOM 2146 1HB LYS B 76 11.770 29.493 42.685 1.00 0.00 H
-ATOM 2147 2HB LYS B 76 12.070 30.690 43.940 1.00 0.00 H
-ATOM 2148 1HG LYS B 76 9.913 30.088 45.030 1.00 0.00 H
-ATOM 2149 2HG LYS B 76 9.635 28.871 43.779 1.00 0.00 H
-ATOM 2150 1HD LYS B 76 11.697 27.681 44.467 1.00 0.00 H
-ATOM 2151 2HD LYS B 76 11.960 28.889 45.738 1.00 0.00 H
-ATOM 2152 1HE LYS B 76 9.831 28.274 46.799 1.00 0.00 H
-ATOM 2153 2HE LYS B 76 9.487 27.127 45.490 1.00 0.00 H
-ATOM 2154 1HZ LYS B 76 10.363 26.026 47.425 1.00 0.00 H
-ATOM 2155 2HZ LYS B 76 11.417 25.873 46.164 1.00 0.00 H
-ATOM 2156 3HZ LYS B 76 11.739 26.935 47.384 1.00 0.00 H
-TER
-ATOM 2158 N SER C 7 19.259 45.532 17.068 1.00 58.42 N
-ATOM 2159 CA SER C 7 19.611 44.167 16.714 1.00 58.32 C
-ATOM 2160 C SER C 7 18.542 43.187 17.186 1.00 55.18 C
-ATOM 2161 O SER C 7 18.072 43.245 18.330 1.00 60.56 O
-ATOM 2162 CB SER C 7 20.956 43.797 17.294 1.00 60.56 C
-ATOM 2163 OG SER C 7 21.259 42.466 17.020 1.00 57.68 O
-ATOM 2164 1H SER C 7 19.941 46.166 16.680 1.00 0.00 H
-ATOM 2165 2H SER C 7 18.345 45.738 16.688 1.00 0.00 H
-ATOM 2166 3H SER C 7 19.237 45.627 18.071 1.00 0.00 H
-ATOM 2167 HA SER C 7 19.674 44.098 15.626 1.00 0.00 H
-ATOM 2168 1HB SER C 7 21.728 44.444 16.879 1.00 0.00 H
-ATOM 2169 2HB SER C 7 20.945 43.952 18.368 1.00 0.00 H
-ATOM 2170 HG SER C 7 20.539 41.948 17.405 1.00 0.00 H
-ATOM 2171 N ASP C 8 18.171 42.278 16.290 1.00 50.37 N
-ATOM 2172 CA ASP C 8 17.128 41.292 16.541 1.00 46.89 C
-ATOM 2173 C ASP C 8 17.414 40.356 17.704 1.00 43.99 C
-ATOM 2174 O ASP C 8 18.573 40.025 17.997 1.00 44.55 O
-ATOM 2175 CB ASP C 8 16.844 40.453 15.287 1.00 49.33 C
-ATOM 2176 CG ASP C 8 16.085 41.239 14.216 1.00 55.45 C
-ATOM 2177 OD1 ASP C 8 15.667 42.334 14.505 1.00 54.92 O
-ATOM 2178 OD2 ASP C 8 15.919 40.736 13.137 1.00 60.11 O
-ATOM 2179 H ASP C 8 18.618 42.280 15.381 1.00 0.00 H
-ATOM 2180 HA ASP C 8 16.211 41.837 16.783 1.00 0.00 H
-ATOM 2181 1HB ASP C 8 17.781 40.099 14.864 1.00 0.00 H
-ATOM 2182 2HB ASP C 8 16.256 39.573 15.566 1.00 0.00 H
-ATOM 2183 N PHE C 9 16.315 39.918 18.314 1.00 40.66 N
-ATOM 2184 CA PHE C 9 16.289 38.984 19.426 1.00 40.39 C
-ATOM 2185 C PHE C 9 15.130 38.033 19.280 1.00 41.37 C
-ATOM 2186 O PHE C 9 14.232 38.270 18.469 1.00 41.28 O
-ATOM 2187 CB PHE C 9 16.127 39.712 20.770 1.00 35.25 C
-ATOM 2188 CG PHE C 9 14.837 40.441 20.960 1.00 34.05 C
-ATOM 2189 CD1 PHE C 9 13.754 39.804 21.544 1.00 32.04 C
-ATOM 2190 CD2 PHE C 9 14.701 41.766 20.592 1.00 32.60 C
-ATOM 2191 CE1 PHE C 9 12.566 40.468 21.758 1.00 33.79 C
-ATOM 2192 CE2 PHE C 9 13.511 42.428 20.805 1.00 38.78 C
-ATOM 2193 CZ PHE C 9 12.448 41.776 21.392 1.00 39.23 C
-ATOM 2194 H PHE C 9 15.430 40.277 17.984 1.00 0.00 H
-ATOM 2195 HA PHE C 9 17.204 38.397 19.416 1.00 0.00 H
-ATOM 2196 1HB PHE C 9 16.189 38.995 21.569 1.00 0.00 H
-ATOM 2197 2HB PHE C 9 16.915 40.402 20.905 1.00 0.00 H
-ATOM 2198 HD1 PHE C 9 13.854 38.760 21.840 1.00 0.00 H
-ATOM 2199 HD2 PHE C 9 15.543 42.293 20.133 1.00 0.00 H
-ATOM 2200 HE1 PHE C 9 11.727 39.952 22.220 1.00 0.00 H
-ATOM 2201 HE2 PHE C 9 13.414 43.472 20.509 1.00 0.00 H
-ATOM 2202 HZ PHE C 9 11.526 42.300 21.558 1.00 0.00 H
-ATOM 2203 N VAL C 10 15.156 36.962 20.063 1.00 41.26 N
-ATOM 2204 CA VAL C 10 14.065 35.995 20.078 1.00 44.07 C
-ATOM 2205 C VAL C 10 13.551 35.831 21.506 1.00 45.18 C
-ATOM 2206 O VAL C 10 14.264 36.129 22.467 1.00 44.53 O
-ATOM 2207 CB VAL C 10 14.560 34.635 19.540 1.00 39.94 C
-ATOM 2208 CG1 VAL C 10 15.081 34.802 18.104 1.00 38.44 C
-ATOM 2209 CG2 VAL C 10 15.651 34.090 20.459 1.00 39.53 C
-ATOM 2210 H VAL C 10 15.965 36.834 20.667 1.00 0.00 H
-ATOM 2211 HA VAL C 10 13.252 36.357 19.448 1.00 0.00 H
-ATOM 2212 HB VAL C 10 13.722 33.931 19.512 1.00 0.00 H
-ATOM 2213 1HG1 VAL C 10 15.420 33.852 17.727 1.00 0.00 H
-ATOM 2214 2HG1 VAL C 10 14.283 35.184 17.469 1.00 0.00 H
-ATOM 2215 3HG1 VAL C 10 15.913 35.498 18.098 1.00 0.00 H
-ATOM 2216 1HG2 VAL C 10 15.995 33.124 20.087 1.00 0.00 H
-ATOM 2217 2HG2 VAL C 10 16.487 34.790 20.487 1.00 0.00 H
-ATOM 2218 3HG2 VAL C 10 15.247 33.967 21.467 1.00 0.00 H
-ATOM 2219 N VAL C 11 12.320 35.344 21.651 1.00 44.07 N
-ATOM 2220 CA VAL C 11 11.761 35.105 22.986 1.00 44.00 C
-ATOM 2221 C VAL C 11 11.477 33.625 23.158 1.00 46.00 C
-ATOM 2222 O VAL C 11 10.771 33.032 22.348 1.00 46.32 O
-ATOM 2223 CB VAL C 11 10.438 35.865 23.195 1.00 44.65 C
-ATOM 2224 CG1 VAL C 11 9.914 35.595 24.566 1.00 45.73 C
-ATOM 2225 CG2 VAL C 11 10.621 37.341 22.957 1.00 23.86 C
-ATOM 2226 H VAL C 11 11.773 35.130 20.820 1.00 0.00 H
-ATOM 2227 HA VAL C 11 12.480 35.416 23.741 1.00 0.00 H
-ATOM 2228 HB VAL C 11 9.714 35.481 22.522 1.00 0.00 H
-ATOM 2229 1HG1 VAL C 11 8.969 36.114 24.673 1.00 0.00 H
-ATOM 2230 2HG1 VAL C 11 9.765 34.525 24.693 1.00 0.00 H
-ATOM 2231 3HG1 VAL C 11 10.613 35.948 25.308 1.00 0.00 H
-ATOM 2232 1HG2 VAL C 11 9.664 37.849 23.096 1.00 0.00 H
-ATOM 2233 2HG2 VAL C 11 11.332 37.731 23.647 1.00 0.00 H
-ATOM 2234 3HG2 VAL C 11 10.970 37.503 21.953 1.00 0.00 H
-ATOM 2235 N ILE C 12 12.034 33.018 24.196 1.00 47.69 N
-ATOM 2236 CA ILE C 12 11.849 31.591 24.408 1.00 44.45 C
-ATOM 2237 C ILE C 12 11.233 31.272 25.774 1.00 43.61 C
-ATOM 2238 O ILE C 12 11.774 31.659 26.814 1.00 46.70 O
-ATOM 2239 CB ILE C 12 13.208 30.881 24.287 1.00 42.87 C
-ATOM 2240 CG1 ILE C 12 13.816 31.159 22.899 1.00 45.82 C
-ATOM 2241 CG2 ILE C 12 13.011 29.371 24.482 1.00 33.94 C
-ATOM 2242 CD1 ILE C 12 15.235 30.770 22.797 1.00 45.71 C
-ATOM 2243 H ILE C 12 12.618 33.550 24.829 1.00 0.00 H
-ATOM 2244 HA ILE C 12 11.186 31.205 23.639 1.00 0.00 H
-ATOM 2245 HB ILE C 12 13.897 31.268 25.039 1.00 0.00 H
-ATOM 2246 1HG1 ILE C 12 13.256 30.611 22.161 1.00 0.00 H
-ATOM 2247 2HG1 ILE C 12 13.749 32.218 22.669 1.00 0.00 H
-ATOM 2248 1HG2 ILE C 12 13.961 28.861 24.391 1.00 0.00 H
-ATOM 2249 2HG2 ILE C 12 12.591 29.183 25.470 1.00 0.00 H
-ATOM 2250 3HG2 ILE C 12 12.325 28.998 23.721 1.00 0.00 H
-ATOM 2251 1HD1 ILE C 12 15.604 30.980 21.793 1.00 0.00 H
-ATOM 2252 2HD1 ILE C 12 15.814 31.338 23.525 1.00 0.00 H
-ATOM 2253 3HD1 ILE C 12 15.322 29.724 23.008 1.00 0.00 H
-ATOM 2254 N LYS C 13 10.112 30.546 25.775 1.00 41.88 N
-ATOM 2255 CA LYS C 13 9.459 30.145 27.023 1.00 40.42 C
-ATOM 2256 C LYS C 13 9.479 28.652 27.250 1.00 41.46 C
-ATOM 2257 O LYS C 13 8.968 27.867 26.446 1.00 37.14 O
-ATOM 2258 CB LYS C 13 8.012 30.587 27.085 1.00 45.43 C
-ATOM 2259 CG LYS C 13 7.309 30.116 28.355 1.00 46.77 C
-ATOM 2260 CD LYS C 13 5.854 30.503 28.385 1.00 49.39 C
-ATOM 2261 CE LYS C 13 5.182 29.924 29.634 1.00 44.39 C
-ATOM 2262 NZ LYS C 13 3.726 30.192 29.668 1.00 43.47 N
-ATOM 2263 H LYS C 13 9.700 30.278 24.886 1.00 0.00 H
-ATOM 2264 HA LYS C 13 9.994 30.604 27.851 1.00 0.00 H
-ATOM 2265 1HB LYS C 13 7.982 31.655 27.083 1.00 0.00 H
-ATOM 2266 2HB LYS C 13 7.474 30.231 26.225 1.00 0.00 H
-ATOM 2267 1HG LYS C 13 7.365 29.029 28.411 1.00 0.00 H
-ATOM 2268 2HG LYS C 13 7.815 30.528 29.233 1.00 0.00 H
-ATOM 2269 1HD LYS C 13 5.764 31.592 28.399 1.00 0.00 H
-ATOM 2270 2HD LYS C 13 5.355 30.121 27.496 1.00 0.00 H
-ATOM 2271 1HE LYS C 13 5.347 28.847 29.658 1.00 0.00 H
-ATOM 2272 2HE LYS C 13 5.636 30.374 30.519 1.00 0.00 H
-ATOM 2273 1HZ LYS C 13 3.314 29.790 30.522 1.00 0.00 H
-ATOM 2274 2HZ LYS C 13 3.578 31.198 29.667 1.00 0.00 H
-ATOM 2275 3HZ LYS C 13 3.281 29.780 28.867 1.00 0.00 H
-ATOM 2276 N ALA C 14 10.071 28.239 28.353 1.00 43.40 N
-ATOM 2277 CA ALA C 14 10.139 26.816 28.620 1.00 45.94 C
-ATOM 2278 C ALA C 14 8.752 26.242 28.836 1.00 46.78 C
-ATOM 2279 O ALA C 14 7.996 26.734 29.683 1.00 43.40 O
-ATOM 2280 CB ALA C 14 10.985 26.561 29.838 1.00 45.78 C
-ATOM 2281 H ALA C 14 10.461 28.920 29.010 1.00 0.00 H
-ATOM 2282 HA ALA C 14 10.577 26.331 27.750 1.00 0.00 H
-ATOM 2283 1HB ALA C 14 11.049 25.492 30.042 1.00 0.00 H
-ATOM 2284 2HB ALA C 14 11.967 26.952 29.680 1.00 0.00 H
-ATOM 2285 3HB ALA C 14 10.524 27.064 30.667 1.00 0.00 H
-ATOM 2286 N LEU C 15 8.424 25.156 28.149 1.00 49.40 N
-ATOM 2287 CA LEU C 15 7.130 24.527 28.376 1.00 50.58 C
-ATOM 2288 C LEU C 15 7.289 23.277 29.240 1.00 51.75 C
-ATOM 2289 O LEU C 15 6.308 22.639 29.632 1.00 53.80 O
-ATOM 2290 CB LEU C 15 6.453 24.254 27.036 1.00 40.08 C
-ATOM 2291 CG LEU C 15 6.162 25.545 26.204 1.00 51.27 C
-ATOM 2292 CD1 LEU C 15 5.587 25.166 24.855 1.00 38.99 C
-ATOM 2293 CD2 LEU C 15 5.223 26.446 26.968 1.00 37.44 C
-ATOM 2294 H LEU C 15 9.053 24.763 27.445 1.00 0.00 H
-ATOM 2295 HA LEU C 15 6.497 25.225 28.920 1.00 0.00 H
-ATOM 2296 1HB LEU C 15 7.104 23.614 26.451 1.00 0.00 H
-ATOM 2297 2HB LEU C 15 5.513 23.737 27.212 1.00 0.00 H
-ATOM 2298 HG LEU C 15 7.068 26.082 26.051 1.00 0.00 H
-ATOM 2299 1HD1 LEU C 15 5.394 26.056 24.272 1.00 0.00 H
-ATOM 2300 2HD1 LEU C 15 6.293 24.547 24.321 1.00 0.00 H
-ATOM 2301 3HD1 LEU C 15 4.656 24.626 24.997 1.00 0.00 H
-ATOM 2302 1HD2 LEU C 15 5.039 27.353 26.390 1.00 0.00 H
-ATOM 2303 2HD2 LEU C 15 4.280 25.929 27.144 1.00 0.00 H
-ATOM 2304 3HD2 LEU C 15 5.677 26.713 27.924 1.00 0.00 H
-ATOM 2305 N GLU C 16 8.540 22.967 29.565 1.00 51.59 N
-ATOM 2306 CA GLU C 16 8.898 21.830 30.407 1.00 53.98 C
-ATOM 2307 C GLU C 16 10.202 22.109 31.150 1.00 56.05 C
-ATOM 2308 O GLU C 16 10.943 23.021 30.802 1.00 56.98 O
-ATOM 2309 CB GLU C 16 8.998 20.528 29.591 1.00 54.23 C
-ATOM 2310 CG GLU C 16 10.069 20.482 28.494 1.00 57.42 C
-ATOM 2311 CD GLU C 16 10.044 19.152 27.734 1.00 61.17 C
-ATOM 2312 OE1 GLU C 16 9.299 18.282 28.118 1.00 56.39 O
-ATOM 2313 OE2 GLU C 16 10.736 19.031 26.744 1.00 65.66 O
-ATOM 2314 H GLU C 16 9.278 23.550 29.199 1.00 0.00 H
-ATOM 2315 HA GLU C 16 8.115 21.694 31.152 1.00 0.00 H
-ATOM 2316 1HB GLU C 16 9.197 19.698 30.268 1.00 0.00 H
-ATOM 2317 2HB GLU C 16 8.040 20.333 29.111 1.00 0.00 H
-ATOM 2318 1HG GLU C 16 9.919 21.307 27.802 1.00 0.00 H
-ATOM 2319 2HG GLU C 16 11.050 20.606 28.956 1.00 0.00 H
-ATOM 2320 N ASP C 17 10.465 21.361 32.211 1.00 55.42 N
-ATOM 2321 CA ASP C 17 11.727 21.527 32.929 1.00 54.19 C
-ATOM 2322 C ASP C 17 12.919 21.135 32.061 1.00 53.08 C
-ATOM 2323 O ASP C 17 12.822 20.205 31.261 1.00 49.84 O
-ATOM 2324 CB ASP C 17 11.718 20.737 34.232 1.00 52.70 C
-ATOM 2325 CG ASP C 17 10.800 21.367 35.263 1.00 60.97 C
-ATOM 2326 OD1 ASP C 17 10.368 22.485 35.039 1.00 55.20 O
-ATOM 2327 OD2 ASP C 17 10.529 20.741 36.260 1.00 66.77 O
-ATOM 2328 H ASP C 17 9.815 20.641 32.490 1.00 0.00 H
-ATOM 2329 HA ASP C 17 11.835 22.568 33.185 1.00 0.00 H
-ATOM 2330 1HB ASP C 17 11.401 19.712 34.044 1.00 0.00 H
-ATOM 2331 2HB ASP C 17 12.731 20.703 34.642 1.00 0.00 H
-ATOM 2332 N GLY C 18 14.054 21.815 32.241 1.00 53.62 N
-ATOM 2333 CA GLY C 18 15.269 21.448 31.516 1.00 53.84 C
-ATOM 2334 C GLY C 18 15.411 21.967 30.073 1.00 53.51 C
-ATOM 2335 O GLY C 18 16.230 21.437 29.319 1.00 54.32 O
-ATOM 2336 H GLY C 18 14.101 22.576 32.929 1.00 0.00 H
-ATOM 2337 1HA GLY C 18 16.122 21.799 32.091 1.00 0.00 H
-ATOM 2338 2HA GLY C 18 15.343 20.362 31.504 1.00 0.00 H
-ATOM 2339 N VAL C 19 14.629 22.965 29.667 1.00 52.20 N
-ATOM 2340 CA VAL C 19 14.757 23.491 28.305 1.00 51.18 C
-ATOM 2341 C VAL C 19 16.129 24.112 28.156 1.00 51.08 C
-ATOM 2342 O VAL C 19 16.596 24.831 29.037 1.00 49.12 O
-ATOM 2343 CB VAL C 19 13.632 24.483 27.982 1.00 45.05 C
-ATOM 2344 CG1 VAL C 19 13.884 25.204 26.652 1.00 37.47 C
-ATOM 2345 CG2 VAL C 19 12.342 23.699 27.880 1.00 36.58 C
-ATOM 2346 H VAL C 19 13.978 23.405 30.314 1.00 0.00 H
-ATOM 2347 HA VAL C 19 14.677 22.662 27.600 1.00 0.00 H
-ATOM 2348 HB VAL C 19 13.565 25.208 28.768 1.00 0.00 H
-ATOM 2349 1HG1 VAL C 19 13.069 25.892 26.460 1.00 0.00 H
-ATOM 2350 2HG1 VAL C 19 14.818 25.761 26.707 1.00 0.00 H
-ATOM 2351 3HG1 VAL C 19 13.943 24.467 25.844 1.00 0.00 H
-ATOM 2352 1HG2 VAL C 19 11.527 24.356 27.672 1.00 0.00 H
-ATOM 2353 2HG2 VAL C 19 12.425 22.972 27.079 1.00 0.00 H
-ATOM 2354 3HG2 VAL C 19 12.161 23.183 28.805 1.00 0.00 H
-ATOM 2355 N ASN C 20 16.810 23.780 27.077 1.00 49.74 N
-ATOM 2356 CA ASN C 20 18.176 24.222 26.896 1.00 47.75 C
-ATOM 2357 C ASN C 20 18.359 25.140 25.689 1.00 47.21 C
-ATOM 2358 O ASN C 20 18.184 24.718 24.542 1.00 46.84 O
-ATOM 2359 CB ASN C 20 19.072 23.005 26.832 1.00 57.79 C
-ATOM 2360 CG ASN C 20 20.503 23.333 26.846 1.00 69.03 C
-ATOM 2361 OD1 ASN C 20 20.954 24.369 26.352 1.00 79.05 O
-ATOM 2362 ND2 ASN C 20 21.274 22.463 27.439 1.00 62.37 N
-ATOM 2363 H ASN C 20 16.373 23.202 26.370 1.00 0.00 H
-ATOM 2364 HA ASN C 20 18.466 24.803 27.772 1.00 0.00 H
-ATOM 2365 1HB ASN C 20 18.855 22.357 27.687 1.00 0.00 H
-ATOM 2366 2HB ASN C 20 18.852 22.438 25.936 1.00 0.00 H
-ATOM 2367 1HD2 ASN C 20 22.262 22.633 27.503 1.00 0.00 H
-ATOM 2368 2HD2 ASN C 20 20.879 21.637 27.846 1.00 0.00 H
-ATOM 2369 N VAL C 21 18.653 26.416 25.952 1.00 45.31 N
-ATOM 2370 CA VAL C 21 18.850 27.358 24.857 1.00 44.09 C
-ATOM 2371 C VAL C 21 20.348 27.541 24.651 1.00 44.51 C
-ATOM 2372 O VAL C 21 21.082 27.921 25.564 1.00 44.39 O
-ATOM 2373 CB VAL C 21 18.188 28.703 25.137 1.00 37.50 C
-ATOM 2374 CG1 VAL C 21 18.450 29.628 23.962 1.00 33.43 C
-ATOM 2375 CG2 VAL C 21 16.709 28.482 25.373 1.00 37.61 C
-ATOM 2376 H VAL C 21 18.768 26.719 26.918 1.00 0.00 H
-ATOM 2377 HA VAL C 21 18.424 26.947 23.944 1.00 0.00 H
-ATOM 2378 HB VAL C 21 18.633 29.158 26.017 1.00 0.00 H
-ATOM 2379 1HG1 VAL C 21 17.999 30.594 24.142 1.00 0.00 H
-ATOM 2380 2HG1 VAL C 21 19.526 29.753 23.832 1.00 0.00 H
-ATOM 2381 3HG1 VAL C 21 18.028 29.191 23.060 1.00 0.00 H
-ATOM 2382 1HG2 VAL C 21 16.227 29.434 25.568 1.00 0.00 H
-ATOM 2383 2HG2 VAL C 21 16.271 28.023 24.493 1.00 0.00 H
-ATOM 2384 3HG2 VAL C 21 16.577 27.821 26.232 1.00 0.00 H
-ATOM 2385 N ILE C 22 20.801 27.221 23.452 1.00 44.34 N
-ATOM 2386 CA ILE C 22 22.215 27.152 23.158 1.00 44.61 C
-ATOM 2387 C ILE C 22 22.704 28.257 22.230 1.00 46.86 C
-ATOM 2388 O ILE C 22 22.153 28.475 21.149 1.00 48.54 O
-ATOM 2389 CB ILE C 22 22.494 25.792 22.510 1.00 49.06 C
-ATOM 2390 CG1 ILE C 22 22.065 24.671 23.456 1.00 42.22 C
-ATOM 2391 CG2 ILE C 22 23.961 25.672 22.196 1.00 33.83 C
-ATOM 2392 CD1 ILE C 22 21.992 23.311 22.809 1.00 42.92 C
-ATOM 2393 H ILE C 22 20.144 26.955 22.735 1.00 0.00 H
-ATOM 2394 HA ILE C 22 22.758 27.218 24.091 1.00 0.00 H
-ATOM 2395 HB ILE C 22 21.917 25.700 21.626 1.00 0.00 H
-ATOM 2396 1HG1 ILE C 22 22.769 24.625 24.285 1.00 0.00 H
-ATOM 2397 2HG1 ILE C 22 21.076 24.901 23.848 1.00 0.00 H
-ATOM 2398 1HG2 ILE C 22 24.160 24.706 21.740 1.00 0.00 H
-ATOM 2399 2HG2 ILE C 22 24.261 26.461 21.515 1.00 0.00 H
-ATOM 2400 3HG2 ILE C 22 24.515 25.765 23.132 1.00 0.00 H
-ATOM 2401 1HD1 ILE C 22 21.676 22.579 23.554 1.00 0.00 H
-ATOM 2402 2HD1 ILE C 22 21.266 23.336 21.991 1.00 0.00 H
-ATOM 2403 3HD1 ILE C 22 22.970 23.036 22.420 1.00 0.00 H
-ATOM 2404 N GLY C 23 23.746 28.967 22.660 1.00 45.85 N
-ATOM 2405 CA GLY C 23 24.352 30.000 21.830 1.00 43.18 C
-ATOM 2406 C GLY C 23 25.481 29.381 21.012 1.00 44.02 C
-ATOM 2407 O GLY C 23 26.375 28.731 21.575 1.00 43.17 O
-ATOM 2408 H GLY C 23 24.147 28.744 23.565 1.00 0.00 H
-ATOM 2409 1HA GLY C 23 23.607 30.438 21.165 1.00 0.00 H
-ATOM 2410 2HA GLY C 23 24.747 30.799 22.458 1.00 0.00 H
-ATOM 2411 N LEU C 24 25.449 29.625 19.694 1.00 41.08 N
-ATOM 2412 CA LEU C 24 26.441 29.123 18.733 1.00 36.52 C
-ATOM 2413 C LEU C 24 27.343 30.256 18.250 1.00 33.76 C
-ATOM 2414 O LEU C 24 26.850 31.324 17.846 1.00 30.27 O
-ATOM 2415 CB LEU C 24 25.736 28.498 17.527 1.00 33.51 C
-ATOM 2416 CG LEU C 24 25.083 27.107 17.724 1.00 40.65 C
-ATOM 2417 CD1 LEU C 24 23.804 27.252 18.541 1.00 45.92 C
-ATOM 2418 CD2 LEU C 24 24.766 26.494 16.358 1.00 32.06 C
-ATOM 2419 H LEU C 24 24.666 30.158 19.322 1.00 0.00 H
-ATOM 2420 HA LEU C 24 27.057 28.373 19.218 1.00 0.00 H
-ATOM 2421 1HB LEU C 24 24.959 29.170 17.247 1.00 0.00 H
-ATOM 2422 2HB LEU C 24 26.445 28.427 16.709 1.00 0.00 H
-ATOM 2423 HG LEU C 24 25.769 26.457 18.270 1.00 0.00 H
-ATOM 2424 1HD1 LEU C 24 23.362 26.274 18.680 1.00 0.00 H
-ATOM 2425 2HD1 LEU C 24 24.023 27.677 19.498 1.00 0.00 H
-ATOM 2426 3HD1 LEU C 24 23.102 27.898 18.014 1.00 0.00 H
-ATOM 2427 1HD2 LEU C 24 24.310 25.511 16.493 1.00 0.00 H
-ATOM 2428 2HD2 LEU C 24 24.078 27.136 15.820 1.00 0.00 H
-ATOM 2429 3HD2 LEU C 24 25.685 26.384 15.784 1.00 0.00 H
-ATOM 2430 N THR C 25 28.660 30.012 18.277 1.00 33.60 N
-ATOM 2431 CA THR C 25 29.634 31.064 17.987 1.00 33.73 C
-ATOM 2432 C THR C 25 29.601 31.634 16.588 1.00 35.96 C
-ATOM 2433 O THR C 25 29.377 30.926 15.604 1.00 35.72 O
-ATOM 2434 CB THR C 25 31.090 30.589 18.219 1.00 35.52 C
-ATOM 2435 OG1 THR C 25 31.387 29.452 17.390 1.00 36.91 O
-ATOM 2436 CG2 THR C 25 31.310 30.229 19.651 1.00 29.55 C
-ATOM 2437 H THR C 25 28.985 29.100 18.589 1.00 0.00 H
-ATOM 2438 HA THR C 25 29.438 31.869 18.680 1.00 0.00 H
-ATOM 2439 HB THR C 25 31.778 31.395 17.962 1.00 0.00 H
-ATOM 2440 HG1 THR C 25 31.829 29.733 16.554 1.00 0.00 H
-ATOM 2441 1HG2 THR C 25 32.341 29.908 19.783 1.00 0.00 H
-ATOM 2442 2HG2 THR C 25 31.115 31.102 20.270 1.00 0.00 H
-ATOM 2443 3HG2 THR C 25 30.645 29.433 19.937 1.00 0.00 H
-ATOM 2444 N ARG C 26 29.898 32.933 16.539 1.00 35.96 N
-ATOM 2445 CA ARG C 26 30.060 33.697 15.310 1.00 37.53 C
-ATOM 2446 C ARG C 26 31.513 33.681 14.846 1.00 39.57 C
-ATOM 2447 O ARG C 26 32.422 33.976 15.622 1.00 44.76 O
-ATOM 2448 CB ARG C 26 29.646 35.149 15.522 1.00 38.26 C
-ATOM 2449 CG ARG C 26 29.684 36.016 14.267 1.00 33.28 C
-ATOM 2450 CD ARG C 26 29.381 37.444 14.563 1.00 25.91 C
-ATOM 2451 NE ARG C 26 28.059 37.634 15.134 1.00 40.72 N
-ATOM 2452 CZ ARG C 26 26.923 37.759 14.430 1.00 37.03 C
-ATOM 2453 NH1 ARG C 26 26.949 37.717 13.115 1.00 39.54 N
-ATOM 2454 NH2 ARG C 26 25.799 37.931 15.082 1.00 30.21 N
-ATOM 2455 H ARG C 26 30.000 33.413 17.429 1.00 0.00 H
-ATOM 2456 HA ARG C 26 29.441 33.249 14.534 1.00 0.00 H
-ATOM 2457 1HB ARG C 26 28.634 35.186 15.919 1.00 0.00 H
-ATOM 2458 2HB ARG C 26 30.296 35.611 16.264 1.00 0.00 H
-ATOM 2459 1HG ARG C 26 30.683 35.973 13.838 1.00 0.00 H
-ATOM 2460 2HG ARG C 26 28.963 35.652 13.540 1.00 0.00 H
-ATOM 2461 1HD ARG C 26 30.113 37.832 15.260 1.00 0.00 H
-ATOM 2462 2HD ARG C 26 29.432 38.013 13.639 1.00 0.00 H
-ATOM 2463 HE ARG C 26 27.974 37.686 16.159 1.00 0.00 H
-ATOM 2464 1HH1 ARG C 26 27.827 37.594 12.641 1.00 0.00 H
-ATOM 2465 2HH1 ARG C 26 26.095 37.829 12.583 1.00 0.00 H
-ATOM 2466 1HH2 ARG C 26 25.828 37.973 16.107 1.00 0.00 H
-ATOM 2467 2HH2 ARG C 26 24.909 38.015 14.591 1.00 0.00 H
-ATOM 2468 N GLY C 27 31.734 33.352 13.576 1.00 39.14 N
-ATOM 2469 CA GLY C 27 33.082 33.346 13.016 1.00 37.80 C
-ATOM 2470 C GLY C 27 33.336 32.102 12.179 1.00 38.05 C
-ATOM 2471 O GLY C 27 32.410 31.365 11.847 1.00 34.46 O
-ATOM 2472 H GLY C 27 30.953 33.099 12.988 1.00 0.00 H
-ATOM 2473 1HA GLY C 27 33.215 34.233 12.397 1.00 0.00 H
-ATOM 2474 2HA GLY C 27 33.819 33.407 13.817 1.00 0.00 H
-ATOM 2475 N ALA C 28 34.602 31.876 11.830 1.00 39.91 N
-ATOM 2476 CA ALA C 28 34.989 30.733 11.000 1.00 43.70 C
-ATOM 2477 C ALA C 28 34.615 29.405 11.661 1.00 42.78 C
-ATOM 2478 O ALA C 28 34.247 28.445 10.984 1.00 45.98 O
-ATOM 2479 CB ALA C 28 36.485 30.777 10.733 1.00 40.95 C
-ATOM 2480 H ALA C 28 35.314 32.520 12.138 1.00 0.00 H
-ATOM 2481 HA ALA C 28 34.451 30.802 10.054 1.00 0.00 H
-ATOM 2482 1HB ALA C 28 36.770 29.942 10.095 1.00 0.00 H
-ATOM 2483 2HB ALA C 28 36.737 31.715 10.239 1.00 0.00 H
-ATOM 2484 3HB ALA C 28 37.026 30.707 11.678 1.00 0.00 H
-ATOM 2485 N ASP C 29 34.730 29.359 12.989 1.00 40.96 N
-ATOM 2486 CA ASP C 29 34.415 28.170 13.769 1.00 40.21 C
-ATOM 2487 C ASP C 29 33.057 28.274 14.455 1.00 35.80 C
-ATOM 2488 O ASP C 29 32.811 29.246 15.180 1.00 32.16 O
-ATOM 2489 CB ASP C 29 35.438 27.930 14.873 1.00 46.80 C
-ATOM 2490 CG ASP C 29 36.850 27.548 14.414 1.00 45.40 C
-ATOM 2491 OD1 ASP C 29 37.036 27.226 13.268 1.00 45.38 O
-ATOM 2492 OD2 ASP C 29 37.724 27.516 15.270 1.00 48.31 O
-ATOM 2493 H ASP C 29 35.036 30.191 13.468 1.00 0.00 H
-ATOM 2494 HA ASP C 29 34.399 27.309 13.100 1.00 0.00 H
-ATOM 2495 1HB ASP C 29 35.515 28.832 15.479 1.00 0.00 H
-ATOM 2496 2HB ASP C 29 35.055 27.145 15.517 1.00 0.00 H
-ATOM 2497 N THR C 30 32.201 27.265 14.271 1.00 38.68 N
-ATOM 2498 CA THR C 30 30.913 27.259 14.964 1.00 42.44 C
-ATOM 2499 C THR C 30 30.866 26.177 16.050 1.00 44.49 C
-ATOM 2500 O THR C 30 30.855 24.982 15.754 1.00 43.64 O
-ATOM 2501 CB THR C 30 29.736 27.043 13.995 1.00 36.73 C
-ATOM 2502 OG1 THR C 30 29.707 28.101 13.029 1.00 39.68 O
-ATOM 2503 CG2 THR C 30 28.430 27.059 14.778 1.00 40.11 C
-ATOM 2504 H THR C 30 32.447 26.506 13.653 1.00 0.00 H
-ATOM 2505 HA THR C 30 30.765 28.226 15.435 1.00 0.00 H
-ATOM 2506 HB THR C 30 29.850 26.088 13.488 1.00 0.00 H
-ATOM 2507 HG1 THR C 30 29.687 28.953 13.488 1.00 0.00 H
-ATOM 2508 1HG2 THR C 30 27.596 26.906 14.094 1.00 0.00 H
-ATOM 2509 2HG2 THR C 30 28.438 26.260 15.523 1.00 0.00 H
-ATOM 2510 3HG2 THR C 30 28.327 28.022 15.276 1.00 0.00 H
-ATOM 2511 N ARG C 31 30.830 26.622 17.300 1.00 46.21 N
-ATOM 2512 CA ARG C 31 30.791 25.768 18.486 1.00 47.76 C
-ATOM 2513 C ARG C 31 29.744 26.301 19.447 1.00 46.87 C
-ATOM 2514 O ARG C 31 29.418 27.485 19.415 1.00 44.89 O
-ATOM 2515 CB ARG C 31 32.146 25.722 19.195 1.00 47.87 C
-ATOM 2516 CG ARG C 31 33.265 24.933 18.471 1.00 47.53 C
-ATOM 2517 CD ARG C 31 34.561 24.943 19.257 1.00 51.74 C
-ATOM 2518 NE ARG C 31 35.221 26.247 19.218 1.00 59.73 N
-ATOM 2519 CZ ARG C 31 36.143 26.610 18.284 1.00 58.17 C
-ATOM 2520 NH1 ARG C 31 36.529 25.772 17.361 1.00 46.59 N
-ATOM 2521 NH2 ARG C 31 36.680 27.812 18.266 1.00 58.77 N
-ATOM 2522 H ARG C 31 30.868 27.627 17.435 1.00 0.00 H
-ATOM 2523 HA ARG C 31 30.515 24.757 18.190 1.00 0.00 H
-ATOM 2524 1HB ARG C 31 32.500 26.742 19.349 1.00 0.00 H
-ATOM 2525 2HB ARG C 31 32.016 25.276 20.186 1.00 0.00 H
-ATOM 2526 1HG ARG C 31 32.947 23.896 18.350 1.00 0.00 H
-ATOM 2527 2HG ARG C 31 33.450 25.370 17.488 1.00 0.00 H
-ATOM 2528 1HD ARG C 31 34.351 24.702 20.300 1.00 0.00 H
-ATOM 2529 2HD ARG C 31 35.249 24.200 18.847 1.00 0.00 H
-ATOM 2530 HE ARG C 31 34.951 26.933 19.912 1.00 0.00 H
-ATOM 2531 1HH1 ARG C 31 36.154 24.838 17.320 1.00 0.00 H
-ATOM 2532 2HH1 ARG C 31 37.229 26.093 16.675 1.00 0.00 H
-ATOM 2533 1HH2 ARG C 31 36.420 28.507 18.949 1.00 0.00 H
-ATOM 2534 2HH2 ARG C 31 37.351 28.022 17.511 1.00 0.00 H
-ATOM 2535 N PHE C 32 29.174 25.463 20.298 1.00 47.97 N
-ATOM 2536 CA PHE C 32 28.309 26.092 21.279 1.00 50.33 C
-ATOM 2537 C PHE C 32 29.246 26.860 22.205 1.00 50.37 C
-ATOM 2538 O PHE C 32 30.378 26.427 22.417 1.00 50.01 O
-ATOM 2539 CB PHE C 32 27.495 25.087 22.088 1.00 51.52 C
-ATOM 2540 CG PHE C 32 28.212 24.459 23.242 1.00 69.45 C
-ATOM 2541 CD1 PHE C 32 28.952 23.298 23.102 1.00 76.19 C
-ATOM 2542 CD2 PHE C 32 28.110 25.038 24.501 1.00 73.87 C
-ATOM 2543 CE1 PHE C 32 29.589 22.737 24.204 1.00 73.46 C
-ATOM 2544 CE2 PHE C 32 28.735 24.488 25.594 1.00 73.29 C
-ATOM 2545 CZ PHE C 32 29.481 23.333 25.446 1.00 79.03 C
-ATOM 2546 H PHE C 32 29.375 24.474 20.310 1.00 0.00 H
-ATOM 2547 HA PHE C 32 27.633 26.784 20.789 1.00 0.00 H
-ATOM 2548 1HB PHE C 32 26.652 25.610 22.492 1.00 0.00 H
-ATOM 2549 2HB PHE C 32 27.115 24.299 21.441 1.00 0.00 H
-ATOM 2550 HD1 PHE C 32 29.036 22.828 22.124 1.00 0.00 H
-ATOM 2551 HD2 PHE C 32 27.518 25.946 24.616 1.00 0.00 H
-ATOM 2552 HE1 PHE C 32 30.175 21.824 24.091 1.00 0.00 H
-ATOM 2553 HE2 PHE C 32 28.644 24.961 26.571 1.00 0.00 H
-ATOM 2554 HZ PHE C 32 29.977 22.894 26.311 1.00 0.00 H
-ATOM 2555 N HIS C 33 28.785 27.958 22.788 1.00 49.14 N
-ATOM 2556 CA HIS C 33 29.631 28.625 23.770 1.00 50.52 C
-ATOM 2557 C HIS C 33 28.862 28.858 25.055 1.00 51.24 C
-ATOM 2558 O HIS C 33 29.445 29.129 26.104 1.00 51.41 O
-ATOM 2559 CB HIS C 33 30.159 29.949 23.227 1.00 45.27 C
-ATOM 2560 CG HIS C 33 29.114 30.986 23.016 1.00 48.42 C
-ATOM 2561 ND1 HIS C 33 28.647 31.765 24.045 1.00 47.87 N
-ATOM 2562 CD2 HIS C 33 28.432 31.379 21.914 1.00 44.91 C
-ATOM 2563 CE1 HIS C 33 27.736 32.590 23.593 1.00 45.75 C
-ATOM 2564 NE2 HIS C 33 27.585 32.380 22.306 1.00 50.88 N
-ATOM 2565 H HIS C 33 27.868 28.308 22.544 1.00 0.00 H
-ATOM 2566 HA HIS C 33 30.485 27.996 24.012 1.00 0.00 H
-ATOM 2567 1HB HIS C 33 30.898 30.353 23.921 1.00 0.00 H
-ATOM 2568 2HB HIS C 33 30.662 29.766 22.296 1.00 0.00 H
-ATOM 2569 HD2 HIS C 33 28.535 30.982 20.911 1.00 0.00 H
-ATOM 2570 HE1 HIS C 33 27.197 33.329 24.188 1.00 0.00 H
-ATOM 2571 HE2 HIS C 33 26.945 32.888 21.719 1.00 0.00 H
-ATOM 2572 N HIS C 34 27.547 28.693 24.979 1.00 51.73 N
-ATOM 2573 CA HIS C 34 26.702 28.905 26.151 1.00 50.64 C
-ATOM 2574 C HIS C 34 25.438 28.083 26.089 1.00 53.40 C
-ATOM 2575 O HIS C 34 24.832 27.919 25.033 1.00 52.74 O
-ATOM 2576 CB HIS C 34 26.332 30.378 26.347 1.00 33.20 C
-ATOM 2577 CG HIS C 34 25.543 30.611 27.616 1.00 47.01 C
-ATOM 2578 ND1 HIS C 34 26.113 30.534 28.869 1.00 55.75 N
-ATOM 2579 CD2 HIS C 34 24.233 30.911 27.816 1.00 52.35 C
-ATOM 2580 CE1 HIS C 34 25.188 30.775 29.788 1.00 51.37 C
-ATOM 2581 NE2 HIS C 34 24.041 31.006 29.175 1.00 55.35 N
-ATOM 2582 H HIS C 34 27.137 28.483 24.072 1.00 0.00 H
-ATOM 2583 HA HIS C 34 27.243 28.587 27.041 1.00 0.00 H
-ATOM 2584 1HB HIS C 34 27.242 30.977 26.403 1.00 0.00 H
-ATOM 2585 2HB HIS C 34 25.752 30.733 25.497 1.00 0.00 H
-ATOM 2586 HD2 HIS C 34 23.473 31.043 27.047 1.00 0.00 H
-ATOM 2587 HE1 HIS C 34 25.347 30.781 30.865 1.00 0.00 H
-ATOM 2588 HE2 HIS C 34 23.144 31.216 29.642 1.00 0.00 H
-ATOM 2589 N SER C 35 25.038 27.569 27.240 1.00 52.37 N
-ATOM 2590 CA SER C 35 23.826 26.771 27.353 1.00 53.95 C
-ATOM 2591 C SER C 35 22.993 27.224 28.552 1.00 55.51 C
-ATOM 2592 O SER C 35 23.380 27.021 29.707 1.00 56.67 O
-ATOM 2593 CB SER C 35 24.239 25.318 27.465 1.00 46.66 C
-ATOM 2594 OG SER C 35 23.156 24.486 27.672 1.00 45.00 O
-ATOM 2595 H SER C 35 25.584 27.748 28.071 1.00 0.00 H
-ATOM 2596 HA SER C 35 23.226 26.904 26.453 1.00 0.00 H
-ATOM 2597 1HB SER C 35 24.739 25.029 26.537 1.00 0.00 H
-ATOM 2598 2HB SER C 35 24.958 25.201 28.273 1.00 0.00 H
-ATOM 2599 HG SER C 35 22.513 24.692 26.972 1.00 0.00 H
-ATOM 2600 N GLU C 36 21.864 27.878 28.265 1.00 55.44 N
-ATOM 2601 CA GLU C 36 21.003 28.448 29.294 1.00 54.50 C
-ATOM 2602 C GLU C 36 19.861 27.502 29.647 1.00 56.02 C
-ATOM 2603 O GLU C 36 19.039 27.153 28.796 1.00 53.95 O
-ATOM 2604 CB GLU C 36 20.430 29.801 28.847 1.00 52.67 C
-ATOM 2605 CG GLU C 36 19.647 30.544 29.933 1.00 60.27 C
-ATOM 2606 CD GLU C 36 20.521 31.078 31.029 1.00 62.27 C
-ATOM 2607 OE1 GLU C 36 21.665 31.411 30.766 1.00 52.28 O
-ATOM 2608 OE2 GLU C 36 20.047 31.166 32.146 1.00 55.76 O
-ATOM 2609 H GLU C 36 21.599 27.984 27.291 1.00 0.00 H
-ATOM 2610 HA GLU C 36 21.600 28.608 30.191 1.00 0.00 H
-ATOM 2611 1HB GLU C 36 21.233 30.445 28.502 1.00 0.00 H
-ATOM 2612 2HB GLU C 36 19.754 29.647 28.011 1.00 0.00 H
-ATOM 2613 1HG GLU C 36 19.106 31.375 29.497 1.00 0.00 H
-ATOM 2614 2HG GLU C 36 18.920 29.858 30.365 1.00 0.00 H
-ATOM 2615 N LYS C 37 19.823 27.067 30.899 1.00 55.64 N
-ATOM 2616 CA LYS C 37 18.789 26.136 31.333 1.00 54.47 C
-ATOM 2617 C LYS C 37 17.536 26.870 31.806 1.00 54.57 C
-ATOM 2618 O LYS C 37 17.598 27.684 32.734 1.00 53.88 O
-ATOM 2619 CB LYS C 37 19.326 25.245 32.452 1.00 55.28 C
-ATOM 2620 CG LYS C 37 18.357 24.173 32.939 1.00 43.79 C
-ATOM 2621 CD LYS C 37 18.987 23.323 34.052 1.00 47.23 C
-ATOM 2622 CE LYS C 37 18.009 22.291 34.595 1.00 46.33 C
-ATOM 2623 NZ LYS C 37 18.590 21.520 35.724 1.00 46.70 N
-ATOM 2624 H LYS C 37 20.523 27.384 31.555 1.00 0.00 H
-ATOM 2625 HA LYS C 37 18.512 25.507 30.488 1.00 0.00 H
-ATOM 2626 1HB LYS C 37 20.231 24.744 32.106 1.00 0.00 H
-ATOM 2627 2HB LYS C 37 19.602 25.864 33.305 1.00 0.00 H
-ATOM 2628 1HG LYS C 37 17.445 24.646 33.322 1.00 0.00 H
-ATOM 2629 2HG LYS C 37 18.079 23.530 32.100 1.00 0.00 H
-ATOM 2630 1HD LYS C 37 19.866 22.806 33.662 1.00 0.00 H
-ATOM 2631 2HD LYS C 37 19.300 23.970 34.870 1.00 0.00 H
-ATOM 2632 1HE LYS C 37 17.106 22.798 34.937 1.00 0.00 H
-ATOM 2633 2HE LYS C 37 17.744 21.598 33.800 1.00 0.00 H
-ATOM 2634 1HZ LYS C 37 17.911 20.849 36.056 1.00 0.00 H
-ATOM 2635 2HZ LYS C 37 19.422 21.036 35.416 1.00 0.00 H
-ATOM 2636 3HZ LYS C 37 18.825 22.158 36.471 1.00 0.00 H
-ATOM 2637 N LEU C 38 16.413 26.597 31.149 1.00 53.94 N
-ATOM 2638 CA LEU C 38 15.138 27.220 31.474 1.00 54.12 C
-ATOM 2639 C LEU C 38 14.168 26.156 31.989 1.00 55.84 C
-ATOM 2640 O LEU C 38 13.854 25.196 31.279 1.00 56.12 O
-ATOM 2641 CB LEU C 38 14.535 27.896 30.225 1.00 50.56 C
-ATOM 2642 CG LEU C 38 15.413 28.907 29.480 1.00 53.69 C
-ATOM 2643 CD1 LEU C 38 14.648 29.417 28.249 1.00 53.45 C
-ATOM 2644 CD2 LEU C 38 15.791 30.036 30.398 1.00 53.02 C
-ATOM 2645 H LEU C 38 16.445 25.923 30.395 1.00 0.00 H
-ATOM 2646 HA LEU C 38 15.286 27.961 32.257 1.00 0.00 H
-ATOM 2647 1HB LEU C 38 14.297 27.129 29.516 1.00 0.00 H
-ATOM 2648 2HB LEU C 38 13.612 28.403 30.512 1.00 0.00 H
-ATOM 2649 HG LEU C 38 16.322 28.405 29.131 1.00 0.00 H
-ATOM 2650 1HD1 LEU C 38 15.274 30.110 27.704 1.00 0.00 H
-ATOM 2651 2HD1 LEU C 38 14.396 28.575 27.606 1.00 0.00 H
-ATOM 2652 3HD1 LEU C 38 13.728 29.923 28.562 1.00 0.00 H
-ATOM 2653 1HD2 LEU C 38 16.427 30.737 29.867 1.00 0.00 H
-ATOM 2654 2HD2 LEU C 38 14.890 30.545 30.744 1.00 0.00 H
-ATOM 2655 3HD2 LEU C 38 16.334 29.632 31.249 1.00 0.00 H
-ATOM 2656 N ASP C 39 13.700 26.302 33.217 1.00 54.83 N
-ATOM 2657 CA ASP C 39 12.761 25.321 33.744 1.00 53.17 C
-ATOM 2658 C ASP C 39 11.360 25.760 33.378 1.00 52.25 C
-ATOM 2659 O ASP C 39 11.197 26.875 32.885 1.00 49.21 O
-ATOM 2660 CB ASP C 39 12.970 25.069 35.230 1.00 52.57 C
-ATOM 2661 CG ASP C 39 14.237 24.206 35.482 1.00 54.67 C
-ATOM 2662 OD1 ASP C 39 14.646 23.467 34.578 1.00 47.96 O
-ATOM 2663 OD2 ASP C 39 14.781 24.280 36.557 1.00 48.68 O
-ATOM 2664 H ASP C 39 13.981 27.108 33.777 1.00 0.00 H
-ATOM 2665 HA ASP C 39 12.948 24.383 33.242 1.00 0.00 H
-ATOM 2666 1HB ASP C 39 13.076 26.025 35.752 1.00 0.00 H
-ATOM 2667 2HB ASP C 39 12.095 24.554 35.642 1.00 0.00 H
-ATOM 2668 N LYS C 40 10.369 24.889 33.537 1.00 50.31 N
-ATOM 2669 CA LYS C 40 9.045 25.219 33.035 1.00 48.78 C
-ATOM 2670 C LYS C 40 8.570 26.585 33.484 1.00 47.84 C
-ATOM 2671 O LYS C 40 8.564 26.907 34.676 1.00 49.91 O
-ATOM 2672 CB LYS C 40 8.030 24.161 33.450 1.00 54.53 C
-ATOM 2673 CG LYS C 40 6.642 24.387 32.879 1.00 67.57 C
-ATOM 2674 CD LYS C 40 5.715 23.238 33.192 1.00 67.75 C
-ATOM 2675 CE LYS C 40 4.366 23.451 32.541 1.00 66.25 C
-ATOM 2676 NZ LYS C 40 3.442 22.329 32.806 1.00 69.77 N
-ATOM 2677 H LYS C 40 10.520 23.981 33.989 1.00 0.00 H
-ATOM 2678 HA LYS C 40 9.094 25.228 31.945 1.00 0.00 H
-ATOM 2679 1HB LYS C 40 8.378 23.184 33.145 1.00 0.00 H
-ATOM 2680 2HB LYS C 40 7.952 24.142 34.537 1.00 0.00 H
-ATOM 2681 1HG LYS C 40 6.220 25.296 33.309 1.00 0.00 H
-ATOM 2682 2HG LYS C 40 6.702 24.514 31.802 1.00 0.00 H
-ATOM 2683 1HD LYS C 40 6.147 22.313 32.807 1.00 0.00 H
-ATOM 2684 2HD LYS C 40 5.591 23.145 34.272 1.00 0.00 H
-ATOM 2685 1HE LYS C 40 3.926 24.372 32.921 1.00 0.00 H
-ATOM 2686 2HE LYS C 40 4.506 23.544 31.463 1.00 0.00 H
-ATOM 2687 1HZ LYS C 40 2.562 22.509 32.349 1.00 0.00 H
-ATOM 2688 2HZ LYS C 40 3.842 21.475 32.442 1.00 0.00 H
-ATOM 2689 3HZ LYS C 40 3.296 22.237 33.799 1.00 0.00 H
-ATOM 2690 N GLY C 41 8.160 27.385 32.506 1.00 42.64 N
-ATOM 2691 CA GLY C 41 7.638 28.713 32.733 1.00 39.28 C
-ATOM 2692 C GLY C 41 8.686 29.830 32.676 1.00 38.03 C
-ATOM 2693 O GLY C 41 8.320 31.008 32.655 1.00 38.26 O
-ATOM 2694 H GLY C 41 8.202 27.057 31.543 1.00 0.00 H
-ATOM 2695 1HA GLY C 41 6.867 28.911 31.993 1.00 0.00 H
-ATOM 2696 2HA GLY C 41 7.143 28.727 33.700 1.00 0.00 H
-ATOM 2697 N GLU C 42 9.978 29.504 32.669 1.00 39.23 N
-ATOM 2698 CA GLU C 42 10.967 30.586 32.607 1.00 44.19 C
-ATOM 2699 C GLU C 42 11.008 31.184 31.206 1.00 44.96 C
-ATOM 2700 O GLU C 42 10.878 30.468 30.204 1.00 45.65 O
-ATOM 2701 CB GLU C 42 12.374 30.127 33.047 1.00 46.31 C
-ATOM 2702 CG GLU C 42 12.505 29.819 34.556 1.00 57.46 C
-ATOM 2703 CD GLU C 42 13.937 29.554 35.031 1.00 64.89 C
-ATOM 2704 OE1 GLU C 42 14.509 28.557 34.676 1.00 56.58 O
-ATOM 2705 OE2 GLU C 42 14.453 30.378 35.757 1.00 66.75 O
-ATOM 2706 H GLU C 42 10.276 28.530 32.707 1.00 0.00 H
-ATOM 2707 HA GLU C 42 10.655 31.377 33.292 1.00 0.00 H
-ATOM 2708 1HB GLU C 42 12.635 29.216 32.514 1.00 0.00 H
-ATOM 2709 2HB GLU C 42 13.113 30.891 32.786 1.00 0.00 H
-ATOM 2710 1HG GLU C 42 12.108 30.660 35.124 1.00 0.00 H
-ATOM 2711 2HG GLU C 42 11.891 28.943 34.774 1.00 0.00 H
-ATOM 2712 N VAL C 43 11.196 32.507 31.131 1.00 41.60 N
-ATOM 2713 CA VAL C 43 11.275 33.169 29.828 1.00 43.11 C
-ATOM 2714 C VAL C 43 12.616 33.829 29.595 1.00 43.91 C
-ATOM 2715 O VAL C 43 13.127 34.563 30.440 1.00 41.33 O
-ATOM 2716 CB VAL C 43 10.144 34.219 29.647 1.00 38.08 C
-ATOM 2717 CG1 VAL C 43 10.314 34.969 28.310 1.00 35.22 C
-ATOM 2718 CG2 VAL C 43 8.804 33.512 29.626 1.00 39.31 C
-ATOM 2719 H VAL C 43 11.294 33.052 31.991 1.00 0.00 H
-ATOM 2720 HA VAL C 43 11.138 32.415 29.058 1.00 0.00 H
-ATOM 2721 HB VAL C 43 10.181 34.939 30.463 1.00 0.00 H
-ATOM 2722 1HG1 VAL C 43 9.510 35.696 28.187 1.00 0.00 H
-ATOM 2723 2HG1 VAL C 43 11.270 35.490 28.295 1.00 0.00 H
-ATOM 2724 3HG1 VAL C 43 10.279 34.248 27.491 1.00 0.00 H
-ATOM 2725 1HG2 VAL C 43 8.003 34.240 29.495 1.00 0.00 H
-ATOM 2726 2HG2 VAL C 43 8.797 32.821 28.806 1.00 0.00 H
-ATOM 2727 3HG2 VAL C 43 8.659 32.970 30.557 1.00 0.00 H
-ATOM 2728 N LEU C 44 13.193 33.543 28.435 1.00 42.09 N
-ATOM 2729 CA LEU C 44 14.464 34.122 28.042 1.00 40.57 C
-ATOM 2730 C LEU C 44 14.319 34.963 26.786 1.00 39.56 C
-ATOM 2731 O LEU C 44 13.834 34.491 25.759 1.00 38.05 O
-ATOM 2732 CB LEU C 44 15.481 33.017 27.782 1.00 31.21 C
-ATOM 2733 CG LEU C 44 16.856 33.466 27.302 1.00 34.55 C
-ATOM 2734 CD1 LEU C 44 17.561 34.271 28.417 1.00 27.62 C
-ATOM 2735 CD2 LEU C 44 17.649 32.233 26.894 1.00 29.80 C
-ATOM 2736 H LEU C 44 12.723 32.901 27.802 1.00 0.00 H
-ATOM 2737 HA LEU C 44 14.825 34.762 28.843 1.00 0.00 H
-ATOM 2738 1HB LEU C 44 15.617 32.473 28.702 1.00 0.00 H
-ATOM 2739 2HB LEU C 44 15.071 32.340 27.034 1.00 0.00 H
-ATOM 2740 HG LEU C 44 16.744 34.122 26.438 1.00 0.00 H
-ATOM 2741 1HD1 LEU C 44 18.535 34.596 28.066 1.00 0.00 H
-ATOM 2742 2HD1 LEU C 44 16.960 35.146 28.674 1.00 0.00 H
-ATOM 2743 3HD1 LEU C 44 17.685 33.646 29.303 1.00 0.00 H
-ATOM 2744 1HD2 LEU C 44 18.634 32.530 26.534 1.00 0.00 H
-ATOM 2745 2HD2 LEU C 44 17.758 31.570 27.742 1.00 0.00 H
-ATOM 2746 3HD2 LEU C 44 17.115 31.714 26.103 1.00 0.00 H
-ATOM 2747 N ILE C 45 14.726 36.214 26.867 1.00 40.23 N
-ATOM 2748 CA ILE C 45 14.666 37.087 25.714 1.00 41.97 C
-ATOM 2749 C ILE C 45 16.111 37.373 25.327 1.00 43.17 C
-ATOM 2750 O ILE C 45 16.865 37.904 26.139 1.00 45.22 O
-ATOM 2751 CB ILE C 45 13.935 38.385 26.055 1.00 40.16 C
-ATOM 2752 CG1 ILE C 45 12.530 38.056 26.594 1.00 48.10 C
-ATOM 2753 CG2 ILE C 45 13.824 39.173 24.793 1.00 33.81 C
-ATOM 2754 CD1 ILE C 45 11.793 39.216 27.172 1.00 47.38 C
-ATOM 2755 H ILE C 45 15.086 36.572 27.742 1.00 0.00 H
-ATOM 2756 HA ILE C 45 14.170 36.587 24.890 1.00 0.00 H
-ATOM 2757 HB ILE C 45 14.480 38.945 26.809 1.00 0.00 H
-ATOM 2758 1HG1 ILE C 45 11.942 37.648 25.801 1.00 0.00 H
-ATOM 2759 2HG1 ILE C 45 12.627 37.305 27.376 1.00 0.00 H
-ATOM 2760 1HG2 ILE C 45 13.300 40.105 24.972 1.00 0.00 H
-ATOM 2761 2HG2 ILE C 45 14.816 39.373 24.405 1.00 0.00 H
-ATOM 2762 3HG2 ILE C 45 13.286 38.588 24.076 1.00 0.00 H
-ATOM 2763 1HD1 ILE C 45 10.830 38.879 27.526 1.00 0.00 H
-ATOM 2764 2HD1 ILE C 45 12.359 39.642 28.003 1.00 0.00 H
-ATOM 2765 3HD1 ILE C 45 11.653 39.961 26.406 1.00 0.00 H
-ATOM 2766 N ALA C 46 16.528 37.001 24.121 1.00 40.37 N
-ATOM 2767 CA ALA C 46 17.962 37.132 23.855 1.00 40.54 C
-ATOM 2768 C ALA C 46 18.316 37.558 22.449 1.00 41.72 C
-ATOM 2769 O ALA C 46 17.736 37.092 21.464 1.00 39.57 O
-ATOM 2770 CB ALA C 46 18.634 35.797 24.138 1.00 31.74 C
-ATOM 2771 H ALA C 46 15.875 36.607 23.447 1.00 0.00 H
-ATOM 2772 HA ALA C 46 18.360 37.890 24.525 1.00 0.00 H
-ATOM 2773 1HB ALA C 46 19.709 35.897 23.987 1.00 0.00 H
-ATOM 2774 2HB ALA C 46 18.435 35.500 25.165 1.00 0.00 H
-ATOM 2775 3HB ALA C 46 18.238 35.042 23.460 1.00 0.00 H
-ATOM 2776 N GLN C 47 19.312 38.444 22.378 1.00 41.41 N
-ATOM 2777 CA GLN C 47 19.837 38.980 21.128 1.00 38.17 C
-ATOM 2778 C GLN C 47 20.920 38.145 20.490 1.00 38.21 C
-ATOM 2779 O GLN C 47 21.652 37.413 21.160 1.00 37.20 O
-ATOM 2780 CB GLN C 47 20.406 40.394 21.314 1.00 26.30 C
-ATOM 2781 CG GLN C 47 19.400 41.482 21.617 1.00 33.32 C
-ATOM 2782 CD GLN C 47 20.049 42.833 21.745 1.00 35.83 C
-ATOM 2783 OE1 GLN C 47 20.960 43.018 22.564 1.00 35.90 O
-ATOM 2784 NE2 GLN C 47 19.605 43.799 20.930 1.00 39.82 N
-ATOM 2785 H GLN C 47 19.731 38.784 23.246 1.00 0.00 H
-ATOM 2786 HA GLN C 47 19.025 39.043 20.418 1.00 0.00 H
-ATOM 2787 1HB GLN C 47 21.136 40.381 22.126 1.00 0.00 H
-ATOM 2788 2HB GLN C 47 20.940 40.685 20.406 1.00 0.00 H
-ATOM 2789 1HG GLN C 47 18.723 41.551 20.775 1.00 0.00 H
-ATOM 2790 2HG GLN C 47 18.862 41.252 22.539 1.00 0.00 H
-ATOM 2791 1HE2 GLN C 47 20.004 44.713 20.976 1.00 0.00 H
-ATOM 2792 2HE2 GLN C 47 18.870 43.600 20.247 1.00 0.00 H
-ATOM 2793 N PHE C 48 21.067 38.340 19.188 1.00 34.87 N
-ATOM 2794 CA PHE C 48 22.208 37.801 18.465 1.00 37.48 C
-ATOM 2795 C PHE C 48 23.311 38.825 18.701 1.00 35.71 C
-ATOM 2796 O PHE C 48 23.021 40.016 18.816 1.00 35.52 O
-ATOM 2797 CB PHE C 48 21.890 37.635 16.993 1.00 36.93 C
-ATOM 2798 CG PHE C 48 20.845 36.586 16.742 1.00 28.54 C
-ATOM 2799 CD1 PHE C 48 21.167 35.237 16.613 1.00 25.88 C
-ATOM 2800 CD2 PHE C 48 19.514 36.965 16.655 1.00 26.10 C
-ATOM 2801 CE1 PHE C 48 20.160 34.307 16.404 1.00 25.09 C
-ATOM 2802 CE2 PHE C 48 18.527 36.040 16.450 1.00 26.06 C
-ATOM 2803 CZ PHE C 48 18.851 34.717 16.331 1.00 26.10 C
-ATOM 2804 H PHE C 48 20.373 38.912 18.703 1.00 0.00 H
-ATOM 2805 HA PHE C 48 22.511 36.840 18.891 1.00 0.00 H
-ATOM 2806 1HB PHE C 48 21.547 38.580 16.580 1.00 0.00 H
-ATOM 2807 2HB PHE C 48 22.799 37.344 16.465 1.00 0.00 H
-ATOM 2808 HD1 PHE C 48 22.211 34.917 16.682 1.00 0.00 H
-ATOM 2809 HD2 PHE C 48 19.258 38.017 16.759 1.00 0.00 H
-ATOM 2810 HE1 PHE C 48 20.395 33.257 16.306 1.00 0.00 H
-ATOM 2811 HE2 PHE C 48 17.488 36.358 16.389 1.00 0.00 H
-ATOM 2812 HZ PHE C 48 18.078 33.997 16.190 1.00 0.00 H
-ATOM 2813 N THR C 49 24.545 38.375 18.873 1.00 34.25 N
-ATOM 2814 CA THR C 49 25.615 39.295 19.265 1.00 34.74 C
-ATOM 2815 C THR C 49 26.876 39.162 18.441 1.00 37.62 C
-ATOM 2816 O THR C 49 26.980 38.346 17.528 1.00 40.71 O
-ATOM 2817 CB THR C 49 26.032 39.095 20.739 1.00 27.72 C
-ATOM 2818 OG1 THR C 49 26.728 37.849 20.866 1.00 37.18 O
-ATOM 2819 CG2 THR C 49 24.813 39.074 21.660 1.00 26.73 C
-ATOM 2820 H THR C 49 24.744 37.392 18.706 1.00 0.00 H
-ATOM 2821 HA THR C 49 25.251 40.315 19.143 1.00 0.00 H
-ATOM 2822 HB THR C 49 26.688 39.908 21.046 1.00 0.00 H
-ATOM 2823 HG1 THR C 49 26.073 37.145 20.962 1.00 0.00 H
-ATOM 2824 1HG2 THR C 49 25.146 38.930 22.686 1.00 0.00 H
-ATOM 2825 2HG2 THR C 49 24.269 40.011 21.582 1.00 0.00 H
-ATOM 2826 3HG2 THR C 49 24.155 38.254 21.380 1.00 0.00 H
-ATOM 2827 N GLU C 50 27.876 39.933 18.843 1.00 36.57 N
-ATOM 2828 CA GLU C 50 29.218 39.876 18.288 1.00 39.88 C
-ATOM 2829 C GLU C 50 29.815 38.469 18.404 1.00 41.06 C
-ATOM 2830 O GLU C 50 30.689 38.104 17.617 1.00 40.75 O
-ATOM 2831 CB GLU C 50 30.124 40.884 19.004 1.00 42.48 C
-ATOM 2832 CG GLU C 50 31.540 40.972 18.460 1.00 42.99 C
-ATOM 2833 CD GLU C 50 32.352 42.078 19.104 1.00 60.03 C
-ATOM 2834 OE1 GLU C 50 31.828 42.770 19.943 1.00 66.29 O
-ATOM 2835 OE2 GLU C 50 33.497 42.227 18.752 1.00 55.71 O
-ATOM 2836 H GLU C 50 27.703 40.589 19.587 1.00 0.00 H
-ATOM 2837 HA GLU C 50 29.167 40.136 17.231 1.00 0.00 H
-ATOM 2838 1HB GLU C 50 29.683 41.877 18.947 1.00 0.00 H
-ATOM 2839 2HB GLU C 50 30.195 40.617 20.060 1.00 0.00 H
-ATOM 2840 1HG GLU C 50 32.040 40.018 18.642 1.00 0.00 H
-ATOM 2841 2HG GLU C 50 31.497 41.131 17.385 1.00 0.00 H
-ATOM 2842 N HIS C 51 29.400 37.701 19.419 1.00 39.36 N
-ATOM 2843 CA HIS C 51 29.963 36.374 19.616 1.00 40.36 C
-ATOM 2844 C HIS C 51 28.975 35.241 19.310 1.00 39.51 C
-ATOM 2845 O HIS C 51 29.396 34.089 19.202 1.00 41.95 O
-ATOM 2846 CB HIS C 51 30.486 36.232 21.052 1.00 41.61 C
-ATOM 2847 CG HIS C 51 31.626 37.165 21.370 1.00 39.04 C
-ATOM 2848 ND1 HIS C 51 31.430 38.477 21.743 1.00 42.30 N
-ATOM 2849 CD2 HIS C 51 32.966 36.969 21.371 1.00 31.92 C
-ATOM 2850 CE1 HIS C 51 32.601 39.052 21.951 1.00 40.69 C
-ATOM 2851 NE2 HIS C 51 33.550 38.158 21.737 1.00 37.75 N
-ATOM 2852 H HIS C 51 28.653 38.010 20.034 1.00 0.00 H
-ATOM 2853 HA HIS C 51 30.812 36.247 18.946 1.00 0.00 H
-ATOM 2854 1HB HIS C 51 29.676 36.432 21.757 1.00 0.00 H
-ATOM 2855 2HB HIS C 51 30.819 35.208 21.218 1.00 0.00 H
-ATOM 2856 HD2 HIS C 51 33.486 36.043 21.126 1.00 0.00 H
-ATOM 2857 HE1 HIS C 51 32.755 40.089 22.252 1.00 0.00 H
-ATOM 2858 HE2 HIS C 51 34.545 38.318 21.823 1.00 0.00 H
-ATOM 2859 N THR C 52 27.681 35.559 19.156 1.00 39.16 N
-ATOM 2860 CA THR C 52 26.638 34.546 18.888 1.00 38.46 C
-ATOM 2861 C THR C 52 25.936 34.785 17.552 1.00 35.80 C
-ATOM 2862 O THR C 52 25.255 35.801 17.382 1.00 31.58 O
-ATOM 2863 CB THR C 52 25.525 34.545 19.969 1.00 35.82 C
-ATOM 2864 OG1 THR C 52 26.079 34.272 21.258 1.00 31.10 O
-ATOM 2865 CG2 THR C 52 24.445 33.486 19.637 1.00 42.66 C
-ATOM 2866 H THR C 52 27.418 36.532 19.235 1.00 0.00 H
-ATOM 2867 HA THR C 52 27.108 33.564 18.856 1.00 0.00 H
-ATOM 2868 HB THR C 52 25.054 35.523 19.995 1.00 0.00 H
-ATOM 2869 HG1 THR C 52 26.633 35.006 21.536 1.00 0.00 H
-ATOM 2870 1HG2 THR C 52 23.665 33.505 20.397 1.00 0.00 H
-ATOM 2871 2HG2 THR C 52 23.999 33.703 18.665 1.00 0.00 H
-ATOM 2872 3HG2 THR C 52 24.899 32.494 19.610 1.00 0.00 H
-ATOM 2873 N SER C 53 26.041 33.822 16.631 1.00 35.13 N
-ATOM 2874 CA SER C 53 25.406 33.966 15.315 1.00 38.19 C
-ATOM 2875 C SER C 53 24.157 33.116 15.185 1.00 38.45 C
-ATOM 2876 O SER C 53 23.358 33.301 14.260 1.00 38.29 O
-ATOM 2877 CB SER C 53 26.343 33.606 14.195 1.00 37.14 C
-ATOM 2878 OG SER C 53 26.727 32.271 14.262 1.00 33.11 O
-ATOM 2879 H SER C 53 26.576 32.984 16.859 1.00 0.00 H
-ATOM 2880 HA SER C 53 25.112 35.008 15.189 1.00 0.00 H
-ATOM 2881 1HB SER C 53 25.830 33.785 13.254 1.00 0.00 H
-ATOM 2882 2HB SER C 53 27.205 34.241 14.216 1.00 0.00 H
-ATOM 2883 HG SER C 53 25.945 31.784 14.545 1.00 0.00 H
-ATOM 2884 N ALA C 54 23.986 32.170 16.099 1.00 35.83 N
-ATOM 2885 CA ALA C 54 22.803 31.329 16.026 1.00 39.38 C
-ATOM 2886 C ALA C 54 22.361 30.880 17.406 1.00 39.83 C
-ATOM 2887 O ALA C 54 23.170 30.734 18.328 1.00 38.55 O
-ATOM 2888 CB ALA C 54 23.041 30.130 15.118 1.00 28.30 C
-ATOM 2889 H ALA C 54 24.690 32.030 16.824 1.00 0.00 H
-ATOM 2890 HA ALA C 54 21.999 31.922 15.602 1.00 0.00 H
-ATOM 2891 1HB ALA C 54 22.123 29.548 15.060 1.00 0.00 H
-ATOM 2892 2HB ALA C 54 23.314 30.478 14.126 1.00 0.00 H
-ATOM 2893 3HB ALA C 54 23.824 29.515 15.493 1.00 0.00 H
-ATOM 2894 N ILE C 55 21.061 30.638 17.519 1.00 38.20 N
-ATOM 2895 CA ILE C 55 20.446 30.139 18.738 1.00 39.77 C
-ATOM 2896 C ILE C 55 19.743 28.810 18.485 1.00 40.03 C
-ATOM 2897 O ILE C 55 18.910 28.688 17.588 1.00 36.79 O
-ATOM 2898 CB ILE C 55 19.449 31.170 19.314 1.00 39.02 C
-ATOM 2899 CG1 ILE C 55 20.200 32.486 19.673 1.00 25.11 C
-ATOM 2900 CG2 ILE C 55 18.746 30.591 20.527 1.00 29.36 C
-ATOM 2901 CD1 ILE C 55 19.288 33.646 20.056 1.00 19.94 C
-ATOM 2902 H ILE C 55 20.477 30.787 16.702 1.00 0.00 H
-ATOM 2903 HA ILE C 55 21.227 29.976 19.476 1.00 0.00 H
-ATOM 2904 HB ILE C 55 18.707 31.415 18.554 1.00 0.00 H
-ATOM 2905 1HG1 ILE C 55 20.878 32.284 20.502 1.00 0.00 H
-ATOM 2906 2HG1 ILE C 55 20.789 32.797 18.818 1.00 0.00 H
-ATOM 2907 1HG2 ILE C 55 18.041 31.318 20.921 1.00 0.00 H
-ATOM 2908 2HG2 ILE C 55 18.212 29.684 20.245 1.00 0.00 H
-ATOM 2909 3HG2 ILE C 55 19.492 30.351 21.286 1.00 0.00 H
-ATOM 2910 1HD1 ILE C 55 19.893 34.528 20.287 1.00 0.00 H
-ATOM 2911 2HD1 ILE C 55 18.618 33.878 19.227 1.00 0.00 H
-ATOM 2912 3HD1 ILE C 55 18.700 33.374 20.931 1.00 0.00 H
-ATOM 2913 N LYS C 56 20.094 27.804 19.264 1.00 40.35 N
-ATOM 2914 CA LYS C 56 19.492 26.486 19.104 1.00 43.44 C
-ATOM 2915 C LYS C 56 18.666 26.150 20.335 1.00 44.14 C
-ATOM 2916 O LYS C 56 19.106 26.365 21.458 1.00 42.08 O
-ATOM 2917 CB LYS C 56 20.588 25.462 18.835 1.00 34.94 C
-ATOM 2918 CG LYS C 56 20.159 24.048 18.613 1.00 37.03 C
-ATOM 2919 CD LYS C 56 21.397 23.206 18.346 1.00 44.36 C
-ATOM 2920 CE LYS C 56 21.074 21.748 18.145 1.00 59.05 C
-ATOM 2921 NZ LYS C 56 22.305 20.969 17.862 1.00 56.61 N
-ATOM 2922 H LYS C 56 20.795 27.960 19.984 1.00 0.00 H
-ATOM 2923 HA LYS C 56 18.822 26.504 18.251 1.00 0.00 H
-ATOM 2924 1HB LYS C 56 21.122 25.759 17.940 1.00 0.00 H
-ATOM 2925 2HB LYS C 56 21.294 25.466 19.631 1.00 0.00 H
-ATOM 2926 1HG LYS C 56 19.626 23.666 19.485 1.00 0.00 H
-ATOM 2927 2HG LYS C 56 19.493 24.002 17.745 1.00 0.00 H
-ATOM 2928 1HD LYS C 56 21.905 23.575 17.445 1.00 0.00 H
-ATOM 2929 2HD LYS C 56 22.084 23.299 19.188 1.00 0.00 H
-ATOM 2930 1HE LYS C 56 20.593 21.346 19.038 1.00 0.00 H
-ATOM 2931 2HE LYS C 56 20.398 21.650 17.315 1.00 0.00 H
-ATOM 2932 1HZ LYS C 56 22.074 19.992 17.707 1.00 0.00 H
-ATOM 2933 2HZ LYS C 56 22.772 21.344 17.031 1.00 0.00 H
-ATOM 2934 3HZ LYS C 56 22.936 21.046 18.639 1.00 0.00 H
-ATOM 2935 N VAL C 57 17.441 25.679 20.132 1.00 45.58 N
-ATOM 2936 CA VAL C 57 16.597 25.386 21.277 1.00 48.41 C
-ATOM 2937 C VAL C 57 16.233 23.907 21.346 1.00 48.65 C
-ATOM 2938 O VAL C 57 15.714 23.317 20.389 1.00 50.27 O
-ATOM 2939 CB VAL C 57 15.320 26.237 21.234 1.00 48.46 C
-ATOM 2940 CG1 VAL C 57 14.457 25.936 22.475 1.00 29.48 C
-ATOM 2941 CG2 VAL C 57 15.705 27.694 21.143 1.00 37.55 C
-ATOM 2942 H VAL C 57 17.104 25.533 19.188 1.00 0.00 H
-ATOM 2943 HA VAL C 57 17.138 25.644 22.187 1.00 0.00 H
-ATOM 2944 HB VAL C 57 14.731 25.967 20.356 1.00 0.00 H
-ATOM 2945 1HG1 VAL C 57 13.550 26.530 22.449 1.00 0.00 H
-ATOM 2946 2HG1 VAL C 57 14.190 24.876 22.498 1.00 0.00 H
-ATOM 2947 3HG1 VAL C 57 15.023 26.182 23.374 1.00 0.00 H
-ATOM 2948 1HG2 VAL C 57 14.807 28.305 21.105 1.00 0.00 H
-ATOM 2949 2HG2 VAL C 57 16.293 27.950 22.015 1.00 0.00 H
-ATOM 2950 3HG2 VAL C 57 16.296 27.865 20.243 1.00 0.00 H
-ATOM 2951 N ARG C 58 16.532 23.323 22.502 1.00 48.79 N
-ATOM 2952 CA ARG C 58 16.286 21.920 22.800 1.00 48.92 C
-ATOM 2953 C ARG C 58 15.319 21.766 23.974 1.00 48.15 C
-ATOM 2954 O ARG C 58 15.486 22.379 25.025 1.00 47.10 O
-ATOM 2955 CB ARG C 58 17.606 21.245 23.120 1.00 49.41 C
-ATOM 2956 CG ARG C 58 17.529 19.815 23.573 1.00 66.71 C
-ATOM 2957 CD ARG C 58 18.885 19.284 23.836 1.00 74.53 C
-ATOM 2958 NE ARG C 58 19.634 19.100 22.615 1.00 80.47 N
-ATOM 2959 CZ ARG C 58 20.952 18.859 22.543 1.00 79.66 C
-ATOM 2960 NH1 ARG C 58 21.689 18.787 23.630 1.00 77.54 N
-ATOM 2961 NH2 ARG C 58 21.487 18.695 21.356 1.00 79.86 N
-ATOM 2962 H ARG C 58 16.983 23.883 23.223 1.00 0.00 H
-ATOM 2963 HA ARG C 58 15.848 21.450 21.919 1.00 0.00 H
-ATOM 2964 1HB ARG C 58 18.238 21.262 22.226 1.00 0.00 H
-ATOM 2965 2HB ARG C 58 18.123 21.813 23.884 1.00 0.00 H
-ATOM 2966 1HG ARG C 58 16.943 19.750 24.491 1.00 0.00 H
-ATOM 2967 2HG ARG C 58 17.063 19.209 22.792 1.00 0.00 H
-ATOM 2968 1HD ARG C 58 19.428 19.997 24.459 1.00 0.00 H
-ATOM 2969 2HD ARG C 58 18.820 18.328 24.350 1.00 0.00 H
-ATOM 2970 HE ARG C 58 19.129 19.149 21.720 1.00 0.00 H
-ATOM 2971 1HH1 ARG C 58 21.267 18.914 24.536 1.00 0.00 H
-ATOM 2972 2HH1 ARG C 58 22.679 18.604 23.554 1.00 0.00 H
-ATOM 2973 1HH2 ARG C 58 20.867 18.749 20.540 1.00 0.00 H
-ATOM 2974 2HH2 ARG C 58 22.470 18.508 21.259 1.00 0.00 H
-ATOM 2975 N GLY C 59 14.309 20.930 23.812 1.00 47.87 N
-ATOM 2976 CA GLY C 59 13.312 20.771 24.863 1.00 48.38 C
-ATOM 2977 C GLY C 59 12.091 21.547 24.442 1.00 48.06 C
-ATOM 2978 O GLY C 59 12.193 22.458 23.613 1.00 49.66 O
-ATOM 2979 H GLY C 59 14.192 20.425 22.941 1.00 0.00 H
-ATOM 2980 1HA GLY C 59 13.060 19.719 24.994 1.00 0.00 H
-ATOM 2981 2HA GLY C 59 13.688 21.139 25.817 1.00 0.00 H
-ATOM 2982 N LYS C 60 10.926 21.163 24.934 1.00 48.30 N
-ATOM 2983 CA LYS C 60 9.705 21.797 24.476 1.00 46.34 C
-ATOM 2984 C LYS C 60 9.664 23.259 24.880 1.00 46.84 C
-ATOM 2985 O LYS C 60 9.877 23.587 26.054 1.00 43.99 O
-ATOM 2986 CB LYS C 60 8.482 21.042 25.001 1.00 46.02 C
-ATOM 2987 CG LYS C 60 7.181 21.385 24.298 1.00 41.19 C
-ATOM 2988 CD LYS C 60 6.016 20.593 24.881 1.00 58.47 C
-ATOM 2989 CE LYS C 60 4.816 20.588 23.932 1.00 55.85 C
-ATOM 2990 NZ LYS C 60 4.288 21.938 23.677 1.00 57.57 N
-ATOM 2991 H LYS C 60 10.895 20.418 25.631 1.00 0.00 H
-ATOM 2992 HA LYS C 60 9.692 21.759 23.397 1.00 0.00 H
-ATOM 2993 1HB LYS C 60 8.651 19.969 24.910 1.00 0.00 H
-ATOM 2994 2HB LYS C 60 8.350 21.261 26.056 1.00 0.00 H
-ATOM 2995 1HG LYS C 60 6.991 22.443 24.391 1.00 0.00 H
-ATOM 2996 2HG LYS C 60 7.266 21.152 23.235 1.00 0.00 H
-ATOM 2997 1HD LYS C 60 6.333 19.563 25.063 1.00 0.00 H
-ATOM 2998 2HD LYS C 60 5.717 21.034 25.837 1.00 0.00 H
-ATOM 2999 1HE LYS C 60 5.121 20.146 22.980 1.00 0.00 H
-ATOM 3000 2HE LYS C 60 4.027 19.980 24.371 1.00 0.00 H
-ATOM 3001 1HZ LYS C 60 3.499 21.886 23.041 1.00 0.00 H
-ATOM 3002 2HZ LYS C 60 3.991 22.359 24.546 1.00 0.00 H
-ATOM 3003 3HZ LYS C 60 5.031 22.497 23.251 1.00 0.00 H
-ATOM 3004 N ALA C 61 9.399 24.140 23.929 1.00 46.44 N
-ATOM 3005 CA ALA C 61 9.392 25.563 24.247 1.00 43.34 C
-ATOM 3006 C ALA C 61 8.586 26.387 23.258 1.00 43.81 C
-ATOM 3007 O ALA C 61 8.510 26.062 22.070 1.00 44.14 O
-ATOM 3008 CB ALA C 61 10.811 26.108 24.303 1.00 35.62 C
-ATOM 3009 H ALA C 61 9.209 23.798 22.982 1.00 0.00 H
-ATOM 3010 HA ALA C 61 8.958 25.673 25.230 1.00 0.00 H
-ATOM 3011 1HB ALA C 61 10.782 27.152 24.597 1.00 0.00 H
-ATOM 3012 2HB ALA C 61 11.382 25.539 25.027 1.00 0.00 H
-ATOM 3013 3HB ALA C 61 11.280 26.020 23.330 1.00 0.00 H
-ATOM 3014 N TYR C 62 8.026 27.493 23.729 1.00 42.69 N
-ATOM 3015 CA TYR C 62 7.339 28.421 22.836 1.00 41.40 C
-ATOM 3016 C TYR C 62 8.333 29.474 22.397 1.00 42.17 C
-ATOM 3017 O TYR C 62 8.948 30.134 23.234 1.00 43.56 O
-ATOM 3018 CB TYR C 62 6.123 29.043 23.519 1.00 39.53 C
-ATOM 3019 CG TYR C 62 5.337 30.035 22.681 1.00 36.48 C
-ATOM 3020 CD1 TYR C 62 4.582 29.605 21.594 1.00 35.38 C
-ATOM 3021 CD2 TYR C 62 5.337 31.369 23.032 1.00 35.55 C
-ATOM 3022 CE1 TYR C 62 3.833 30.517 20.870 1.00 36.14 C
-ATOM 3023 CE2 TYR C 62 4.588 32.275 22.319 1.00 36.57 C
-ATOM 3024 CZ TYR C 62 3.837 31.855 21.247 1.00 39.16 C
-ATOM 3025 OH TYR C 62 3.071 32.761 20.558 1.00 45.76 O
-ATOM 3026 H TYR C 62 8.124 27.704 24.721 1.00 0.00 H
-ATOM 3027 HA TYR C 62 7.007 27.885 21.948 1.00 0.00 H
-ATOM 3028 1HB TYR C 62 5.441 28.261 23.827 1.00 0.00 H
-ATOM 3029 2HB TYR C 62 6.442 29.553 24.410 1.00 0.00 H
-ATOM 3030 HD1 TYR C 62 4.571 28.554 21.317 1.00 0.00 H
-ATOM 3031 HD2 TYR C 62 5.919 31.697 23.883 1.00 0.00 H
-ATOM 3032 HE1 TYR C 62 3.233 30.181 20.023 1.00 0.00 H
-ATOM 3033 HE2 TYR C 62 4.583 33.322 22.612 1.00 0.00 H
-ATOM 3034 HH TYR C 62 3.019 33.578 21.057 1.00 0.00 H
-ATOM 3035 N ILE C 63 8.530 29.609 21.090 1.00 39.49 N
-ATOM 3036 CA ILE C 63 9.536 30.528 20.597 1.00 39.77 C
-ATOM 3037 C ILE C 63 8.933 31.633 19.726 1.00 38.49 C
-ATOM 3038 O ILE C 63 8.168 31.363 18.795 1.00 40.08 O
-ATOM 3039 CB ILE C 63 10.569 29.758 19.764 1.00 47.08 C
-ATOM 3040 CG1 ILE C 63 11.189 28.638 20.591 1.00 42.16 C
-ATOM 3041 CG2 ILE C 63 11.663 30.705 19.295 1.00 39.85 C
-ATOM 3042 CD1 ILE C 63 11.991 27.683 19.762 1.00 34.45 C
-ATOM 3043 H ILE C 63 8.018 29.043 20.419 1.00 0.00 H
-ATOM 3044 HA ILE C 63 10.034 30.982 21.442 1.00 0.00 H
-ATOM 3045 HB ILE C 63 10.085 29.311 18.921 1.00 0.00 H
-ATOM 3046 1HG1 ILE C 63 11.822 29.063 21.350 1.00 0.00 H
-ATOM 3047 2HG1 ILE C 63 10.398 28.068 21.077 1.00 0.00 H
-ATOM 3048 1HG2 ILE C 63 12.375 30.145 18.715 1.00 0.00 H
-ATOM 3049 2HG2 ILE C 63 11.232 31.492 18.686 1.00 0.00 H
-ATOM 3050 3HG2 ILE C 63 12.160 31.151 20.156 1.00 0.00 H
-ATOM 3051 1HD1 ILE C 63 12.397 26.912 20.401 1.00 0.00 H
-ATOM 3052 2HD1 ILE C 63 11.347 27.227 19.006 1.00 0.00 H
-ATOM 3053 3HD1 ILE C 63 12.804 28.216 19.274 1.00 0.00 H
-ATOM 3054 N GLN C 64 9.278 32.885 20.023 1.00 37.97 N
-ATOM 3055 CA GLN C 64 8.803 33.988 19.202 1.00 38.05 C
-ATOM 3056 C GLN C 64 9.992 34.605 18.489 1.00 39.65 C
-ATOM 3057 O GLN C 64 11.022 34.882 19.113 1.00 39.82 O
-ATOM 3058 CB GLN C 64 8.146 35.079 20.048 1.00 30.64 C
-ATOM 3059 CG GLN C 64 7.006 34.615 20.941 1.00 35.74 C
-ATOM 3060 CD GLN C 64 6.398 35.750 21.750 1.00 46.43 C
-ATOM 3061 OE1 GLN C 64 7.079 36.431 22.517 1.00 45.64 O
-ATOM 3062 NE2 GLN C 64 5.101 35.949 21.575 1.00 44.38 N
-ATOM 3063 H GLN C 64 9.880 33.057 20.817 1.00 0.00 H
-ATOM 3064 HA GLN C 64 8.108 33.618 18.454 1.00 0.00 H
-ATOM 3065 1HB GLN C 64 8.886 35.603 20.609 1.00 0.00 H
-ATOM 3066 2HB GLN C 64 7.714 35.807 19.367 1.00 0.00 H
-ATOM 3067 1HG GLN C 64 6.229 34.169 20.337 1.00 0.00 H
-ATOM 3068 2HG GLN C 64 7.400 33.878 21.644 1.00 0.00 H
-ATOM 3069 1HE2 GLN C 64 4.630 36.676 22.083 1.00 0.00 H
-ATOM 3070 2HE2 GLN C 64 4.589 35.384 20.932 1.00 0.00 H
-ATOM 3071 N THR C 65 9.855 34.842 17.193 1.00 40.44 N
-ATOM 3072 CA THR C 65 10.918 35.478 16.434 1.00 38.31 C
-ATOM 3073 C THR C 65 10.309 36.569 15.571 1.00 39.50 C
-ATOM 3074 O THR C 65 9.091 36.712 15.476 1.00 40.57 O
-ATOM 3075 CB THR C 65 11.650 34.496 15.494 1.00 41.51 C
-ATOM 3076 OG1 THR C 65 10.803 34.194 14.384 1.00 36.87 O
-ATOM 3077 CG2 THR C 65 11.988 33.196 16.220 1.00 29.54 C
-ATOM 3078 H THR C 65 9.001 34.575 16.709 1.00 0.00 H
-ATOM 3079 HA THR C 65 11.634 35.935 17.116 1.00 0.00 H
-ATOM 3080 HB THR C 65 12.567 34.950 15.144 1.00 0.00 H
-ATOM 3081 HG1 THR C 65 9.957 33.847 14.722 1.00 0.00 H
-ATOM 3082 1HG2 THR C 65 12.501 32.521 15.537 1.00 0.00 H
-ATOM 3083 2HG2 THR C 65 12.631 33.404 17.072 1.00 0.00 H
-ATOM 3084 3HG2 THR C 65 11.071 32.725 16.564 1.00 0.00 H
-ATOM 3085 N ARG C 66 11.158 37.289 14.870 1.00 38.71 N
-ATOM 3086 CA ARG C 66 10.709 38.315 13.940 1.00 38.26 C
-ATOM 3087 C ARG C 66 9.816 37.760 12.822 1.00 41.69 C
-ATOM 3088 O ARG C 66 9.088 38.521 12.181 1.00 41.39 O
-ATOM 3089 CB ARG C 66 11.884 39.045 13.315 1.00 44.82 C
-ATOM 3090 CG ARG C 66 11.492 40.305 12.564 1.00 58.03 C
-ATOM 3091 CD ARG C 66 12.665 41.084 12.117 1.00 73.64 C
-ATOM 3092 NE ARG C 66 12.262 42.331 11.460 1.00 83.43 N
-ATOM 3093 CZ ARG C 66 12.022 42.465 10.146 1.00 88.31 C
-ATOM 3094 NH1 ARG C 66 12.164 41.437 9.358 1.00 82.32 N
-ATOM 3095 NH2 ARG C 66 11.646 43.633 9.648 1.00 82.28 N
-ATOM 3096 H ARG C 66 12.146 37.132 14.992 1.00 0.00 H
-ATOM 3097 HA ARG C 66 10.123 39.043 14.504 1.00 0.00 H
-ATOM 3098 1HB ARG C 66 12.628 39.300 14.069 1.00 0.00 H
-ATOM 3099 2HB ARG C 66 12.359 38.386 12.584 1.00 0.00 H
-ATOM 3100 1HG ARG C 66 10.893 40.046 11.689 1.00 0.00 H
-ATOM 3101 2HG ARG C 66 10.910 40.942 13.231 1.00 0.00 H
-ATOM 3102 1HD ARG C 66 13.281 41.340 12.984 1.00 0.00 H
-ATOM 3103 2HD ARG C 66 13.260 40.495 11.415 1.00 0.00 H
-ATOM 3104 HE ARG C 66 12.140 43.143 12.043 1.00 0.00 H
-ATOM 3105 1HH1 ARG C 66 12.458 40.549 9.743 1.00 0.00 H
-ATOM 3106 2HH1 ARG C 66 11.986 41.531 8.373 1.00 0.00 H
-ATOM 3107 1HH2 ARG C 66 11.535 44.432 10.255 1.00 0.00 H
-ATOM 3108 2HH2 ARG C 66 11.469 43.726 8.659 1.00 0.00 H
-ATOM 3109 N HIS C 67 9.905 36.453 12.534 1.00 40.86 N
-ATOM 3110 CA HIS C 67 9.180 35.882 11.408 1.00 41.31 C
-ATOM 3111 C HIS C 67 7.895 35.172 11.843 1.00 42.91 C
-ATOM 3112 O HIS C 67 7.284 34.451 11.051 1.00 45.91 O
-ATOM 3113 CB HIS C 67 10.052 34.859 10.673 1.00 34.66 C
-ATOM 3114 CG HIS C 67 11.345 35.407 10.196 1.00 30.35 C
-ATOM 3115 ND1 HIS C 67 11.474 36.670 9.655 1.00 33.12 N
-ATOM 3116 CD2 HIS C 67 12.570 34.849 10.149 1.00 28.68 C
-ATOM 3117 CE1 HIS C 67 12.735 36.865 9.323 1.00 33.65 C
-ATOM 3118 NE2 HIS C 67 13.414 35.773 9.601 1.00 42.05 N
-ATOM 3119 H HIS C 67 10.462 35.828 13.117 1.00 0.00 H
-ATOM 3120 HA HIS C 67 8.909 36.671 10.710 1.00 0.00 H
-ATOM 3121 1HB HIS C 67 10.259 34.011 11.333 1.00 0.00 H
-ATOM 3122 2HB HIS C 67 9.512 34.475 9.806 1.00 0.00 H
-ATOM 3123 HD2 HIS C 67 12.839 33.846 10.479 1.00 0.00 H
-ATOM 3124 HE1 HIS C 67 13.142 37.768 8.881 1.00 0.00 H
-ATOM 3125 HE2 HIS C 67 14.408 35.618 9.432 1.00 0.00 H
-ATOM 3126 N GLY C 68 7.488 35.358 13.099 1.00 41.76 N
-ATOM 3127 CA GLY C 68 6.302 34.679 13.611 1.00 39.71 C
-ATOM 3128 C GLY C 68 6.690 33.779 14.771 1.00 41.27 C
-ATOM 3129 O GLY C 68 7.712 34.011 15.423 1.00 42.17 O
-ATOM 3130 H GLY C 68 8.018 35.969 13.720 1.00 0.00 H
-ATOM 3131 1HA GLY C 68 5.569 35.415 13.944 1.00 0.00 H
-ATOM 3132 2HA GLY C 68 5.838 34.090 12.821 1.00 0.00 H
-ATOM 3133 N VAL C 69 5.877 32.769 15.058 1.00 40.83 N
-ATOM 3134 CA VAL C 69 6.179 31.925 16.209 1.00 41.76 C
-ATOM 3135 C VAL C 69 6.340 30.474 15.797 1.00 42.52 C
-ATOM 3136 O VAL C 69 5.906 30.073 14.713 1.00 43.09 O
-ATOM 3137 CB VAL C 69 5.074 32.041 17.273 1.00 43.48 C
-ATOM 3138 CG1 VAL C 69 4.948 33.491 17.722 1.00 26.57 C
-ATOM 3139 CG2 VAL C 69 3.764 31.517 16.720 1.00 35.18 C
-ATOM 3140 H VAL C 69 5.051 32.596 14.499 1.00 0.00 H
-ATOM 3141 HA VAL C 69 7.116 32.260 16.652 1.00 0.00 H
-ATOM 3142 HB VAL C 69 5.363 31.451 18.147 1.00 0.00 H
-ATOM 3143 1HG1 VAL C 69 4.190 33.572 18.491 1.00 0.00 H
-ATOM 3144 2HG1 VAL C 69 5.892 33.826 18.111 1.00 0.00 H
-ATOM 3145 3HG1 VAL C 69 4.666 34.114 16.879 1.00 0.00 H
-ATOM 3146 1HG2 VAL C 69 2.990 31.587 17.487 1.00 0.00 H
-ATOM 3147 2HG2 VAL C 69 3.469 32.106 15.854 1.00 0.00 H
-ATOM 3148 3HG2 VAL C 69 3.890 30.473 16.426 1.00 0.00 H
-ATOM 3149 N ILE C 70 7.005 29.705 16.650 1.00 43.31 N
-ATOM 3150 CA ILE C 70 7.226 28.286 16.405 1.00 43.11 C
-ATOM 3151 C ILE C 70 7.409 27.560 17.737 1.00 46.44 C
-ATOM 3152 O ILE C 70 7.866 28.159 18.705 1.00 46.93 O
-ATOM 3153 CB ILE C 70 8.458 28.103 15.487 1.00 41.28 C
-ATOM 3154 CG1 ILE C 70 8.535 26.683 14.948 1.00 43.43 C
-ATOM 3155 CG2 ILE C 70 9.732 28.436 16.263 1.00 32.04 C
-ATOM 3156 CD1 ILE C 70 9.471 26.566 13.769 1.00 35.70 C
-ATOM 3157 H ILE C 70 7.364 30.129 17.504 1.00 0.00 H
-ATOM 3158 HA ILE C 70 6.351 27.876 15.905 1.00 0.00 H
-ATOM 3159 HB ILE C 70 8.376 28.767 14.632 1.00 0.00 H
-ATOM 3160 1HG1 ILE C 70 8.886 26.012 15.734 1.00 0.00 H
-ATOM 3161 2HG1 ILE C 70 7.540 26.365 14.634 1.00 0.00 H
-ATOM 3162 1HG2 ILE C 70 10.598 28.318 15.622 1.00 0.00 H
-ATOM 3163 2HG2 ILE C 70 9.679 29.465 16.617 1.00 0.00 H
-ATOM 3164 3HG2 ILE C 70 9.815 27.756 17.110 1.00 0.00 H
-ATOM 3165 1HD1 ILE C 70 9.469 25.547 13.423 1.00 0.00 H
-ATOM 3166 2HD1 ILE C 70 9.127 27.217 12.965 1.00 0.00 H
-ATOM 3167 3HD1 ILE C 70 10.475 26.858 14.067 1.00 0.00 H
-ATOM 3168 N GLU C 71 7.035 26.287 17.807 1.00 45.83 N
-ATOM 3169 CA GLU C 71 7.301 25.545 19.039 1.00 43.92 C
-ATOM 3170 C GLU C 71 8.352 24.462 18.831 1.00 45.49 C
-ATOM 3171 O GLU C 71 8.321 23.734 17.829 1.00 44.53 O
-ATOM 3172 CB GLU C 71 6.020 24.904 19.604 1.00 35.87 C
-ATOM 3173 CG GLU C 71 4.978 25.899 20.120 1.00 44.07 C
-ATOM 3174 CD GLU C 71 3.727 25.237 20.696 1.00 52.30 C
-ATOM 3175 OE1 GLU C 71 3.836 24.185 21.296 1.00 52.96 O
-ATOM 3176 OE2 GLU C 71 2.666 25.789 20.529 1.00 51.78 O
-ATOM 3177 H GLU C 71 6.616 25.833 17.009 1.00 0.00 H
-ATOM 3178 HA GLU C 71 7.686 26.237 19.784 1.00 0.00 H
-ATOM 3179 1HB GLU C 71 5.547 24.287 18.842 1.00 0.00 H
-ATOM 3180 2HB GLU C 71 6.292 24.249 20.435 1.00 0.00 H
-ATOM 3181 1HG GLU C 71 5.447 26.480 20.908 1.00 0.00 H
-ATOM 3182 2HG GLU C 71 4.699 26.578 19.320 1.00 0.00 H
-ATOM 3183 N SER C 72 9.266 24.350 19.796 1.00 42.20 N
-ATOM 3184 CA SER C 72 10.287 23.301 19.802 1.00 44.59 C
-ATOM 3185 C SER C 72 9.728 22.139 20.595 1.00 47.43 C
-ATOM 3186 O SER C 72 8.746 22.329 21.318 1.00 45.56 O
-ATOM 3187 CB SER C 72 11.593 23.819 20.384 1.00 41.99 C
-ATOM 3188 OG SER C 72 11.460 24.139 21.733 1.00 42.26 O
-ATOM 3189 H SER C 72 9.211 24.999 20.579 1.00 0.00 H
-ATOM 3190 HA SER C 72 10.468 22.964 18.780 1.00 0.00 H
-ATOM 3191 1HB SER C 72 12.386 23.079 20.255 1.00 0.00 H
-ATOM 3192 2HB SER C 72 11.890 24.702 19.838 1.00 0.00 H
-ATOM 3193 HG SER C 72 11.652 23.325 22.244 1.00 0.00 H
-ATOM 3194 N GLU C 73 10.346 20.962 20.495 1.00 49.46 N
-ATOM 3195 CA GLU C 73 9.861 19.783 21.222 1.00 53.46 C
-ATOM 3196 C GLU C 73 10.958 19.057 22.010 1.00 56.19 C
-ATOM 3197 O GLU C 73 12.154 19.244 21.764 1.00 55.05 O
-ATOM 3198 CB GLU C 73 9.174 18.820 20.251 1.00 56.84 C
-ATOM 3199 CG GLU C 73 7.956 19.422 19.540 1.00 67.74 C
-ATOM 3200 CD GLU C 73 7.294 18.485 18.579 1.00 79.50 C
-ATOM 3201 OE1 GLU C 73 7.103 17.340 18.915 1.00 89.37 O
-ATOM 3202 OE2 GLU C 73 6.986 18.924 17.483 1.00 76.90 O
-ATOM 3203 H GLU C 73 11.155 20.880 19.879 1.00 0.00 H
-ATOM 3204 HA GLU C 73 9.107 20.111 21.934 1.00 0.00 H
-ATOM 3205 1HB GLU C 73 9.870 18.507 19.499 1.00 0.00 H
-ATOM 3206 2HB GLU C 73 8.854 17.928 20.790 1.00 0.00 H
-ATOM 3207 1HG GLU C 73 7.230 19.731 20.294 1.00 0.00 H
-ATOM 3208 2HG GLU C 73 8.269 20.310 18.997 1.00 0.00 H
-ATOM 3209 N GLY C 74 10.543 18.262 22.993 1.00 59.34 N
-ATOM 3210 CA GLY C 74 11.476 17.476 23.799 1.00 64.50 C
-ATOM 3211 C GLY C 74 11.505 16.015 23.384 1.00 69.16 C
-ATOM 3212 O GLY C 74 11.007 15.668 22.314 1.00 69.08 O
-ATOM 3213 H GLY C 74 9.552 18.168 23.164 1.00 0.00 H
-ATOM 3214 1HA GLY C 74 12.476 17.891 23.701 1.00 0.00 H
-ATOM 3215 2HA GLY C 74 11.198 17.547 24.848 1.00 0.00 H
-ATOM 3216 N LYS C 75 12.067 15.174 24.261 1.00 72.76 N
-ATOM 3217 CA LYS C 75 12.242 13.739 24.046 1.00 75.35 C
-ATOM 3218 C LYS C 75 13.261 13.496 22.938 1.00 76.88 C
-ATOM 3219 O LYS C 75 14.236 14.249 22.831 1.00 78.56 O
-ATOM 3220 OXT LYS C 75 13.288 12.395 22.384 1.00 0.00 O
-ATOM 3221 CB LYS C 75 10.905 13.045 23.736 1.00 74.42 C
-ATOM 3222 CG LYS C 75 10.990 11.518 23.621 1.00 76.10 C
-ATOM 3223 CD LYS C 75 9.604 10.890 23.426 1.00 76.24 C
-ATOM 3224 CE LYS C 75 9.696 9.375 23.296 1.00 66.64 C
-ATOM 3225 NZ LYS C 75 8.353 8.738 23.128 1.00 0.00 N
-ATOM 3226 H LYS C 75 12.422 15.564 25.122 1.00 0.00 H
-ATOM 3227 HA LYS C 75 12.645 13.294 24.958 1.00 0.00 H
-ATOM 3228 1HB LYS C 75 10.177 13.292 24.504 1.00 0.00 H
-ATOM 3229 2HB LYS C 75 10.512 13.391 22.786 1.00 0.00 H
-ATOM 3230 1HG LYS C 75 11.614 11.251 22.767 1.00 0.00 H
-ATOM 3231 2HG LYS C 75 11.445 11.107 24.522 1.00 0.00 H
-ATOM 3232 1HD LYS C 75 8.970 11.139 24.281 1.00 0.00 H
-ATOM 3233 2HD LYS C 75 9.143 11.299 22.527 1.00 0.00 H
-ATOM 3234 1HE LYS C 75 10.313 9.132 22.434 1.00 0.00 H
-ATOM 3235 2HE LYS C 75 10.168 8.973 24.193 1.00 0.00 H
-ATOM 3236 1HZ LYS C 75 8.463 7.737 23.047 1.00 0.00 H
-ATOM 3237 2HZ LYS C 75 7.776 8.949 23.931 1.00 0.00 H
-ATOM 3238 3HZ LYS C 75 7.910 9.096 22.294 1.00 0.00 H
-TER
-ATOM 3240 N SER D 7 21.075 42.241 10.425 1.00 43.46 N
-ATOM 3241 CA SER D 7 21.151 41.288 9.329 1.00 44.35 C
-ATOM 3242 C SER D 7 20.018 40.275 9.425 1.00 43.57 C
-ATOM 3243 O SER D 7 19.339 40.179 10.449 1.00 45.95 O
-ATOM 3244 CB SER D 7 22.487 40.574 9.352 1.00 44.62 C
-ATOM 3245 OG SER D 7 22.579 39.753 10.475 1.00 56.14 O
-ATOM 3246 1H SER D 7 21.218 43.179 10.078 1.00 0.00 H
-ATOM 3247 2H SER D 7 20.166 42.178 10.856 1.00 0.00 H
-ATOM 3248 3H SER D 7 21.786 42.026 11.110 1.00 0.00 H
-ATOM 3249 HA SER D 7 21.051 41.827 8.386 1.00 0.00 H
-ATOM 3250 1HB SER D 7 22.596 39.968 8.445 1.00 0.00 H
-ATOM 3251 2HB SER D 7 23.299 41.300 9.358 1.00 0.00 H
-ATOM 3252 HG SER D 7 21.860 39.117 10.382 1.00 0.00 H
-ATOM 3253 N ASP D 8 19.819 39.510 8.355 1.00 39.44 N
-ATOM 3254 CA ASP D 8 18.760 38.503 8.300 1.00 39.18 C
-ATOM 3255 C ASP D 8 19.116 37.194 8.978 1.00 38.63 C
-ATOM 3256 O ASP D 8 20.294 36.827 9.087 1.00 39.02 O
-ATOM 3257 CB ASP D 8 18.381 38.194 6.843 1.00 49.75 C
-ATOM 3258 CG ASP D 8 17.524 39.260 6.171 1.00 60.47 C
-ATOM 3259 OD1 ASP D 8 16.534 39.653 6.740 1.00 49.29 O
-ATOM 3260 OD2 ASP D 8 17.863 39.690 5.099 1.00 57.68 O
-ATOM 3261 H ASP D 8 20.415 39.625 7.547 1.00 0.00 H
-ATOM 3262 HA ASP D 8 17.880 38.908 8.803 1.00 0.00 H
-ATOM 3263 1HB ASP D 8 19.282 38.044 6.249 1.00 0.00 H
-ATOM 3264 2HB ASP D 8 17.821 37.257 6.818 1.00 0.00 H
-ATOM 3265 N PHE D 9 18.063 36.472 9.364 1.00 36.18 N
-ATOM 3266 CA PHE D 9 18.159 35.132 9.923 1.00 35.42 C
-ATOM 3267 C PHE D 9 17.001 34.288 9.452 1.00 32.78 C
-ATOM 3268 O PHE D 9 15.978 34.818 9.000 1.00 32.52 O
-ATOM 3269 CB PHE D 9 18.122 35.126 11.465 1.00 36.33 C
-ATOM 3270 CG PHE D 9 16.820 35.543 12.094 1.00 39.29 C
-ATOM 3271 CD1 PHE D 9 15.849 34.592 12.392 1.00 33.12 C
-ATOM 3272 CD2 PHE D 9 16.567 36.863 12.414 1.00 35.19 C
-ATOM 3273 CE1 PHE D 9 14.662 34.951 12.989 1.00 37.08 C
-ATOM 3274 CE2 PHE D 9 15.376 37.224 13.010 1.00 34.95 C
-ATOM 3275 CZ PHE D 9 14.426 36.265 13.296 1.00 38.34 C
-ATOM 3276 H PHE D 9 17.148 36.881 9.252 1.00 0.00 H
-ATOM 3277 HA PHE D 9 19.071 34.665 9.564 1.00 0.00 H
-ATOM 3278 1HB PHE D 9 18.344 34.127 11.826 1.00 0.00 H
-ATOM 3279 2HB PHE D 9 18.874 35.768 11.839 1.00 0.00 H
-ATOM 3280 HD1 PHE D 9 16.040 33.550 12.142 1.00 0.00 H
-ATOM 3281 HD2 PHE D 9 17.318 37.625 12.193 1.00 0.00 H
-ATOM 3282 HE1 PHE D 9 13.912 34.192 13.211 1.00 0.00 H
-ATOM 3283 HE2 PHE D 9 15.189 38.275 13.255 1.00 0.00 H
-ATOM 3284 HZ PHE D 9 13.501 36.549 13.756 1.00 0.00 H
-ATOM 3285 N VAL D 10 17.166 32.982 9.574 1.00 28.05 N
-ATOM 3286 CA VAL D 10 16.118 32.037 9.226 1.00 32.83 C
-ATOM 3287 C VAL D 10 15.896 31.068 10.386 1.00 34.11 C
-ATOM 3288 O VAL D 10 16.797 30.849 11.202 1.00 37.24 O
-ATOM 3289 CB VAL D 10 16.516 31.275 7.944 1.00 33.10 C
-ATOM 3290 CG1 VAL D 10 16.717 32.263 6.778 1.00 33.15 C
-ATOM 3291 CG2 VAL D 10 17.783 30.507 8.192 1.00 36.84 C
-ATOM 3292 H VAL D 10 18.060 32.647 9.929 1.00 0.00 H
-ATOM 3293 HA VAL D 10 15.190 32.582 9.043 1.00 0.00 H
-ATOM 3294 HB VAL D 10 15.713 30.590 7.673 1.00 0.00 H
-ATOM 3295 1HG1 VAL D 10 16.990 31.717 5.894 1.00 0.00 H
-ATOM 3296 2HG1 VAL D 10 15.796 32.814 6.599 1.00 0.00 H
-ATOM 3297 3HG1 VAL D 10 17.514 32.960 7.020 1.00 0.00 H
-ATOM 3298 1HG2 VAL D 10 18.059 29.957 7.289 1.00 0.00 H
-ATOM 3299 2HG2 VAL D 10 18.585 31.198 8.460 1.00 0.00 H
-ATOM 3300 3HG2 VAL D 10 17.616 29.816 9.008 1.00 0.00 H
-ATOM 3301 N VAL D 11 14.708 30.468 10.448 1.00 32.50 N
-ATOM 3302 CA VAL D 11 14.409 29.491 11.500 1.00 32.94 C
-ATOM 3303 C VAL D 11 14.192 28.115 10.892 1.00 34.25 C
-ATOM 3304 O VAL D 11 13.394 27.976 9.977 1.00 32.81 O
-ATOM 3305 CB VAL D 11 13.098 29.862 12.232 1.00 35.78 C
-ATOM 3306 CG1 VAL D 11 12.814 28.851 13.338 1.00 29.51 C
-ATOM 3307 CG2 VAL D 11 13.147 31.298 12.750 1.00 23.36 C
-ATOM 3308 H VAL D 11 13.998 30.709 9.762 1.00 0.00 H
-ATOM 3309 HA VAL D 11 15.232 29.449 12.204 1.00 0.00 H
-ATOM 3310 HB VAL D 11 12.293 29.765 11.546 1.00 0.00 H
-ATOM 3311 1HG1 VAL D 11 11.869 29.104 13.814 1.00 0.00 H
-ATOM 3312 2HG1 VAL D 11 12.746 27.850 12.913 1.00 0.00 H
-ATOM 3313 3HG1 VAL D 11 13.606 28.875 14.069 1.00 0.00 H
-ATOM 3314 1HG2 VAL D 11 12.197 31.537 13.238 1.00 0.00 H
-ATOM 3315 2HG2 VAL D 11 13.938 31.408 13.450 1.00 0.00 H
-ATOM 3316 3HG2 VAL D 11 13.305 31.979 11.918 1.00 0.00 H
-ATOM 3317 N ILE D 12 14.902 27.097 11.393 1.00 36.40 N
-ATOM 3318 CA ILE D 12 14.709 25.731 10.895 1.00 36.64 C
-ATOM 3319 C ILE D 12 14.284 24.773 12.007 1.00 38.51 C
-ATOM 3320 O ILE D 12 14.999 24.601 12.994 1.00 39.51 O
-ATOM 3321 CB ILE D 12 16.003 25.151 10.288 1.00 38.82 C
-ATOM 3322 CG1 ILE D 12 16.541 26.046 9.193 1.00 36.93 C
-ATOM 3323 CG2 ILE D 12 15.720 23.748 9.720 1.00 27.64 C
-ATOM 3324 CD1 ILE D 12 17.609 26.988 9.684 1.00 33.40 C
-ATOM 3325 H ILE D 12 15.568 27.276 12.128 1.00 0.00 H
-ATOM 3326 HA ILE D 12 13.929 25.735 10.139 1.00 0.00 H
-ATOM 3327 HB ILE D 12 16.766 25.082 11.059 1.00 0.00 H
-ATOM 3328 1HG1 ILE D 12 16.971 25.423 8.425 1.00 0.00 H
-ATOM 3329 2HG1 ILE D 12 15.730 26.628 8.759 1.00 0.00 H
-ATOM 3330 1HG2 ILE D 12 16.627 23.330 9.301 1.00 0.00 H
-ATOM 3331 2HG2 ILE D 12 15.362 23.093 10.516 1.00 0.00 H
-ATOM 3332 3HG2 ILE D 12 14.964 23.817 8.943 1.00 0.00 H
-ATOM 3333 1HD1 ILE D 12 17.971 27.579 8.852 1.00 0.00 H
-ATOM 3334 2HD1 ILE D 12 17.202 27.647 10.457 1.00 0.00 H
-ATOM 3335 3HD1 ILE D 12 18.420 26.413 10.101 1.00 0.00 H
-ATOM 3336 N LYS D 13 13.137 24.122 11.830 1.00 37.80 N
-ATOM 3337 CA LYS D 13 12.693 23.121 12.794 1.00 37.27 C
-ATOM 3338 C LYS D 13 12.770 21.721 12.243 1.00 38.41 C
-ATOM 3339 O LYS D 13 12.212 21.420 11.190 1.00 36.48 O
-ATOM 3340 CB LYS D 13 11.278 23.363 13.268 1.00 35.40 C
-ATOM 3341 CG LYS D 13 10.813 22.280 14.232 1.00 28.98 C
-ATOM 3342 CD LYS D 13 9.428 22.511 14.763 1.00 34.48 C
-ATOM 3343 CE LYS D 13 8.991 21.305 15.596 1.00 34.48 C
-ATOM 3344 NZ LYS D 13 7.657 21.491 16.191 1.00 34.21 N
-ATOM 3345 H LYS D 13 12.561 24.331 11.019 1.00 0.00 H
-ATOM 3346 HA LYS D 13 13.349 23.159 13.661 1.00 0.00 H
-ATOM 3347 1HB LYS D 13 11.246 24.309 13.781 1.00 0.00 H
-ATOM 3348 2HB LYS D 13 10.603 23.406 12.423 1.00 0.00 H
-ATOM 3349 1HG LYS D 13 10.818 21.324 13.714 1.00 0.00 H
-ATOM 3350 2HG LYS D 13 11.509 22.210 15.068 1.00 0.00 H
-ATOM 3351 1HD LYS D 13 9.419 23.402 15.397 1.00 0.00 H
-ATOM 3352 2HD LYS D 13 8.730 22.660 13.938 1.00 0.00 H
-ATOM 3353 1HE LYS D 13 8.972 20.423 14.956 1.00 0.00 H
-ATOM 3354 2HE LYS D 13 9.712 21.145 16.401 1.00 0.00 H
-ATOM 3355 1HZ LYS D 13 7.408 20.651 16.742 1.00 0.00 H
-ATOM 3356 2HZ LYS D 13 7.710 22.319 16.809 1.00 0.00 H
-ATOM 3357 3HZ LYS D 13 6.969 21.636 15.475 1.00 0.00 H
-ATOM 3358 N ALA D 14 13.452 20.840 12.951 1.00 40.23 N
-ATOM 3359 CA ALA D 14 13.576 19.474 12.468 1.00 42.70 C
-ATOM 3360 C ALA D 14 12.268 18.711 12.620 1.00 45.23 C
-ATOM 3361 O ALA D 14 11.727 18.588 13.724 1.00 45.51 O
-ATOM 3362 CB ALA D 14 14.661 18.765 13.232 1.00 33.48 C
-ATOM 3363 H ALA D 14 13.893 21.122 13.830 1.00 0.00 H
-ATOM 3364 HA ALA D 14 13.829 19.510 11.411 1.00 0.00 H
-ATOM 3365 1HB ALA D 14 14.773 17.746 12.870 1.00 0.00 H
-ATOM 3366 2HB ALA D 14 15.584 19.291 13.108 1.00 0.00 H
-ATOM 3367 3HB ALA D 14 14.384 18.760 14.270 1.00 0.00 H
-ATOM 3368 N LEU D 15 11.764 18.152 11.518 1.00 46.85 N
-ATOM 3369 CA LEU D 15 10.541 17.351 11.564 1.00 48.23 C
-ATOM 3370 C LEU D 15 10.876 15.863 11.618 1.00 51.18 C
-ATOM 3371 O LEU D 15 10.003 15.013 11.811 1.00 53.93 O
-ATOM 3372 CB LEU D 15 9.646 17.695 10.375 1.00 42.82 C
-ATOM 3373 CG LEU D 15 8.643 18.877 10.585 1.00 45.70 C
-ATOM 3374 CD1 LEU D 15 9.316 20.033 11.300 1.00 38.41 C
-ATOM 3375 CD2 LEU D 15 8.158 19.346 9.222 1.00 33.40 C
-ATOM 3376 H LEU D 15 12.228 18.275 10.615 1.00 0.00 H
-ATOM 3377 HA LEU D 15 9.997 17.605 12.472 1.00 0.00 H
-ATOM 3378 1HB LEU D 15 10.284 17.957 9.552 1.00 0.00 H
-ATOM 3379 2HB LEU D 15 9.073 16.810 10.102 1.00 0.00 H
-ATOM 3380 HG LEU D 15 7.802 18.540 11.188 1.00 0.00 H
-ATOM 3381 1HD1 LEU D 15 8.605 20.847 11.433 1.00 0.00 H
-ATOM 3382 2HD1 LEU D 15 9.665 19.703 12.273 1.00 0.00 H
-ATOM 3383 3HD1 LEU D 15 10.134 20.374 10.723 1.00 0.00 H
-ATOM 3384 1HD2 LEU D 15 7.452 20.166 9.340 1.00 0.00 H
-ATOM 3385 2HD2 LEU D 15 9.003 19.681 8.628 1.00 0.00 H
-ATOM 3386 3HD2 LEU D 15 7.670 18.534 8.720 1.00 0.00 H
-ATOM 3387 N GLU D 16 12.166 15.572 11.491 1.00 51.16 N
-ATOM 3388 CA GLU D 16 12.697 14.214 11.552 1.00 51.98 C
-ATOM 3389 C GLU D 16 14.114 14.238 12.113 1.00 53.04 C
-ATOM 3390 O GLU D 16 14.745 15.285 12.193 1.00 54.38 O
-ATOM 3391 CB GLU D 16 12.662 13.514 10.179 1.00 46.81 C
-ATOM 3392 CG GLU D 16 13.529 14.123 9.066 1.00 57.46 C
-ATOM 3393 CD GLU D 16 13.395 13.345 7.741 1.00 58.84 C
-ATOM 3394 OE1 GLU D 16 12.779 12.304 7.751 1.00 62.13 O
-ATOM 3395 OE2 GLU D 16 13.864 13.821 6.721 1.00 57.95 O
-ATOM 3396 H GLU D 16 12.804 16.337 11.331 1.00 0.00 H
-ATOM 3397 HA GLU D 16 12.079 13.633 12.235 1.00 0.00 H
-ATOM 3398 1HB GLU D 16 12.968 12.473 10.300 1.00 0.00 H
-ATOM 3399 2HB GLU D 16 11.637 13.507 9.810 1.00 0.00 H
-ATOM 3400 1HG GLU D 16 13.254 15.161 8.918 1.00 0.00 H
-ATOM 3401 2HG GLU D 16 14.571 14.099 9.387 1.00 0.00 H
-ATOM 3402 N ASP D 17 14.598 13.093 12.566 1.00 51.76 N
-ATOM 3403 CA ASP D 17 15.964 13.009 13.072 1.00 51.67 C
-ATOM 3404 C ASP D 17 16.990 13.250 11.969 1.00 51.06 C
-ATOM 3405 O ASP D 17 16.763 12.868 10.821 1.00 49.67 O
-ATOM 3406 CB ASP D 17 16.192 11.665 13.747 1.00 48.09 C
-ATOM 3407 CG ASP D 17 15.431 11.565 15.059 1.00 50.66 C
-ATOM 3408 OD1 ASP D 17 14.958 12.589 15.529 1.00 54.71 O
-ATOM 3409 OD2 ASP D 17 15.306 10.483 15.575 1.00 54.92 O
-ATOM 3410 H ASP D 17 14.029 12.261 12.513 1.00 0.00 H
-ATOM 3411 HA ASP D 17 16.095 13.775 13.817 1.00 0.00 H
-ATOM 3412 1HB ASP D 17 15.882 10.857 13.085 1.00 0.00 H
-ATOM 3413 2HB ASP D 17 17.259 11.541 13.951 1.00 0.00 H
-ATOM 3414 N GLY D 18 18.134 13.846 12.314 1.00 49.07 N
-ATOM 3415 CA GLY D 18 19.201 14.025 11.333 1.00 49.54 C
-ATOM 3416 C GLY D 18 19.025 15.150 10.299 1.00 49.67 C
-ATOM 3417 O GLY D 18 19.518 15.028 9.178 1.00 49.84 O
-ATOM 3418 H GLY D 18 18.298 14.143 13.284 1.00 0.00 H
-ATOM 3419 1HA GLY D 18 20.122 14.210 11.878 1.00 0.00 H
-ATOM 3420 2HA GLY D 18 19.346 13.083 10.808 1.00 0.00 H
-ATOM 3421 N VAL D 19 18.318 16.225 10.642 1.00 46.08 N
-ATOM 3422 CA VAL D 19 18.154 17.334 9.698 1.00 45.86 C
-ATOM 3423 C VAL D 19 19.419 18.167 9.684 1.00 44.40 C
-ATOM 3424 O VAL D 19 19.916 18.577 10.728 1.00 47.16 O
-ATOM 3425 CB VAL D 19 16.941 18.205 10.070 1.00 40.07 C
-ATOM 3426 CG1 VAL D 19 16.869 19.455 9.189 1.00 31.38 C
-ATOM 3427 CG2 VAL D 19 15.691 17.383 9.872 1.00 36.86 C
-ATOM 3428 H VAL D 19 17.932 16.304 11.579 1.00 0.00 H
-ATOM 3429 HA VAL D 19 17.990 16.927 8.701 1.00 0.00 H
-ATOM 3430 HB VAL D 19 17.023 18.506 11.100 1.00 0.00 H
-ATOM 3431 1HG1 VAL D 19 16.013 20.047 9.477 1.00 0.00 H
-ATOM 3432 2HG1 VAL D 19 17.774 20.047 9.322 1.00 0.00 H
-ATOM 3433 3HG1 VAL D 19 16.778 19.161 8.137 1.00 0.00 H
-ATOM 3434 1HG2 VAL D 19 14.822 17.955 10.138 1.00 0.00 H
-ATOM 3435 2HG2 VAL D 19 15.613 17.083 8.834 1.00 0.00 H
-ATOM 3436 3HG2 VAL D 19 15.751 16.506 10.488 1.00 0.00 H
-ATOM 3437 N ASN D 20 19.977 18.374 8.502 1.00 41.20 N
-ATOM 3438 CA ASN D 20 21.237 19.091 8.400 1.00 38.51 C
-ATOM 3439 C ASN D 20 21.076 20.500 7.872 1.00 39.82 C
-ATOM 3440 O ASN D 20 20.559 20.706 6.772 1.00 38.35 O
-ATOM 3441 CB ASN D 20 22.221 18.297 7.561 1.00 45.02 C
-ATOM 3442 CG ASN D 20 22.625 17.002 8.240 1.00 50.33 C
-ATOM 3443 OD1 ASN D 20 22.848 16.971 9.456 1.00 46.28 O
-ATOM 3444 ND2 ASN D 20 22.731 15.938 7.478 1.00 42.04 N
-ATOM 3445 H ASN D 20 19.510 18.038 7.664 1.00 0.00 H
-ATOM 3446 HA ASN D 20 21.660 19.183 9.399 1.00 0.00 H
-ATOM 3447 1HB ASN D 20 21.774 18.064 6.596 1.00 0.00 H
-ATOM 3448 2HB ASN D 20 23.113 18.896 7.374 1.00 0.00 H
-ATOM 3449 1HD2 ASN D 20 22.997 15.062 7.881 1.00 0.00 H
-ATOM 3450 2HD2 ASN D 20 22.552 16.000 6.498 1.00 0.00 H
-ATOM 3451 N VAL D 21 21.536 21.471 8.658 1.00 37.14 N
-ATOM 3452 CA VAL D 21 21.512 22.862 8.231 1.00 38.64 C
-ATOM 3453 C VAL D 21 22.948 23.261 7.924 1.00 39.02 C
-ATOM 3454 O VAL D 21 23.815 23.249 8.800 1.00 38.81 O
-ATOM 3455 CB VAL D 21 20.921 23.760 9.318 1.00 36.39 C
-ATOM 3456 CG1 VAL D 21 20.918 25.186 8.824 1.00 28.43 C
-ATOM 3457 CG2 VAL D 21 19.520 23.272 9.662 1.00 35.35 C
-ATOM 3458 H VAL D 21 21.914 21.234 9.577 1.00 0.00 H
-ATOM 3459 HA VAL D 21 20.916 22.957 7.322 1.00 0.00 H
-ATOM 3460 HB VAL D 21 21.552 23.720 10.201 1.00 0.00 H
-ATOM 3461 1HG1 VAL D 21 20.526 25.842 9.583 1.00 0.00 H
-ATOM 3462 2HG1 VAL D 21 21.937 25.487 8.585 1.00 0.00 H
-ATOM 3463 3HG1 VAL D 21 20.301 25.249 7.936 1.00 0.00 H
-ATOM 3464 1HG2 VAL D 21 19.092 23.901 10.436 1.00 0.00 H
-ATOM 3465 2HG2 VAL D 21 18.901 23.313 8.775 1.00 0.00 H
-ATOM 3466 3HG2 VAL D 21 19.570 22.241 10.024 1.00 0.00 H
-ATOM 3467 N ILE D 22 23.209 23.557 6.665 1.00 39.07 N
-ATOM 3468 CA ILE D 22 24.564 23.741 6.194 1.00 38.40 C
-ATOM 3469 C ILE D 22 24.925 25.172 5.856 1.00 39.00 C
-ATOM 3470 O ILE D 22 24.232 25.841 5.092 1.00 41.81 O
-ATOM 3471 CB ILE D 22 24.768 22.878 4.947 1.00 41.27 C
-ATOM 3472 CG1 ILE D 22 24.523 21.415 5.284 1.00 38.76 C
-ATOM 3473 CG2 ILE D 22 26.160 23.063 4.413 1.00 43.18 C
-ATOM 3474 CD1 ILE D 22 24.428 20.551 4.069 1.00 40.23 C
-ATOM 3475 H ILE D 22 22.457 23.586 5.997 1.00 0.00 H
-ATOM 3476 HA ILE D 22 25.234 23.395 6.964 1.00 0.00 H
-ATOM 3477 HB ILE D 22 24.051 23.161 4.197 1.00 0.00 H
-ATOM 3478 1HG1 ILE D 22 25.334 21.054 5.905 1.00 0.00 H
-ATOM 3479 2HG1 ILE D 22 23.589 21.323 5.839 1.00 0.00 H
-ATOM 3480 1HG2 ILE D 22 26.265 22.448 3.539 1.00 0.00 H
-ATOM 3481 2HG2 ILE D 22 26.326 24.100 4.148 1.00 0.00 H
-ATOM 3482 3HG2 ILE D 22 26.889 22.762 5.168 1.00 0.00 H
-ATOM 3483 1HD1 ILE D 22 24.251 19.517 4.366 1.00 0.00 H
-ATOM 3484 2HD1 ILE D 22 23.600 20.897 3.444 1.00 0.00 H
-ATOM 3485 3HD1 ILE D 22 25.354 20.614 3.511 1.00 0.00 H
-ATOM 3486 N GLY D 23 26.022 25.647 6.433 1.00 39.26 N
-ATOM 3487 CA GLY D 23 26.502 26.980 6.125 1.00 37.32 C
-ATOM 3488 C GLY D 23 27.462 26.908 4.945 1.00 35.86 C
-ATOM 3489 O GLY D 23 28.431 26.125 4.959 1.00 36.32 O
-ATOM 3490 H GLY D 23 26.547 25.049 7.063 1.00 0.00 H
-ATOM 3491 1HA GLY D 23 25.663 27.635 5.886 1.00 0.00 H
-ATOM 3492 2HA GLY D 23 27.009 27.399 6.994 1.00 0.00 H
-ATOM 3493 N LEU D 24 27.201 27.772 3.955 1.00 32.84 N
-ATOM 3494 CA LEU D 24 28.001 27.909 2.740 1.00 31.94 C
-ATOM 3495 C LEU D 24 28.834 29.178 2.807 1.00 33.64 C
-ATOM 3496 O LEU D 24 28.314 30.277 3.068 1.00 32.62 O
-ATOM 3497 CB LEU D 24 27.102 27.987 1.503 1.00 31.24 C
-ATOM 3498 CG LEU D 24 26.493 26.678 1.000 1.00 26.82 C
-ATOM 3499 CD1 LEU D 24 25.393 26.224 1.948 1.00 37.89 C
-ATOM 3500 CD2 LEU D 24 25.942 26.868 -0.409 1.00 32.71 C
-ATOM 3501 H LEU D 24 26.367 28.349 4.032 1.00 0.00 H
-ATOM 3502 HA LEU D 24 28.667 27.052 2.651 1.00 0.00 H
-ATOM 3503 1HB LEU D 24 26.296 28.635 1.756 1.00 0.00 H
-ATOM 3504 2HB LEU D 24 27.668 28.438 0.685 1.00 0.00 H
-ATOM 3505 HG LEU D 24 27.254 25.926 0.985 1.00 0.00 H
-ATOM 3506 1HD1 LEU D 24 24.986 25.285 1.592 1.00 0.00 H
-ATOM 3507 2HD1 LEU D 24 25.794 26.083 2.934 1.00 0.00 H
-ATOM 3508 3HD1 LEU D 24 24.603 26.973 1.986 1.00 0.00 H
-ATOM 3509 1HD2 LEU D 24 25.520 25.927 -0.765 1.00 0.00 H
-ATOM 3510 2HD2 LEU D 24 25.168 27.627 -0.404 1.00 0.00 H
-ATOM 3511 3HD2 LEU D 24 26.749 27.176 -1.077 1.00 0.00 H
-ATOM 3512 N THR D 25 30.128 29.018 2.549 1.00 35.97 N
-ATOM 3513 CA THR D 25 31.092 30.094 2.704 1.00 35.46 C
-ATOM 3514 C THR D 25 30.896 31.295 1.792 1.00 35.14 C
-ATOM 3515 O THR D 25 30.528 31.170 0.623 1.00 37.74 O
-ATOM 3516 CB THR D 25 32.511 29.563 2.482 1.00 31.83 C
-ATOM 3517 OG1 THR D 25 32.568 28.918 1.219 1.00 34.03 O
-ATOM 3518 CG2 THR D 25 32.912 28.603 3.553 1.00 29.66 C
-ATOM 3519 H THR D 25 30.466 28.092 2.295 1.00 0.00 H
-ATOM 3520 HA THR D 25 31.027 30.434 3.727 1.00 0.00 H
-ATOM 3521 HB THR D 25 33.206 30.403 2.479 1.00 0.00 H
-ATOM 3522 HG1 THR D 25 32.006 28.120 1.241 1.00 0.00 H
-ATOM 3523 1HG2 THR D 25 33.924 28.249 3.359 1.00 0.00 H
-ATOM 3524 2HG2 THR D 25 32.877 29.111 4.517 1.00 0.00 H
-ATOM 3525 3HG2 THR D 25 32.226 27.761 3.557 1.00 0.00 H
-ATOM 3526 N ARG D 26 31.190 32.464 2.361 1.00 34.79 N
-ATOM 3527 CA ARG D 26 31.160 33.747 1.670 1.00 35.53 C
-ATOM 3528 C ARG D 26 32.485 34.046 0.966 1.00 34.41 C
-ATOM 3529 O ARG D 26 33.550 33.960 1.577 1.00 32.86 O
-ATOM 3530 CB ARG D 26 30.863 34.872 2.662 1.00 25.88 C
-ATOM 3531 CG ARG D 26 30.666 36.251 2.034 1.00 24.06 C
-ATOM 3532 CD ARG D 26 30.419 37.324 3.051 1.00 31.34 C
-ATOM 3533 NE ARG D 26 29.219 37.093 3.846 1.00 35.90 N
-ATOM 3534 CZ ARG D 26 27.966 37.370 3.454 1.00 26.01 C
-ATOM 3535 NH1 ARG D 26 27.731 37.876 2.267 1.00 29.08 N
-ATOM 3536 NH2 ARG D 26 26.990 37.122 4.296 1.00 21.02 N
-ATOM 3537 H ARG D 26 31.429 32.448 3.350 1.00 0.00 H
-ATOM 3538 HA ARG D 26 30.371 33.715 0.919 1.00 0.00 H
-ATOM 3539 1HB ARG D 26 29.969 34.633 3.238 1.00 0.00 H
-ATOM 3540 2HB ARG D 26 31.688 34.952 3.374 1.00 0.00 H
-ATOM 3541 1HG ARG D 26 31.566 36.525 1.488 1.00 0.00 H
-ATOM 3542 2HG ARG D 26 29.821 36.223 1.348 1.00 0.00 H
-ATOM 3543 1HD ARG D 26 31.267 37.378 3.729 1.00 0.00 H
-ATOM 3544 2HD ARG D 26 30.307 38.278 2.543 1.00 0.00 H
-ATOM 3545 HE ARG D 26 29.319 36.715 4.797 1.00 0.00 H
-ATOM 3546 1HH1 ARG D 26 28.501 38.063 1.646 1.00 0.00 H
-ATOM 3547 2HH1 ARG D 26 26.785 38.086 1.983 1.00 0.00 H
-ATOM 3548 1HH2 ARG D 26 27.240 36.743 5.213 1.00 0.00 H
-ATOM 3549 2HH2 ARG D 26 26.014 37.294 4.054 1.00 0.00 H
-ATOM 3550 N GLY D 27 32.419 34.422 -0.310 1.00 32.19 N
-ATOM 3551 CA GLY D 27 33.623 34.763 -1.067 1.00 31.52 C
-ATOM 3552 C GLY D 27 33.664 34.050 -2.413 1.00 32.68 C
-ATOM 3553 O GLY D 27 32.768 33.275 -2.740 1.00 30.02 O
-ATOM 3554 H GLY D 27 31.520 34.463 -0.769 1.00 0.00 H
-ATOM 3555 1HA GLY D 27 33.655 35.839 -1.224 1.00 0.00 H
-ATOM 3556 2HA GLY D 27 34.506 34.499 -0.486 1.00 0.00 H
-ATOM 3557 N ALA D 28 34.707 34.324 -3.204 1.00 34.75 N
-ATOM 3558 CA ALA D 28 34.856 33.715 -4.526 1.00 33.81 C
-ATOM 3559 C ALA D 28 34.910 32.189 -4.431 1.00 34.19 C
-ATOM 3560 O ALA D 28 34.433 31.475 -5.303 1.00 37.22 O
-ATOM 3561 CB ALA D 28 36.112 34.226 -5.212 1.00 29.41 C
-ATOM 3562 H ALA D 28 35.410 34.974 -2.880 1.00 0.00 H
-ATOM 3563 HA ALA D 28 33.981 33.984 -5.125 1.00 0.00 H
-ATOM 3564 1HB ALA D 28 36.191 33.776 -6.199 1.00 0.00 H
-ATOM 3565 2HB ALA D 28 36.069 35.305 -5.310 1.00 0.00 H
-ATOM 3566 3HB ALA D 28 36.983 33.953 -4.619 1.00 0.00 H
-ATOM 3567 N ASP D 29 35.540 31.699 -3.364 1.00 31.09 N
-ATOM 3568 CA ASP D 29 35.631 30.262 -3.131 1.00 30.96 C
-ATOM 3569 C ASP D 29 34.430 29.815 -2.303 1.00 32.61 C
-ATOM 3570 O ASP D 29 34.355 30.117 -1.122 1.00 31.23 O
-ATOM 3571 CB ASP D 29 36.942 29.932 -2.388 1.00 24.33 C
-ATOM 3572 CG ASP D 29 37.154 28.423 -2.073 1.00 31.72 C
-ATOM 3573 OD1 ASP D 29 38.041 27.819 -2.632 1.00 38.44 O
-ATOM 3574 OD2 ASP D 29 36.459 27.908 -1.230 1.00 30.83 O
-ATOM 3575 H ASP D 29 35.928 32.335 -2.692 1.00 0.00 H
-ATOM 3576 HA ASP D 29 35.617 29.742 -4.083 1.00 0.00 H
-ATOM 3577 1HB ASP D 29 37.787 30.284 -2.979 1.00 0.00 H
-ATOM 3578 2HB ASP D 29 36.959 30.477 -1.443 1.00 0.00 H
-ATOM 3579 N THR D 30 33.502 29.082 -2.931 1.00 31.48 N
-ATOM 3580 CA THR D 30 32.306 28.667 -2.194 1.00 34.55 C
-ATOM 3581 C THR D 30 32.319 27.166 -1.914 1.00 35.80 C
-ATOM 3582 O THR D 30 32.438 26.342 -2.819 1.00 38.70 O
-ATOM 3583 CB THR D 30 31.010 29.028 -2.946 1.00 32.64 C
-ATOM 3584 OG1 THR D 30 30.929 30.447 -3.111 1.00 35.21 O
-ATOM 3585 CG2 THR D 30 29.793 28.551 -2.134 1.00 20.95 C
-ATOM 3586 H THR D 30 33.614 28.851 -3.901 1.00 0.00 H
-ATOM 3587 HA THR D 30 32.286 29.187 -1.244 1.00 0.00 H
-ATOM 3588 HB THR D 30 31.008 28.555 -3.924 1.00 0.00 H
-ATOM 3589 HG1 THR D 30 31.045 30.878 -2.251 1.00 0.00 H
-ATOM 3590 1HG2 THR D 30 28.877 28.812 -2.662 1.00 0.00 H
-ATOM 3591 2HG2 THR D 30 29.837 27.471 -2.004 1.00 0.00 H
-ATOM 3592 3HG2 THR D 30 29.800 29.037 -1.154 1.00 0.00 H
-ATOM 3593 N ARG D 31 32.174 26.838 -0.637 1.00 34.24 N
-ATOM 3594 CA ARG D 31 32.172 25.467 -0.150 1.00 32.48 C
-ATOM 3595 C ARG D 31 31.440 25.409 1.178 1.00 33.83 C
-ATOM 3596 O ARG D 31 31.089 26.449 1.737 1.00 34.60 O
-ATOM 3597 CB ARG D 31 33.592 24.947 0.035 1.00 23.20 C
-ATOM 3598 CG ARG D 31 34.401 25.639 1.133 1.00 37.64 C
-ATOM 3599 CD ARG D 31 35.785 25.062 1.258 1.00 38.61 C
-ATOM 3600 NE ARG D 31 36.678 25.423 0.146 1.00 39.02 N
-ATOM 3601 CZ ARG D 31 37.817 24.762 -0.168 1.00 31.04 C
-ATOM 3602 NH1 ARG D 31 38.179 23.699 0.536 1.00 26.55 N
-ATOM 3603 NH2 ARG D 31 38.571 25.179 -1.178 1.00 37.96 N
-ATOM 3604 H ARG D 31 32.113 27.590 0.032 1.00 0.00 H
-ATOM 3605 HA ARG D 31 31.650 24.834 -0.867 1.00 0.00 H
-ATOM 3606 1HB ARG D 31 33.564 23.887 0.275 1.00 0.00 H
-ATOM 3607 2HB ARG D 31 34.146 25.061 -0.897 1.00 0.00 H
-ATOM 3608 1HG ARG D 31 34.499 26.704 0.892 1.00 0.00 H
-ATOM 3609 2HG ARG D 31 33.890 25.528 2.091 1.00 0.00 H
-ATOM 3610 1HD ARG D 31 36.236 25.416 2.182 1.00 0.00 H
-ATOM 3611 2HD ARG D 31 35.710 23.976 1.289 1.00 0.00 H
-ATOM 3612 HE ARG D 31 36.451 26.258 -0.420 1.00 0.00 H
-ATOM 3613 1HH1 ARG D 31 37.608 23.384 1.307 1.00 0.00 H
-ATOM 3614 2HH1 ARG D 31 39.031 23.207 0.305 1.00 0.00 H
-ATOM 3615 1HH2 ARG D 31 38.295 26.019 -1.723 1.00 0.00 H
-ATOM 3616 2HH2 ARG D 31 39.417 24.691 -1.412 1.00 0.00 H
-ATOM 3617 N PHE D 32 31.178 24.202 1.669 1.00 35.43 N
-ATOM 3618 CA PHE D 32 30.524 24.061 2.968 1.00 38.14 C
-ATOM 3619 C PHE D 32 31.539 24.300 4.075 1.00 42.55 C
-ATOM 3620 O PHE D 32 32.685 23.868 3.956 1.00 44.97 O
-ATOM 3621 CB PHE D 32 29.970 22.645 3.139 1.00 31.32 C
-ATOM 3622 CG PHE D 32 28.828 22.314 2.252 1.00 32.95 C
-ATOM 3623 CD1 PHE D 32 28.234 23.286 1.485 1.00 39.61 C
-ATOM 3624 CD2 PHE D 32 28.343 21.012 2.180 1.00 39.00 C
-ATOM 3625 CE1 PHE D 32 27.174 22.977 0.656 1.00 44.17 C
-ATOM 3626 CE2 PHE D 32 27.284 20.700 1.355 1.00 45.12 C
-ATOM 3627 CZ PHE D 32 26.700 21.687 0.592 1.00 35.27 C
-ATOM 3628 H PHE D 32 31.455 23.375 1.157 1.00 0.00 H
-ATOM 3629 HA PHE D 32 29.720 24.793 3.053 1.00 0.00 H
-ATOM 3630 1HB PHE D 32 30.761 21.923 2.956 1.00 0.00 H
-ATOM 3631 2HB PHE D 32 29.645 22.515 4.173 1.00 0.00 H
-ATOM 3632 HD1 PHE D 32 28.615 24.299 1.540 1.00 0.00 H
-ATOM 3633 HD2 PHE D 32 28.809 20.235 2.786 1.00 0.00 H
-ATOM 3634 HE1 PHE D 32 26.709 23.751 0.044 1.00 0.00 H
-ATOM 3635 HE2 PHE D 32 26.912 19.676 1.304 1.00 0.00 H
-ATOM 3636 HZ PHE D 32 25.868 21.450 -0.064 1.00 0.00 H
-ATOM 3637 N HIS D 33 31.122 24.942 5.166 1.00 41.40 N
-ATOM 3638 CA HIS D 33 32.036 25.079 6.300 1.00 43.35 C
-ATOM 3639 C HIS D 33 31.474 24.456 7.574 1.00 45.16 C
-ATOM 3640 O HIS D 33 32.232 24.073 8.465 1.00 47.98 O
-ATOM 3641 CB HIS D 33 32.388 26.543 6.566 1.00 36.79 C
-ATOM 3642 CG HIS D 33 31.252 27.398 7.034 1.00 45.42 C
-ATOM 3643 ND1 HIS D 33 30.835 27.392 8.338 1.00 36.24 N
-ATOM 3644 CD2 HIS D 33 30.454 28.288 6.393 1.00 45.54 C
-ATOM 3645 CE1 HIS D 33 29.842 28.233 8.489 1.00 37.43 C
-ATOM 3646 NE2 HIS D 33 29.589 28.792 7.330 1.00 44.03 N
-ATOM 3647 H HIS D 33 30.179 25.322 5.197 1.00 0.00 H
-ATOM 3648 HA HIS D 33 32.965 24.558 6.079 1.00 0.00 H
-ATOM 3649 1HB HIS D 33 33.168 26.586 7.329 1.00 0.00 H
-ATOM 3650 2HB HIS D 33 32.801 26.968 5.679 1.00 0.00 H
-ATOM 3651 HD2 HIS D 33 30.489 28.560 5.346 1.00 0.00 H
-ATOM 3652 HE1 HIS D 33 29.319 28.431 9.424 1.00 0.00 H
-ATOM 3653 HE2 HIS D 33 28.870 29.484 7.183 1.00 0.00 H
-ATOM 3654 N HIS D 34 30.151 24.327 7.654 1.00 41.01 N
-ATOM 3655 CA HIS D 34 29.541 23.775 8.867 1.00 40.83 C
-ATOM 3656 C HIS D 34 28.190 23.146 8.616 1.00 39.25 C
-ATOM 3657 O HIS D 34 27.370 23.672 7.872 1.00 36.62 O
-ATOM 3658 CB HIS D 34 29.387 24.834 9.966 1.00 41.27 C
-ATOM 3659 CG HIS D 34 28.833 24.281 11.265 1.00 49.01 C
-ATOM 3660 ND1 HIS D 34 29.573 23.479 12.111 1.00 41.42 N
-ATOM 3661 CD2 HIS D 34 27.613 24.423 11.851 1.00 48.76 C
-ATOM 3662 CE1 HIS D 34 28.830 23.149 13.162 1.00 34.70 C
-ATOM 3663 NE2 HIS D 34 27.640 23.710 13.026 1.00 45.07 N
-ATOM 3664 H HIS D 34 29.573 24.669 6.889 1.00 0.00 H
-ATOM 3665 HA HIS D 34 30.187 22.991 9.261 1.00 0.00 H
-ATOM 3666 1HB HIS D 34 30.358 25.285 10.178 1.00 0.00 H
-ATOM 3667 2HB HIS D 34 28.725 25.625 9.618 1.00 0.00 H
-ATOM 3668 HD2 HIS D 34 26.768 24.991 11.464 1.00 0.00 H
-ATOM 3669 HE1 HIS D 34 29.147 22.523 13.995 1.00 0.00 H
-ATOM 3670 HE2 HIS D 34 26.853 23.628 13.691 1.00 0.00 H
-ATOM 3671 N SER D 35 27.945 22.020 9.274 1.00 38.43 N
-ATOM 3672 CA SER D 35 26.655 21.352 9.170 1.00 38.72 C
-ATOM 3673 C SER D 35 26.085 21.078 10.554 1.00 39.18 C
-ATOM 3674 O SER D 35 26.615 20.258 11.306 1.00 39.23 O
-ATOM 3675 CB SER D 35 26.801 20.059 8.393 1.00 38.15 C
-ATOM 3676 OG SER D 35 25.592 19.367 8.351 1.00 50.79 O
-ATOM 3677 H SER D 35 28.659 21.631 9.872 1.00 0.00 H
-ATOM 3678 HA SER D 35 25.961 22.000 8.644 1.00 0.00 H
-ATOM 3679 1HB SER D 35 27.125 20.289 7.378 1.00 0.00 H
-ATOM 3680 2HB SER D 35 27.568 19.434 8.849 1.00 0.00 H
-ATOM 3681 HG SER D 35 24.921 20.039 8.207 1.00 0.00 H
-ATOM 3682 N GLU D 36 25.014 21.791 10.895 1.00 39.17 N
-ATOM 3683 CA GLU D 36 24.411 21.659 12.208 1.00 40.46 C
-ATOM 3684 C GLU D 36 23.342 20.583 12.160 1.00 41.65 C
-ATOM 3685 O GLU D 36 22.383 20.676 11.391 1.00 41.08 O
-ATOM 3686 CB GLU D 36 23.818 22.991 12.690 1.00 35.44 C
-ATOM 3687 CG GLU D 36 23.297 22.961 14.139 1.00 36.50 C
-ATOM 3688 CD GLU D 36 24.408 22.812 15.165 1.00 44.62 C
-ATOM 3689 OE1 GLU D 36 25.503 23.275 14.918 1.00 38.71 O
-ATOM 3690 OE2 GLU D 36 24.160 22.232 16.207 1.00 39.04 O
-ATOM 3691 H GLU D 36 24.614 22.436 10.221 1.00 0.00 H
-ATOM 3692 HA GLU D 36 25.176 21.347 12.917 1.00 0.00 H
-ATOM 3693 1HB GLU D 36 24.567 23.776 12.615 1.00 0.00 H
-ATOM 3694 2HB GLU D 36 22.988 23.270 12.044 1.00 0.00 H
-ATOM 3695 1HG GLU D 36 22.773 23.889 14.349 1.00 0.00 H
-ATOM 3696 2HG GLU D 36 22.586 22.142 14.247 1.00 0.00 H
-ATOM 3697 N LYS D 37 23.540 19.529 12.941 1.00 42.08 N
-ATOM 3698 CA LYS D 37 22.609 18.413 12.939 1.00 42.74 C
-ATOM 3699 C LYS D 37 21.496 18.652 13.950 1.00 41.93 C
-ATOM 3700 O LYS D 37 21.758 18.857 15.139 1.00 36.64 O
-ATOM 3701 CB LYS D 37 23.352 17.110 13.250 1.00 43.78 C
-ATOM 3702 CG LYS D 37 22.504 15.840 13.178 1.00 40.91 C
-ATOM 3703 CD LYS D 37 23.359 14.597 13.491 1.00 46.52 C
-ATOM 3704 CE LYS D 37 22.541 13.312 13.432 1.00 49.42 C
-ATOM 3705 NZ LYS D 37 23.349 12.113 13.802 1.00 45.00 N
-ATOM 3706 H LYS D 37 24.352 19.509 13.543 1.00 0.00 H
-ATOM 3707 HA LYS D 37 22.159 18.331 11.950 1.00 0.00 H
-ATOM 3708 1HB LYS D 37 24.172 16.993 12.537 1.00 0.00 H
-ATOM 3709 2HB LYS D 37 23.791 17.168 14.244 1.00 0.00 H
-ATOM 3710 1HG LYS D 37 21.673 15.901 13.891 1.00 0.00 H
-ATOM 3711 2HG LYS D 37 22.086 15.748 12.172 1.00 0.00 H
-ATOM 3712 1HD LYS D 37 24.176 14.530 12.771 1.00 0.00 H
-ATOM 3713 2HD LYS D 37 23.785 14.697 14.490 1.00 0.00 H
-ATOM 3714 1HE LYS D 37 21.692 13.394 14.116 1.00 0.00 H
-ATOM 3715 2HE LYS D 37 22.169 13.179 12.419 1.00 0.00 H
-ATOM 3716 1HZ LYS D 37 22.764 11.291 13.745 1.00 0.00 H
-ATOM 3717 2HZ LYS D 37 24.132 12.016 13.169 1.00 0.00 H
-ATOM 3718 3HZ LYS D 37 23.688 12.218 14.747 1.00 0.00 H
-ATOM 3719 N LEU D 38 20.258 18.653 13.468 1.00 42.38 N
-ATOM 3720 CA LEU D 38 19.092 18.866 14.307 1.00 39.69 C
-ATOM 3721 C LEU D 38 18.266 17.587 14.345 1.00 41.35 C
-ATOM 3722 O LEU D 38 17.907 17.046 13.297 1.00 38.14 O
-ATOM 3723 CB LEU D 38 18.207 19.984 13.736 1.00 44.26 C
-ATOM 3724 CG LEU D 38 18.847 21.331 13.470 1.00 47.99 C
-ATOM 3725 CD1 LEU D 38 17.776 22.263 12.876 1.00 40.45 C
-ATOM 3726 CD2 LEU D 38 19.429 21.876 14.736 1.00 44.48 C
-ATOM 3727 H LEU D 38 20.122 18.502 12.477 1.00 0.00 H
-ATOM 3728 HA LEU D 38 19.409 19.112 15.320 1.00 0.00 H
-ATOM 3729 1HB LEU D 38 17.827 19.646 12.794 1.00 0.00 H
-ATOM 3730 2HB LEU D 38 17.371 20.142 14.412 1.00 0.00 H
-ATOM 3731 HG LEU D 38 19.646 21.212 12.730 1.00 0.00 H
-ATOM 3732 1HD1 LEU D 38 18.213 23.224 12.654 1.00 0.00 H
-ATOM 3733 2HD1 LEU D 38 17.384 21.824 11.959 1.00 0.00 H
-ATOM 3734 3HD1 LEU D 38 16.959 22.392 13.595 1.00 0.00 H
-ATOM 3735 1HD2 LEU D 38 19.905 22.825 14.541 1.00 0.00 H
-ATOM 3736 2HD2 LEU D 38 18.639 22.002 15.480 1.00 0.00 H
-ATOM 3737 3HD2 LEU D 38 20.172 21.175 15.103 1.00 0.00 H
-ATOM 3738 N ASP D 39 17.957 17.098 15.529 1.00 40.61 N
-ATOM 3739 CA ASP D 39 17.123 15.904 15.608 1.00 41.67 C
-ATOM 3740 C ASP D 39 15.674 16.334 15.732 1.00 42.94 C
-ATOM 3741 O ASP D 39 15.421 17.519 15.957 1.00 41.44 O
-ATOM 3742 CB ASP D 39 17.595 14.952 16.694 1.00 56.25 C
-ATOM 3743 CG ASP D 39 18.904 14.215 16.268 1.00 51.32 C
-ATOM 3744 OD1 ASP D 39 19.152 14.083 15.060 1.00 50.41 O
-ATOM 3745 OD2 ASP D 39 19.631 13.791 17.137 1.00 55.20 O
-ATOM 3746 H ASP D 39 18.280 17.574 16.375 1.00 0.00 H
-ATOM 3747 HA ASP D 39 17.222 15.372 14.672 1.00 0.00 H
-ATOM 3748 1HB ASP D 39 17.783 15.508 17.616 1.00 0.00 H
-ATOM 3749 2HB ASP D 39 16.813 14.213 16.898 1.00 0.00 H
-ATOM 3750 N LYS D 40 14.731 15.417 15.534 1.00 44.32 N
-ATOM 3751 CA LYS D 40 13.331 15.811 15.511 1.00 44.06 C
-ATOM 3752 C LYS D 40 12.974 16.637 16.725 1.00 43.24 C
-ATOM 3753 O LYS D 40 13.236 16.236 17.859 1.00 41.30 O
-ATOM 3754 CB LYS D 40 12.423 14.584 15.442 1.00 49.20 C
-ATOM 3755 CG LYS D 40 10.942 14.896 15.298 1.00 45.71 C
-ATOM 3756 CD LYS D 40 10.134 13.624 15.109 1.00 44.39 C
-ATOM 3757 CE LYS D 40 8.659 13.924 14.911 1.00 56.77 C
-ATOM 3758 NZ LYS D 40 7.867 12.680 14.707 1.00 63.29 N
-ATOM 3759 H LYS D 40 14.967 14.431 15.387 1.00 0.00 H
-ATOM 3760 HA LYS D 40 13.158 16.420 14.622 1.00 0.00 H
-ATOM 3761 1HB LYS D 40 12.719 13.952 14.617 1.00 0.00 H
-ATOM 3762 2HB LYS D 40 12.551 13.995 16.349 1.00 0.00 H
-ATOM 3763 1HG LYS D 40 10.584 15.418 16.187 1.00 0.00 H
-ATOM 3764 2HG LYS D 40 10.796 15.545 14.440 1.00 0.00 H
-ATOM 3765 1HD LYS D 40 10.506 13.093 14.231 1.00 0.00 H
-ATOM 3766 2HD LYS D 40 10.257 12.983 15.980 1.00 0.00 H
-ATOM 3767 1HE LYS D 40 8.280 14.446 15.789 1.00 0.00 H
-ATOM 3768 2HE LYS D 40 8.540 14.566 14.037 1.00 0.00 H
-ATOM 3769 1HZ LYS D 40 6.896 12.918 14.579 1.00 0.00 H
-ATOM 3770 2HZ LYS D 40 8.206 12.196 13.887 1.00 0.00 H
-ATOM 3771 3HZ LYS D 40 7.964 12.083 15.515 1.00 0.00 H
-ATOM 3772 N GLY D 41 12.360 17.790 16.480 1.00 42.79 N
-ATOM 3773 CA GLY D 41 11.936 18.690 17.539 1.00 39.54 C
-ATOM 3774 C GLY D 41 12.914 19.831 17.836 1.00 39.53 C
-ATOM 3775 O GLY D 41 12.553 20.790 18.523 1.00 37.35 O
-ATOM 3776 H GLY D 41 12.184 18.059 15.513 1.00 0.00 H
-ATOM 3777 1HA GLY D 41 10.960 19.104 17.285 1.00 0.00 H
-ATOM 3778 2HA GLY D 41 11.799 18.106 18.447 1.00 0.00 H
-ATOM 3779 N GLU D 42 14.145 19.757 17.335 1.00 38.31 N
-ATOM 3780 CA GLU D 42 15.082 20.847 17.614 1.00 38.91 C
-ATOM 3781 C GLU D 42 14.858 22.034 16.686 1.00 37.30 C
-ATOM 3782 O GLU D 42 14.575 21.874 15.492 1.00 40.02 O
-ATOM 3783 CB GLU D 42 16.546 20.372 17.552 1.00 44.88 C
-ATOM 3784 CG GLU D 42 16.938 19.406 18.688 1.00 48.40 C
-ATOM 3785 CD GLU D 42 18.423 19.039 18.735 1.00 54.97 C
-ATOM 3786 OE1 GLU D 42 18.945 18.555 17.763 1.00 42.96 O
-ATOM 3787 OE2 GLU D 42 19.031 19.239 19.770 1.00 51.27 O
-ATOM 3788 H GLU D 42 14.436 18.949 16.786 1.00 0.00 H
-ATOM 3789 HA GLU D 42 14.902 21.194 18.634 1.00 0.00 H
-ATOM 3790 1HB GLU D 42 16.715 19.848 16.614 1.00 0.00 H
-ATOM 3791 2HB GLU D 42 17.218 21.231 17.581 1.00 0.00 H
-ATOM 3792 1HG GLU D 42 16.660 19.869 19.637 1.00 0.00 H
-ATOM 3793 2HG GLU D 42 16.351 18.495 18.574 1.00 0.00 H
-ATOM 3794 N VAL D 43 14.994 23.241 17.244 1.00 35.58 N
-ATOM 3795 CA VAL D 43 14.832 24.459 16.449 1.00 36.37 C
-ATOM 3796 C VAL D 43 16.114 25.276 16.400 1.00 38.52 C
-ATOM 3797 O VAL D 43 16.711 25.577 17.431 1.00 39.20 O
-ATOM 3798 CB VAL D 43 13.685 25.340 17.012 1.00 34.33 C
-ATOM 3799 CG1 VAL D 43 13.579 26.641 16.208 1.00 20.33 C
-ATOM 3800 CG2 VAL D 43 12.360 24.580 16.925 1.00 29.78 C
-ATOM 3801 H VAL D 43 15.216 23.310 18.239 1.00 0.00 H
-ATOM 3802 HA VAL D 43 14.571 24.175 15.433 1.00 0.00 H
-ATOM 3803 HB VAL D 43 13.900 25.591 18.049 1.00 0.00 H
-ATOM 3804 1HG1 VAL D 43 12.776 27.258 16.607 1.00 0.00 H
-ATOM 3805 2HG1 VAL D 43 14.519 27.190 16.271 1.00 0.00 H
-ATOM 3806 3HG1 VAL D 43 13.368 26.399 15.164 1.00 0.00 H
-ATOM 3807 1HG2 VAL D 43 11.553 25.196 17.323 1.00 0.00 H
-ATOM 3808 2HG2 VAL D 43 12.161 24.352 15.895 1.00 0.00 H
-ATOM 3809 3HG2 VAL D 43 12.429 23.655 17.495 1.00 0.00 H
-ATOM 3810 N LEU D 44 16.539 25.619 15.189 1.00 33.64 N
-ATOM 3811 CA LEU D 44 17.738 26.426 15.001 1.00 34.02 C
-ATOM 3812 C LEU D 44 17.417 27.757 14.357 1.00 35.19 C
-ATOM 3813 O LEU D 44 16.795 27.812 13.300 1.00 36.48 O
-ATOM 3814 CB LEU D 44 18.738 25.696 14.112 1.00 33.97 C
-ATOM 3815 CG LEU D 44 20.035 26.451 13.782 1.00 38.15 C
-ATOM 3816 CD1 LEU D 44 20.871 26.644 15.060 1.00 31.89 C
-ATOM 3817 CD2 LEU D 44 20.796 25.666 12.735 1.00 30.07 C
-ATOM 3818 H LEU D 44 16.012 25.310 14.378 1.00 0.00 H
-ATOM 3819 HA LEU D 44 18.191 26.616 15.969 1.00 0.00 H
-ATOM 3820 1HB LEU D 44 19.007 24.787 14.605 1.00 0.00 H
-ATOM 3821 2HB LEU D 44 18.249 25.458 13.170 1.00 0.00 H
-ATOM 3822 HG LEU D 44 19.791 27.439 13.388 1.00 0.00 H
-ATOM 3823 1HD1 LEU D 44 21.782 27.183 14.818 1.00 0.00 H
-ATOM 3824 2HD1 LEU D 44 20.299 27.214 15.792 1.00 0.00 H
-ATOM 3825 3HD1 LEU D 44 21.128 25.671 15.477 1.00 0.00 H
-ATOM 3826 1HD2 LEU D 44 21.716 26.191 12.475 1.00 0.00 H
-ATOM 3827 2HD2 LEU D 44 21.037 24.683 13.119 1.00 0.00 H
-ATOM 3828 3HD2 LEU D 44 20.178 25.563 11.855 1.00 0.00 H
-ATOM 3829 N ILE D 45 17.823 28.833 15.005 1.00 34.51 N
-ATOM 3830 CA ILE D 45 17.600 30.154 14.461 1.00 33.58 C
-ATOM 3831 C ILE D 45 18.971 30.716 14.119 1.00 35.38 C
-ATOM 3832 O ILE D 45 19.822 30.845 14.997 1.00 35.65 O
-ATOM 3833 CB ILE D 45 16.889 31.047 15.476 1.00 29.87 C
-ATOM 3834 CG1 ILE D 45 15.587 30.372 15.901 1.00 32.88 C
-ATOM 3835 CG2 ILE D 45 16.580 32.348 14.787 1.00 31.76 C
-ATOM 3836 CD1 ILE D 45 14.890 31.016 17.035 1.00 43.26 C
-ATOM 3837 H ILE D 45 18.299 28.735 15.893 1.00 0.00 H
-ATOM 3838 HA ILE D 45 17.008 30.090 13.555 1.00 0.00 H
-ATOM 3839 HB ILE D 45 17.509 31.206 16.357 1.00 0.00 H
-ATOM 3840 1HG1 ILE D 45 14.929 30.356 15.067 1.00 0.00 H
-ATOM 3841 2HG1 ILE D 45 15.805 29.346 16.188 1.00 0.00 H
-ATOM 3842 1HG2 ILE D 45 16.048 33.018 15.458 1.00 0.00 H
-ATOM 3843 2HG2 ILE D 45 17.505 32.813 14.455 1.00 0.00 H
-ATOM 3844 3HG2 ILE D 45 15.970 32.138 13.926 1.00 0.00 H
-ATOM 3845 1HD1 ILE D 45 13.990 30.459 17.246 1.00 0.00 H
-ATOM 3846 2HD1 ILE D 45 15.536 31.021 17.917 1.00 0.00 H
-ATOM 3847 3HD1 ILE D 45 14.634 32.026 16.764 1.00 0.00 H
-ATOM 3848 N ALA D 46 19.214 31.026 12.851 1.00 35.14 N
-ATOM 3849 CA ALA D 46 20.584 31.400 12.506 1.00 35.10 C
-ATOM 3850 C ALA D 46 20.687 32.545 11.522 1.00 35.88 C
-ATOM 3851 O ALA D 46 19.926 32.639 10.556 1.00 38.04 O
-ATOM 3852 CB ALA D 46 21.287 30.181 11.923 1.00 28.17 C
-ATOM 3853 H ALA D 46 18.477 30.953 12.153 1.00 0.00 H
-ATOM 3854 HA ALA D 46 21.091 31.712 13.415 1.00 0.00 H
-ATOM 3855 1HB ALA D 46 22.323 30.435 11.698 1.00 0.00 H
-ATOM 3856 2HB ALA D 46 21.260 29.364 12.644 1.00 0.00 H
-ATOM 3857 3HB ALA D 46 20.779 29.875 11.010 1.00 0.00 H
-ATOM 3858 N GLN D 47 21.677 33.405 11.776 1.00 36.46 N
-ATOM 3859 CA GLN D 47 21.967 34.571 10.951 1.00 33.92 C
-ATOM 3860 C GLN D 47 22.944 34.310 9.830 1.00 32.66 C
-ATOM 3861 O GLN D 47 23.789 33.414 9.908 1.00 31.33 O
-ATOM 3862 CB GLN D 47 22.520 35.727 11.798 1.00 24.62 C
-ATOM 3863 CG GLN D 47 21.545 36.334 12.791 1.00 42.70 C
-ATOM 3864 CD GLN D 47 22.123 37.499 13.537 1.00 32.43 C
-ATOM 3865 OE1 GLN D 47 23.298 37.482 13.928 1.00 38.44 O
-ATOM 3866 NE2 GLN D 47 21.306 38.534 13.744 1.00 31.18 N
-ATOM 3867 H GLN D 47 22.257 33.258 12.602 1.00 0.00 H
-ATOM 3868 HA GLN D 47 21.042 34.904 10.501 1.00 0.00 H
-ATOM 3869 1HB GLN D 47 23.392 35.378 12.355 1.00 0.00 H
-ATOM 3870 2HB GLN D 47 22.861 36.527 11.134 1.00 0.00 H
-ATOM 3871 1HG GLN D 47 20.717 36.728 12.228 1.00 0.00 H
-ATOM 3872 2HG GLN D 47 21.210 35.578 13.503 1.00 0.00 H
-ATOM 3873 1HE2 GLN D 47 21.629 39.342 14.239 1.00 0.00 H
-ATOM 3874 2HE2 GLN D 47 20.362 38.500 13.404 1.00 0.00 H
-ATOM 3875 N PHE D 48 22.869 35.161 8.817 1.00 29.22 N
-ATOM 3876 CA PHE D 48 23.869 35.171 7.761 1.00 34.57 C
-ATOM 3877 C PHE D 48 25.026 35.991 8.311 1.00 34.01 C
-ATOM 3878 O PHE D 48 24.802 36.934 9.072 1.00 35.68 O
-ATOM 3879 CB PHE D 48 23.309 35.765 6.483 1.00 27.73 C
-ATOM 3880 CG PHE D 48 22.259 34.902 5.869 1.00 28.37 C
-ATOM 3881 CD1 PHE D 48 22.602 33.811 5.093 1.00 33.11 C
-ATOM 3882 CD2 PHE D 48 20.916 35.182 6.076 1.00 24.77 C
-ATOM 3883 CE1 PHE D 48 21.618 33.013 4.551 1.00 26.87 C
-ATOM 3884 CE2 PHE D 48 19.937 34.386 5.531 1.00 35.05 C
-ATOM 3885 CZ PHE D 48 20.295 33.300 4.774 1.00 31.82 C
-ATOM 3886 H PHE D 48 22.100 35.832 8.806 1.00 0.00 H
-ATOM 3887 HA PHE D 48 24.216 34.153 7.563 1.00 0.00 H
-ATOM 3888 1HB PHE D 48 22.882 36.749 6.680 1.00 0.00 H
-ATOM 3889 2HB PHE D 48 24.116 35.882 5.771 1.00 0.00 H
-ATOM 3890 HD1 PHE D 48 23.658 33.584 4.925 1.00 0.00 H
-ATOM 3891 HD2 PHE D 48 20.645 36.041 6.682 1.00 0.00 H
-ATOM 3892 HE1 PHE D 48 21.883 32.156 3.958 1.00 0.00 H
-ATOM 3893 HE2 PHE D 48 18.886 34.612 5.704 1.00 0.00 H
-ATOM 3894 HZ PHE D 48 19.538 32.666 4.360 1.00 0.00 H
-ATOM 3895 N THR D 49 26.258 35.593 8.016 1.00 35.19 N
-ATOM 3896 CA THR D 49 27.410 36.245 8.643 1.00 36.13 C
-ATOM 3897 C THR D 49 28.518 36.620 7.687 1.00 37.91 C
-ATOM 3898 O THR D 49 28.444 36.402 6.481 1.00 36.70 O
-ATOM 3899 CB THR D 49 28.053 35.362 9.737 1.00 32.74 C
-ATOM 3900 OG1 THR D 49 28.721 34.239 9.133 1.00 33.58 O
-ATOM 3901 CG2 THR D 49 26.998 34.846 10.714 1.00 22.03 C
-ATOM 3902 H THR D 49 26.388 34.849 7.334 1.00 0.00 H
-ATOM 3903 HA THR D 49 27.062 37.165 9.110 1.00 0.00 H
-ATOM 3904 HB THR D 49 28.782 35.947 10.292 1.00 0.00 H
-ATOM 3905 HG1 THR D 49 28.076 33.528 9.023 1.00 0.00 H
-ATOM 3906 1HG2 THR D 49 27.480 34.235 11.473 1.00 0.00 H
-ATOM 3907 2HG2 THR D 49 26.492 35.684 11.189 1.00 0.00 H
-ATOM 3908 3HG2 THR D 49 26.269 34.242 10.180 1.00 0.00 H
-ATOM 3909 N GLU D 50 29.591 37.132 8.269 1.00 37.78 N
-ATOM 3910 CA GLU D 50 30.826 37.438 7.568 1.00 38.16 C
-ATOM 3911 C GLU D 50 31.372 36.198 6.852 1.00 38.85 C
-ATOM 3912 O GLU D 50 32.094 36.324 5.862 1.00 35.41 O
-ATOM 3913 CB GLU D 50 31.870 37.980 8.551 1.00 41.86 C
-ATOM 3914 CG GLU D 50 33.193 38.396 7.919 1.00 55.44 C
-ATOM 3915 CD GLU D 50 34.151 39.033 8.909 1.00 63.40 C
-ATOM 3916 OE1 GLU D 50 33.773 39.224 10.041 1.00 63.90 O
-ATOM 3917 OE2 GLU D 50 35.263 39.319 8.529 1.00 67.60 O
-ATOM 3918 H GLU D 50 29.562 37.302 9.263 1.00 0.00 H
-ATOM 3919 HA GLU D 50 30.618 38.200 6.817 1.00 0.00 H
-ATOM 3920 1HB GLU D 50 31.463 38.846 9.074 1.00 0.00 H
-ATOM 3921 2HB GLU D 50 32.087 37.217 9.300 1.00 0.00 H
-ATOM 3922 1HG GLU D 50 33.666 37.511 7.487 1.00 0.00 H
-ATOM 3923 2HG GLU D 50 32.990 39.100 7.114 1.00 0.00 H
-ATOM 3924 N HIS D 51 31.083 35.001 7.386 1.00 37.57 N
-ATOM 3925 CA HIS D 51 31.599 33.778 6.798 1.00 39.20 C
-ATOM 3926 C HIS D 51 30.517 32.949 6.091 1.00 36.84 C
-ATOM 3927 O HIS D 51 30.849 32.160 5.210 1.00 38.51 O
-ATOM 3928 CB HIS D 51 32.295 32.927 7.871 1.00 34.83 C
-ATOM 3929 CG HIS D 51 33.515 33.592 8.468 1.00 33.67 C
-ATOM 3930 ND1 HIS D 51 33.436 34.520 9.485 1.00 33.33 N
-ATOM 3931 CD2 HIS D 51 34.832 33.455 8.186 1.00 30.29 C
-ATOM 3932 CE1 HIS D 51 34.654 34.934 9.796 1.00 26.49 C
-ATOM 3933 NE2 HIS D 51 35.518 34.300 9.025 1.00 31.55 N
-ATOM 3934 H HIS D 51 30.458 34.928 8.183 1.00 0.00 H
-ATOM 3935 HA HIS D 51 32.347 34.033 6.047 1.00 0.00 H
-ATOM 3936 1HB HIS D 51 31.592 32.710 8.679 1.00 0.00 H
-ATOM 3937 2HB HIS D 51 32.598 31.974 7.438 1.00 0.00 H
-ATOM 3938 HD2 HIS D 51 35.267 32.799 7.433 1.00 0.00 H
-ATOM 3939 HE1 HIS D 51 34.901 35.673 10.561 1.00 0.00 H
-ATOM 3940 HE2 HIS D 51 36.523 34.417 9.042 1.00 0.00 H
-ATOM 3941 N THR D 52 29.230 33.149 6.437 1.00 37.72 N
-ATOM 3942 CA THR D 52 28.138 32.378 5.802 1.00 35.74 C
-ATOM 3943 C THR D 52 27.267 33.238 4.879 1.00 35.77 C
-ATOM 3944 O THR D 52 26.573 34.149 5.339 1.00 33.47 O
-ATOM 3945 CB THR D 52 27.185 31.743 6.846 1.00 34.29 C
-ATOM 3946 OG1 THR D 52 27.906 30.847 7.697 1.00 30.43 O
-ATOM 3947 CG2 THR D 52 26.050 30.971 6.138 1.00 31.02 C
-ATOM 3948 H THR D 52 29.021 33.805 7.179 1.00 0.00 H
-ATOM 3949 HA THR D 52 28.580 31.584 5.201 1.00 0.00 H
-ATOM 3950 HB THR D 52 26.744 32.530 7.458 1.00 0.00 H
-ATOM 3951 HG1 THR D 52 28.460 31.351 8.300 1.00 0.00 H
-ATOM 3952 1HG2 THR D 52 25.386 30.533 6.881 1.00 0.00 H
-ATOM 3953 2HG2 THR D 52 25.478 31.647 5.502 1.00 0.00 H
-ATOM 3954 3HG2 THR D 52 26.480 30.178 5.525 1.00 0.00 H
-ATOM 3955 N SER D 53 27.262 32.903 3.583 1.00 35.21 N
-ATOM 3956 CA SER D 53 26.480 33.656 2.596 1.00 36.50 C
-ATOM 3957 C SER D 53 25.195 32.935 2.224 1.00 37.36 C
-ATOM 3958 O SER D 53 24.266 33.529 1.670 1.00 34.46 O
-ATOM 3959 CB SER D 53 27.283 33.897 1.344 1.00 36.82 C
-ATOM 3960 OG SER D 53 27.593 32.695 0.696 1.00 32.64 O
-ATOM 3961 H SER D 53 27.826 32.108 3.284 1.00 0.00 H
-ATOM 3962 HA SER D 53 26.209 34.619 3.028 1.00 0.00 H
-ATOM 3963 1HB SER D 53 26.716 34.534 0.672 1.00 0.00 H
-ATOM 3964 2HB SER D 53 28.184 34.421 1.599 1.00 0.00 H
-ATOM 3965 HG SER D 53 27.897 32.085 1.388 1.00 0.00 H
-ATOM 3966 N ALA D 54 25.149 31.643 2.526 1.00 35.60 N
-ATOM 3967 CA ALA D 54 23.958 30.877 2.200 1.00 38.24 C
-ATOM 3968 C ALA D 54 23.770 29.729 3.176 1.00 38.37 C
-ATOM 3969 O ALA D 54 24.729 29.198 3.738 1.00 34.70 O
-ATOM 3970 CB ALA D 54 24.024 30.369 0.771 1.00 28.06 C
-ATOM 3971 H ALA D 54 25.959 31.199 2.948 1.00 0.00 H
-ATOM 3972 HA ALA D 54 23.101 31.533 2.288 1.00 0.00 H
-ATOM 3973 1HB ALA D 54 23.108 29.831 0.550 1.00 0.00 H
-ATOM 3974 2HB ALA D 54 24.125 31.217 0.097 1.00 0.00 H
-ATOM 3975 3HB ALA D 54 24.856 29.722 0.637 1.00 0.00 H
-ATOM 3976 N ILE D 55 22.510 29.344 3.344 1.00 38.67 N
-ATOM 3977 CA ILE D 55 22.131 28.226 4.190 1.00 39.91 C
-ATOM 3978 C ILE D 55 21.402 27.149 3.392 1.00 39.19 C
-ATOM 3979 O ILE D 55 20.440 27.424 2.680 1.00 39.48 O
-ATOM 3980 CB ILE D 55 21.259 28.705 5.372 1.00 41.40 C
-ATOM 3981 CG1 ILE D 55 22.081 29.693 6.257 1.00 38.43 C
-ATOM 3982 CG2 ILE D 55 20.771 27.506 6.183 1.00 28.35 C
-ATOM 3983 CD1 ILE D 55 21.267 30.427 7.310 1.00 30.70 C
-ATOM 3984 H ILE D 55 21.786 29.843 2.840 1.00 0.00 H
-ATOM 3985 HA ILE D 55 23.034 27.792 4.599 1.00 0.00 H
-ATOM 3986 HB ILE D 55 20.399 29.252 4.988 1.00 0.00 H
-ATOM 3987 1HG1 ILE D 55 22.873 29.134 6.757 1.00 0.00 H
-ATOM 3988 2HG1 ILE D 55 22.540 30.437 5.619 1.00 0.00 H
-ATOM 3989 1HG2 ILE D 55 20.153 27.848 7.012 1.00 0.00 H
-ATOM 3990 2HG2 ILE D 55 20.184 26.845 5.546 1.00 0.00 H
-ATOM 3991 3HG2 ILE D 55 21.635 26.962 6.568 1.00 0.00 H
-ATOM 3992 1HD1 ILE D 55 21.921 31.097 7.877 1.00 0.00 H
-ATOM 3993 2HD1 ILE D 55 20.488 31.014 6.822 1.00 0.00 H
-ATOM 3994 3HD1 ILE D 55 20.811 29.710 7.989 1.00 0.00 H
-ATOM 3995 N LYS D 56 21.870 25.917 3.505 1.00 41.17 N
-ATOM 3996 CA LYS D 56 21.249 24.810 2.781 1.00 43.41 C
-ATOM 3997 C LYS D 56 20.696 23.771 3.741 1.00 43.46 C
-ATOM 3998 O LYS D 56 21.372 23.359 4.675 1.00 40.79 O
-ATOM 3999 CB LYS D 56 22.250 24.231 1.782 1.00 42.92 C
-ATOM 4000 CG LYS D 56 21.777 23.055 0.965 1.00 50.50 C
-ATOM 4001 CD LYS D 56 22.747 22.804 -0.186 1.00 47.04 C
-ATOM 4002 CE LYS D 56 22.539 21.449 -0.850 1.00 62.47 C
-ATOM 4003 NZ LYS D 56 23.257 21.380 -2.151 1.00 45.76 N
-ATOM 4004 H LYS D 56 22.679 25.752 4.099 1.00 0.00 H
-ATOM 4005 HA LYS D 56 20.411 25.200 2.214 1.00 0.00 H
-ATOM 4006 1HB LYS D 56 22.551 25.009 1.089 1.00 0.00 H
-ATOM 4007 2HB LYS D 56 23.140 23.917 2.307 1.00 0.00 H
-ATOM 4008 1HG LYS D 56 21.720 22.163 1.593 1.00 0.00 H
-ATOM 4009 2HG LYS D 56 20.781 23.264 0.563 1.00 0.00 H
-ATOM 4010 1HD LYS D 56 22.620 23.581 -0.947 1.00 0.00 H
-ATOM 4011 2HD LYS D 56 23.773 22.864 0.182 1.00 0.00 H
-ATOM 4012 1HE LYS D 56 22.933 20.677 -0.192 1.00 0.00 H
-ATOM 4013 2HE LYS D 56 21.478 21.263 -1.012 1.00 0.00 H
-ATOM 4014 1HZ LYS D 56 23.128 20.474 -2.595 1.00 0.00 H
-ATOM 4015 2HZ LYS D 56 22.880 22.088 -2.759 1.00 0.00 H
-ATOM 4016 3HZ LYS D 56 24.241 21.572 -2.046 1.00 0.00 H
-ATOM 4017 N VAL D 57 19.438 23.389 3.546 1.00 41.81 N
-ATOM 4018 CA VAL D 57 18.810 22.455 4.469 1.00 42.73 C
-ATOM 4019 C VAL D 57 18.417 21.138 3.808 1.00 44.28 C
-ATOM 4020 O VAL D 57 17.738 21.110 2.769 1.00 42.88 O
-ATOM 4021 CB VAL D 57 17.559 23.094 5.112 1.00 41.59 C
-ATOM 4022 CG1 VAL D 57 16.903 22.097 6.097 1.00 36.45 C
-ATOM 4023 CG2 VAL D 57 17.954 24.389 5.813 1.00 31.04 C
-ATOM 4024 H VAL D 57 18.916 23.761 2.759 1.00 0.00 H
-ATOM 4025 HA VAL D 57 19.515 22.239 5.266 1.00 0.00 H
-ATOM 4026 HB VAL D 57 16.830 23.315 4.332 1.00 0.00 H
-ATOM 4027 1HG1 VAL D 57 16.017 22.545 6.541 1.00 0.00 H
-ATOM 4028 2HG1 VAL D 57 16.614 21.185 5.573 1.00 0.00 H
-ATOM 4029 3HG1 VAL D 57 17.615 21.850 6.886 1.00 0.00 H
-ATOM 4030 1HG2 VAL D 57 17.070 24.841 6.246 1.00 0.00 H
-ATOM 4031 2HG2 VAL D 57 18.676 24.171 6.589 1.00 0.00 H
-ATOM 4032 3HG2 VAL D 57 18.393 25.077 5.091 1.00 0.00 H
-ATOM 4033 N ARG D 58 18.859 20.042 4.428 1.00 46.39 N
-ATOM 4034 CA ARG D 58 18.555 18.682 3.991 1.00 45.57 C
-ATOM 4035 C ARG D 58 17.833 17.899 5.085 1.00 44.94 C
-ATOM 4036 O ARG D 58 18.290 17.827 6.228 1.00 46.05 O
-ATOM 4037 CB ARG D 58 19.815 17.917 3.609 1.00 57.65 C
-ATOM 4038 CG ARG D 58 19.562 16.448 3.227 1.00 63.97 C
-ATOM 4039 CD ARG D 58 20.814 15.704 2.884 1.00 68.83 C
-ATOM 4040 NE ARG D 58 21.396 16.131 1.628 1.00 77.75 N
-ATOM 4041 CZ ARG D 58 22.564 15.680 1.125 1.00 87.78 C
-ATOM 4042 NH1 ARG D 58 23.280 14.788 1.780 1.00 84.82 N
-ATOM 4043 NH2 ARG D 58 22.976 16.148 -0.038 1.00 91.25 N
-ATOM 4044 H ARG D 58 19.434 20.173 5.261 1.00 0.00 H
-ATOM 4045 HA ARG D 58 17.903 18.737 3.116 1.00 0.00 H
-ATOM 4046 1HB ARG D 58 20.295 18.402 2.755 1.00 0.00 H
-ATOM 4047 2HB ARG D 58 20.518 17.934 4.439 1.00 0.00 H
-ATOM 4048 1HG ARG D 58 19.096 15.932 4.067 1.00 0.00 H
-ATOM 4049 2HG ARG D 58 18.896 16.412 2.363 1.00 0.00 H
-ATOM 4050 1HD ARG D 58 21.550 15.860 3.670 1.00 0.00 H
-ATOM 4051 2HD ARG D 58 20.587 14.642 2.808 1.00 0.00 H
-ATOM 4052 HE ARG D 58 20.892 16.826 1.065 1.00 0.00 H
-ATOM 4053 1HH1 ARG D 58 22.957 14.436 2.670 1.00 0.00 H
-ATOM 4054 2HH1 ARG D 58 24.153 14.460 1.393 1.00 0.00 H
-ATOM 4055 1HH2 ARG D 58 22.390 16.841 -0.515 1.00 0.00 H
-ATOM 4056 2HH2 ARG D 58 23.841 15.830 -0.444 1.00 0.00 H
-ATOM 4057 N GLY D 59 16.718 17.280 4.731 1.00 45.33 N
-ATOM 4058 CA GLY D 59 15.923 16.539 5.703 1.00 45.38 C
-ATOM 4059 C GLY D 59 14.642 17.302 5.949 1.00 41.90 C
-ATOM 4060 O GLY D 59 14.605 18.522 5.794 1.00 40.78 O
-ATOM 4061 H GLY D 59 16.382 17.352 3.777 1.00 0.00 H
-ATOM 4062 1HA GLY D 59 15.697 15.542 5.329 1.00 0.00 H
-ATOM 4063 2HA GLY D 59 16.474 16.422 6.633 1.00 0.00 H
-ATOM 4064 N LYS D 60 13.581 16.589 6.288 1.00 42.35 N
-ATOM 4065 CA LYS D 60 12.281 17.219 6.460 1.00 43.43 C
-ATOM 4066 C LYS D 60 12.337 18.260 7.565 1.00 40.02 C
-ATOM 4067 O LYS D 60 12.763 17.959 8.686 1.00 37.51 O
-ATOM 4068 CB LYS D 60 11.230 16.153 6.751 1.00 39.47 C
-ATOM 4069 CG LYS D 60 9.798 16.611 6.753 1.00 37.78 C
-ATOM 4070 CD LYS D 60 8.888 15.428 7.087 1.00 41.76 C
-ATOM 4071 CE LYS D 60 7.419 15.802 7.038 1.00 44.88 C
-ATOM 4072 NZ LYS D 60 6.936 15.927 5.630 1.00 51.14 N
-ATOM 4073 H LYS D 60 13.675 15.582 6.420 1.00 0.00 H
-ATOM 4074 HA LYS D 60 12.022 17.730 5.547 1.00 0.00 H
-ATOM 4075 1HB LYS D 60 11.309 15.364 5.997 1.00 0.00 H
-ATOM 4076 2HB LYS D 60 11.421 15.703 7.712 1.00 0.00 H
-ATOM 4077 1HG LYS D 60 9.657 17.408 7.461 1.00 0.00 H
-ATOM 4078 2HG LYS D 60 9.545 16.985 5.759 1.00 0.00 H
-ATOM 4079 1HD LYS D 60 9.077 14.631 6.362 1.00 0.00 H
-ATOM 4080 2HD LYS D 60 9.134 15.051 8.085 1.00 0.00 H
-ATOM 4081 1HE LYS D 60 6.836 15.044 7.555 1.00 0.00 H
-ATOM 4082 2HE LYS D 60 7.277 16.747 7.534 1.00 0.00 H
-ATOM 4083 1HZ LYS D 60 5.960 16.180 5.625 1.00 0.00 H
-ATOM 4084 2HZ LYS D 60 7.470 16.636 5.138 1.00 0.00 H
-ATOM 4085 3HZ LYS D 60 7.054 15.030 5.164 1.00 0.00 H
-ATOM 4086 N ALA D 61 11.899 19.473 7.253 1.00 39.81 N
-ATOM 4087 CA ALA D 61 11.959 20.548 8.237 1.00 39.48 C
-ATOM 4088 C ALA D 61 10.996 21.672 7.918 1.00 38.42 C
-ATOM 4089 O ALA D 61 10.636 21.899 6.763 1.00 38.68 O
-ATOM 4090 CB ALA D 61 13.368 21.107 8.325 1.00 38.39 C
-ATOM 4091 H ALA D 61 11.541 19.634 6.313 1.00 0.00 H
-ATOM 4092 HA ALA D 61 11.690 20.127 9.197 1.00 0.00 H
-ATOM 4093 1HB ALA D 61 13.407 21.875 9.086 1.00 0.00 H
-ATOM 4094 2HB ALA D 61 14.040 20.306 8.580 1.00 0.00 H
-ATOM 4095 3HB ALA D 61 13.658 21.535 7.383 1.00 0.00 H
-ATOM 4096 N TYR D 62 10.619 22.421 8.944 1.00 37.16 N
-ATOM 4097 CA TYR D 62 9.783 23.593 8.724 1.00 36.97 C
-ATOM 4098 C TYR D 62 10.687 24.813 8.783 1.00 36.47 C
-ATOM 4099 O TYR D 62 11.399 25.011 9.772 1.00 34.92 O
-ATOM 4100 CB TYR D 62 8.669 23.687 9.767 1.00 34.30 C
-ATOM 4101 CG TYR D 62 7.653 24.784 9.477 1.00 30.19 C
-ATOM 4102 CD1 TYR D 62 6.682 24.553 8.517 1.00 29.74 C
-ATOM 4103 CD2 TYR D 62 7.681 26.000 10.147 1.00 29.81 C
-ATOM 4104 CE1 TYR D 62 5.741 25.510 8.222 1.00 27.52 C
-ATOM 4105 CE2 TYR D 62 6.727 26.967 9.851 1.00 28.43 C
-ATOM 4106 CZ TYR D 62 5.759 26.716 8.891 1.00 31.07 C
-ATOM 4107 OH TYR D 62 4.797 27.656 8.594 1.00 31.61 O
-ATOM 4108 H TYR D 62 10.955 22.175 9.872 1.00 0.00 H
-ATOM 4109 HA TYR D 62 9.339 23.545 7.729 1.00 0.00 H
-ATOM 4110 1HB TYR D 62 8.138 22.735 9.817 1.00 0.00 H
-ATOM 4111 2HB TYR D 62 9.097 23.872 10.746 1.00 0.00 H
-ATOM 4112 HD1 TYR D 62 6.659 23.602 7.999 1.00 0.00 H
-ATOM 4113 HD2 TYR D 62 8.440 26.192 10.901 1.00 0.00 H
-ATOM 4114 HE1 TYR D 62 4.979 25.308 7.468 1.00 0.00 H
-ATOM 4115 HE2 TYR D 62 6.735 27.917 10.374 1.00 0.00 H
-ATOM 4116 HH TYR D 62 4.948 28.447 9.112 1.00 0.00 H
-ATOM 4117 N ILE D 63 10.703 25.605 7.715 1.00 36.72 N
-ATOM 4118 CA ILE D 63 11.603 26.744 7.652 1.00 31.64 C
-ATOM 4119 C ILE D 63 10.857 28.083 7.575 1.00 30.48 C
-ATOM 4120 O ILE D 63 9.920 28.246 6.792 1.00 29.70 O
-ATOM 4121 CB ILE D 63 12.533 26.606 6.438 1.00 31.08 C
-ATOM 4122 CG1 ILE D 63 13.325 25.302 6.525 1.00 32.31 C
-ATOM 4123 CG2 ILE D 63 13.495 27.788 6.386 1.00 16.93 C
-ATOM 4124 CD1 ILE D 63 14.031 24.962 5.241 1.00 31.40 C
-ATOM 4125 H ILE D 63 10.120 25.406 6.907 1.00 0.00 H
-ATOM 4126 HA ILE D 63 12.207 26.731 8.538 1.00 0.00 H
-ATOM 4127 HB ILE D 63 11.951 26.571 5.549 1.00 0.00 H
-ATOM 4128 1HG1 ILE D 63 14.056 25.382 7.322 1.00 0.00 H
-ATOM 4129 2HG1 ILE D 63 12.644 24.484 6.759 1.00 0.00 H
-ATOM 4130 1HG2 ILE D 63 14.137 27.673 5.530 1.00 0.00 H
-ATOM 4131 2HG2 ILE D 63 12.932 28.712 6.298 1.00 0.00 H
-ATOM 4132 3HG2 ILE D 63 14.096 27.816 7.296 1.00 0.00 H
-ATOM 4133 1HD1 ILE D 63 14.564 24.027 5.360 1.00 0.00 H
-ATOM 4134 2HD1 ILE D 63 13.294 24.860 4.441 1.00 0.00 H
-ATOM 4135 3HD1 ILE D 63 14.733 25.753 4.991 1.00 0.00 H
-ATOM 4136 N GLN D 64 11.265 29.043 8.413 1.00 31.71 N
-ATOM 4137 CA GLN D 64 10.642 30.370 8.398 1.00 32.77 C
-ATOM 4138 C GLN D 64 11.673 31.419 7.991 1.00 32.81 C
-ATOM 4139 O GLN D 64 12.748 31.506 8.597 1.00 34.31 O
-ATOM 4140 CB GLN D 64 10.083 30.738 9.789 1.00 29.02 C
-ATOM 4141 CG GLN D 64 9.029 29.771 10.356 1.00 25.62 C
-ATOM 4142 CD GLN D 64 8.628 30.068 11.825 1.00 35.61 C
-ATOM 4143 OE1 GLN D 64 9.498 30.170 12.694 1.00 35.18 O
-ATOM 4144 NE2 GLN D 64 7.320 30.179 12.090 1.00 30.83 N
-ATOM 4145 H GLN D 64 12.032 28.834 9.045 1.00 0.00 H
-ATOM 4146 HA GLN D 64 9.845 30.385 7.662 1.00 0.00 H
-ATOM 4147 1HB GLN D 64 10.872 30.867 10.486 1.00 0.00 H
-ATOM 4148 2HB GLN D 64 9.592 31.708 9.706 1.00 0.00 H
-ATOM 4149 1HG GLN D 64 8.133 29.832 9.756 1.00 0.00 H
-ATOM 4150 2HG GLN D 64 9.430 28.758 10.318 1.00 0.00 H
-ATOM 4151 1HE2 GLN D 64 6.980 30.336 13.041 1.00 0.00 H
-ATOM 4152 2HE2 GLN D 64 6.645 30.096 11.362 1.00 0.00 H
-ATOM 4153 N THR D 65 11.364 32.224 6.974 1.00 33.25 N
-ATOM 4154 CA THR D 65 12.298 33.258 6.540 1.00 35.12 C
-ATOM 4155 C THR D 65 11.562 34.582 6.377 1.00 34.82 C
-ATOM 4156 O THR D 65 10.333 34.645 6.415 1.00 35.99 O
-ATOM 4157 CB THR D 65 12.934 32.947 5.172 1.00 30.73 C
-ATOM 4158 OG1 THR D 65 11.978 33.207 4.137 1.00 36.55 O
-ATOM 4159 CG2 THR D 65 13.329 31.488 5.089 1.00 27.87 C
-ATOM 4160 H THR D 65 10.489 32.113 6.462 1.00 0.00 H
-ATOM 4161 HA THR D 65 13.076 33.386 7.292 1.00 0.00 H
-ATOM 4162 HB THR D 65 13.810 33.565 5.030 1.00 0.00 H
-ATOM 4163 HG1 THR D 65 11.174 32.665 4.300 1.00 0.00 H
-ATOM 4164 1HG2 THR D 65 13.767 31.290 4.115 1.00 0.00 H
-ATOM 4165 2HG2 THR D 65 14.050 31.255 5.868 1.00 0.00 H
-ATOM 4166 3HG2 THR D 65 12.443 30.869 5.216 1.00 0.00 H
-ATOM 4167 N ARG D 66 12.318 35.632 6.103 1.00 34.76 N
-ATOM 4168 CA ARG D 66 11.737 36.945 5.840 1.00 36.10 C
-ATOM 4169 C ARG D 66 10.823 36.972 4.611 1.00 37.20 C
-ATOM 4170 O ARG D 66 10.015 37.890 4.473 1.00 34.95 O
-ATOM 4171 CB ARG D 66 12.809 38.023 5.723 1.00 31.49 C
-ATOM 4172 CG ARG D 66 12.240 39.427 5.528 1.00 51.27 C
-ATOM 4173 CD ARG D 66 13.200 40.525 5.916 1.00 62.51 C
-ATOM 4174 NE ARG D 66 14.415 40.541 5.159 1.00 62.52 N
-ATOM 4175 CZ ARG D 66 14.564 41.067 3.937 1.00 72.90 C
-ATOM 4176 NH1 ARG D 66 15.742 41.043 3.370 1.00 66.56 N
-ATOM 4177 NH2 ARG D 66 13.531 41.614 3.315 1.00 66.85 N
-ATOM 4178 H ARG D 66 13.317 35.523 6.089 1.00 0.00 H
-ATOM 4179 HA ARG D 66 11.125 37.206 6.705 1.00 0.00 H
-ATOM 4180 1HB ARG D 66 13.462 38.019 6.592 1.00 0.00 H
-ATOM 4181 2HB ARG D 66 13.424 37.822 4.850 1.00 0.00 H
-ATOM 4182 1HG ARG D 66 11.983 39.555 4.475 1.00 0.00 H
-ATOM 4183 2HG ARG D 66 11.341 39.535 6.135 1.00 0.00 H
-ATOM 4184 1HD ARG D 66 12.710 41.490 5.786 1.00 0.00 H
-ATOM 4185 2HD ARG D 66 13.473 40.400 6.962 1.00 0.00 H
-ATOM 4186 HE ARG D 66 15.251 40.156 5.615 1.00 0.00 H
-ATOM 4187 1HH1 ARG D 66 16.540 40.619 3.871 1.00 0.00 H
-ATOM 4188 2HH1 ARG D 66 15.866 41.439 2.448 1.00 0.00 H
-ATOM 4189 1HH2 ARG D 66 12.625 41.631 3.760 1.00 0.00 H
-ATOM 4190 2HH2 ARG D 66 13.655 42.014 2.398 1.00 0.00 H
-ATOM 4191 N HIS D 67 10.978 36.011 3.689 1.00 36.65 N
-ATOM 4192 CA HIS D 67 10.177 36.022 2.472 1.00 39.38 C
-ATOM 4193 C HIS D 67 9.092 34.943 2.488 1.00 38.25 C
-ATOM 4194 O HIS D 67 8.545 34.583 1.444 1.00 37.05 O
-ATOM 4195 CB HIS D 67 11.053 35.902 1.221 1.00 32.56 C
-ATOM 4196 CG HIS D 67 12.001 37.056 1.087 1.00 30.79 C
-ATOM 4197 ND1 HIS D 67 11.570 38.361 1.131 1.00 33.65 N
-ATOM 4198 CD2 HIS D 67 13.334 37.116 0.860 1.00 32.61 C
-ATOM 4199 CE1 HIS D 67 12.596 39.170 0.967 1.00 23.10 C
-ATOM 4200 NE2 HIS D 67 13.675 38.452 0.791 1.00 36.43 N
-ATOM 4201 H HIS D 67 11.609 35.229 3.846 1.00 0.00 H
-ATOM 4202 HA HIS D 67 9.661 36.978 2.398 1.00 0.00 H
-ATOM 4203 1HB HIS D 67 11.628 34.971 1.248 1.00 0.00 H
-ATOM 4204 2HB HIS D 67 10.420 35.876 0.333 1.00 0.00 H
-ATOM 4205 HD2 HIS D 67 14.008 36.271 0.740 1.00 0.00 H
-ATOM 4206 HE1 HIS D 67 12.553 40.255 0.956 1.00 0.00 H
-ATOM 4207 HE2 HIS D 67 14.614 38.851 0.618 1.00 0.00 H
-ATOM 4208 N GLY D 68 8.763 34.446 3.683 1.00 36.16 N
-ATOM 4209 CA GLY D 68 7.709 33.448 3.819 1.00 32.69 C
-ATOM 4210 C GLY D 68 8.218 32.158 4.429 1.00 35.32 C
-ATOM 4211 O GLY D 68 9.378 32.059 4.844 1.00 35.91 O
-ATOM 4212 H GLY D 68 9.254 34.759 4.518 1.00 0.00 H
-ATOM 4213 1HA GLY D 68 6.911 33.856 4.440 1.00 0.00 H
-ATOM 4214 2HA GLY D 68 7.276 33.239 2.844 1.00 0.00 H
-ATOM 4215 N VAL D 69 7.337 31.165 4.497 1.00 36.05 N
-ATOM 4216 CA VAL D 69 7.701 29.899 5.106 1.00 38.52 C
-ATOM 4217 C VAL D 69 7.742 28.834 4.036 1.00 41.42 C
-ATOM 4218 O VAL D 69 7.046 28.935 3.021 1.00 40.10 O
-ATOM 4219 CB VAL D 69 6.691 29.507 6.198 1.00 39.30 C
-ATOM 4220 CG1 VAL D 69 6.668 30.565 7.293 1.00 28.66 C
-ATOM 4221 CG2 VAL D 69 5.320 29.341 5.579 1.00 31.40 C
-ATOM 4222 H VAL D 69 6.403 31.295 4.134 1.00 0.00 H
-ATOM 4223 HA VAL D 69 8.691 29.989 5.551 1.00 0.00 H
-ATOM 4224 HB VAL D 69 7.008 28.564 6.655 1.00 0.00 H
-ATOM 4225 1HG1 VAL D 69 5.964 30.267 8.070 1.00 0.00 H
-ATOM 4226 2HG1 VAL D 69 7.648 30.662 7.716 1.00 0.00 H
-ATOM 4227 3HG1 VAL D 69 6.362 31.521 6.877 1.00 0.00 H
-ATOM 4228 1HG2 VAL D 69 4.606 29.051 6.347 1.00 0.00 H
-ATOM 4229 2HG2 VAL D 69 5.007 30.282 5.129 1.00 0.00 H
-ATOM 4230 3HG2 VAL D 69 5.363 28.566 4.814 1.00 0.00 H
-ATOM 4231 N ILE D 70 8.582 27.839 4.244 1.00 40.54 N
-ATOM 4232 CA ILE D 70 8.752 26.775 3.278 1.00 41.17 C
-ATOM 4233 C ILE D 70 9.104 25.473 3.983 1.00 42.99 C
-ATOM 4234 O ILE D 70 9.750 25.490 5.027 1.00 46.29 O
-ATOM 4235 CB ILE D 70 9.855 27.180 2.270 1.00 42.47 C
-ATOM 4236 CG1 ILE D 70 9.882 26.261 1.089 1.00 43.58 C
-ATOM 4237 CG2 ILE D 70 11.212 27.171 2.954 1.00 51.59 C
-ATOM 4238 CD1 ILE D 70 10.682 26.839 -0.036 1.00 39.65 C
-ATOM 4239 H ILE D 70 9.120 27.832 5.109 1.00 0.00 H
-ATOM 4240 HA ILE D 70 7.815 26.635 2.739 1.00 0.00 H
-ATOM 4241 HB ILE D 70 9.652 28.181 1.898 1.00 0.00 H
-ATOM 4242 1HG1 ILE D 70 10.326 25.303 1.375 1.00 0.00 H
-ATOM 4243 2HG1 ILE D 70 8.862 26.084 0.743 1.00 0.00 H
-ATOM 4244 1HG2 ILE D 70 11.983 27.468 2.252 1.00 0.00 H
-ATOM 4245 2HG2 ILE D 70 11.196 27.865 3.792 1.00 0.00 H
-ATOM 4246 3HG2 ILE D 70 11.420 26.160 3.310 1.00 0.00 H
-ATOM 4247 1HD1 ILE D 70 10.661 26.157 -0.853 1.00 0.00 H
-ATOM 4248 2HD1 ILE D 70 10.249 27.793 -0.350 1.00 0.00 H
-ATOM 4249 3HD1 ILE D 70 11.703 26.996 0.289 1.00 0.00 H
-ATOM 4250 N GLU D 71 8.673 24.348 3.438 1.00 41.35 N
-ATOM 4251 CA GLU D 71 9.068 23.078 4.032 1.00 41.91 C
-ATOM 4252 C GLU D 71 10.115 22.372 3.191 1.00 42.61 C
-ATOM 4253 O GLU D 71 10.015 22.333 1.959 1.00 42.42 O
-ATOM 4254 CB GLU D 71 7.857 22.154 4.205 1.00 33.03 C
-ATOM 4255 CG GLU D 71 6.838 22.616 5.234 1.00 32.29 C
-ATOM 4256 CD GLU D 71 5.629 21.699 5.332 1.00 44.06 C
-ATOM 4257 OE1 GLU D 71 5.456 21.063 6.346 1.00 51.88 O
-ATOM 4258 OE2 GLU D 71 4.880 21.644 4.384 1.00 53.91 O
-ATOM 4259 H GLU D 71 8.109 24.374 2.600 1.00 0.00 H
-ATOM 4260 HA GLU D 71 9.500 23.269 5.016 1.00 0.00 H
-ATOM 4261 1HB GLU D 71 7.345 22.041 3.250 1.00 0.00 H
-ATOM 4262 2HB GLU D 71 8.208 21.165 4.507 1.00 0.00 H
-ATOM 4263 1HG GLU D 71 7.340 22.635 6.193 1.00 0.00 H
-ATOM 4264 2HG GLU D 71 6.512 23.628 4.999 1.00 0.00 H
-ATOM 4265 N SER D 72 11.091 21.776 3.867 1.00 42.42 N
-ATOM 4266 CA SER D 72 12.111 20.957 3.219 1.00 42.47 C
-ATOM 4267 C SER D 72 11.672 19.510 3.372 1.00 44.88 C
-ATOM 4268 O SER D 72 10.802 19.233 4.201 1.00 43.18 O
-ATOM 4269 CB SER D 72 13.488 21.222 3.809 1.00 37.06 C
-ATOM 4270 OG SER D 72 13.563 20.817 5.133 1.00 31.23 O
-ATOM 4271 H SER D 72 11.092 21.865 4.881 1.00 0.00 H
-ATOM 4272 HA SER D 72 12.148 21.191 2.154 1.00 0.00 H
-ATOM 4273 1HB SER D 72 14.251 20.709 3.221 1.00 0.00 H
-ATOM 4274 2HB SER D 72 13.694 22.284 3.752 1.00 0.00 H
-ATOM 4275 HG SER D 72 13.838 19.882 5.136 1.00 0.00 H
-ATOM 4276 N GLU D 73 12.290 18.596 2.626 1.00 45.63 N
-ATOM 4277 CA GLU D 73 11.915 17.175 2.655 1.00 49.48 C
-ATOM 4278 C GLU D 73 13.147 16.252 2.659 1.00 50.07 C
-ATOM 4279 O GLU D 73 14.269 16.682 2.374 1.00 49.88 O
-ATOM 4280 CB GLU D 73 10.957 16.887 1.478 1.00 49.23 C
-ATOM 4281 CG GLU D 73 10.389 15.454 1.339 1.00 41.84 C
-ATOM 4282 CD GLU D 73 9.572 14.964 2.529 1.00 47.42 C
-ATOM 4283 OE1 GLU D 73 8.366 15.092 2.521 1.00 45.00 O
-ATOM 4284 OE2 GLU D 73 10.177 14.467 3.448 1.00 47.59 O
-ATOM 4285 H GLU D 73 13.013 18.906 1.979 1.00 0.00 H
-ATOM 4286 HA GLU D 73 11.356 16.982 3.566 1.00 0.00 H
-ATOM 4287 1HB GLU D 73 10.096 17.548 1.572 1.00 0.00 H
-ATOM 4288 2HB GLU D 73 11.441 17.134 0.547 1.00 0.00 H
-ATOM 4289 1HG GLU D 73 9.742 15.444 0.465 1.00 0.00 H
-ATOM 4290 2HG GLU D 73 11.200 14.759 1.132 1.00 0.00 H
-ATOM 4291 N GLY D 74 12.944 15.002 3.071 1.00 51.62 N
-ATOM 4292 CA GLY D 74 14.018 14.016 3.103 1.00 53.91 C
-ATOM 4293 C GLY D 74 14.173 13.315 1.754 1.00 55.67 C
-ATOM 4294 O GLY D 74 13.614 13.753 0.748 1.00 56.63 O
-ATOM 4295 H GLY D 74 11.995 14.716 3.324 1.00 0.00 H
-ATOM 4296 1HA GLY D 74 14.952 14.502 3.372 1.00 0.00 H
-ATOM 4297 2HA GLY D 74 13.804 13.279 3.877 1.00 0.00 H
-ATOM 4298 N LYS D 75 14.945 12.232 1.740 1.00 57.67 N
-ATOM 4299 CA LYS D 75 15.199 11.478 0.519 1.00 58.92 C
-ATOM 4300 C LYS D 75 14.640 10.067 0.646 1.00 59.91 C
-ATOM 4301 O LYS D 75 14.469 9.574 1.762 1.00 63.21 O
-ATOM 4302 OXT LYS D 75 14.136 9.529 -0.338 1.00 0.00 O
-ATOM 4303 CB LYS D 75 16.697 11.435 0.215 1.00 54.81 C
-ATOM 4304 CG LYS D 75 17.072 10.678 -1.054 1.00 60.93 C
-ATOM 4305 CD LYS D 75 18.573 10.741 -1.304 1.00 45.00 C
-ATOM 4306 CE LYS D 75 18.967 9.980 -2.567 1.00 45.00 C
-ATOM 4307 NZ LYS D 75 20.445 10.037 -2.808 1.00 45.00 N
-ATOM 4308 H LYS D 75 15.372 11.927 2.602 1.00 0.00 H
-ATOM 4309 HA LYS D 75 14.690 11.969 -0.313 1.00 0.00 H
-ATOM 4310 1HB LYS D 75 17.073 12.452 0.110 1.00 0.00 H
-ATOM 4311 2HB LYS D 75 17.227 10.972 1.049 1.00 0.00 H
-ATOM 4312 1HG LYS D 75 16.773 9.633 -0.957 1.00 0.00 H
-ATOM 4313 2HG LYS D 75 16.550 11.111 -1.907 1.00 0.00 H
-ATOM 4314 1HD LYS D 75 18.872 11.783 -1.418 1.00 0.00 H
-ATOM 4315 2HD LYS D 75 19.103 10.319 -0.449 1.00 0.00 H
-ATOM 4316 1HE LYS D 75 18.662 8.938 -2.468 1.00 0.00 H
-ATOM 4317 2HE LYS D 75 18.451 10.420 -3.421 1.00 0.00 H
-ATOM 4318 1HZ LYS D 75 20.675 9.529 -3.652 1.00 0.00 H
-ATOM 4319 2HZ LYS D 75 20.731 11.004 -2.911 1.00 0.00 H
-ATOM 4320 3HZ LYS D 75 20.932 9.623 -2.025 1.00 0.00 H
-TER
-ATOM 4322 N SER E 7 22.337 42.472 3.085 1.00 41.06 N
-ATOM 4323 CA SER E 7 22.107 41.968 1.739 1.00 45.68 C
-ATOM 4324 C SER E 7 20.876 41.072 1.674 1.00 43.32 C
-ATOM 4325 O SER E 7 20.631 40.246 2.557 1.00 44.98 O
-ATOM 4326 CB SER E 7 23.308 41.217 1.236 1.00 44.05 C
-ATOM 4327 OG SER E 7 23.027 40.663 -0.006 1.00 44.67 O
-ATOM 4328 1H SER E 7 22.492 43.467 3.050 1.00 0.00 H
-ATOM 4329 2H SER E 7 21.527 42.277 3.657 1.00 0.00 H
-ATOM 4330 3H SER E 7 23.148 42.019 3.478 1.00 0.00 H
-ATOM 4331 HA SER E 7 21.935 42.819 1.078 1.00 0.00 H
-ATOM 4332 1HB SER E 7 24.163 41.892 1.149 1.00 0.00 H
-ATOM 4333 2HB SER E 7 23.576 40.431 1.946 1.00 0.00 H
-ATOM 4334 HG SER E 7 23.783 40.098 -0.225 1.00 0.00 H
-ATOM 4335 N ASP E 8 20.103 41.243 0.603 1.00 40.52 N
-ATOM 4336 CA ASP E 8 18.858 40.507 0.437 1.00 40.57 C
-ATOM 4337 C ASP E 8 19.150 39.075 -0.003 1.00 39.51 C
-ATOM 4338 O ASP E 8 20.291 38.734 -0.327 1.00 37.33 O
-ATOM 4339 CB ASP E 8 17.960 41.239 -0.586 1.00 56.79 C
-ATOM 4340 CG ASP E 8 16.440 40.991 -0.388 1.00 60.26 C
-ATOM 4341 OD1 ASP E 8 16.087 39.978 0.197 1.00 49.31 O
-ATOM 4342 OD2 ASP E 8 15.658 41.828 -0.797 1.00 55.93 O
-ATOM 4343 H ASP E 8 20.377 41.912 -0.103 1.00 0.00 H
-ATOM 4344 HA ASP E 8 18.339 40.472 1.396 1.00 0.00 H
-ATOM 4345 1HB ASP E 8 18.138 42.313 -0.509 1.00 0.00 H
-ATOM 4346 2HB ASP E 8 18.232 40.941 -1.604 1.00 0.00 H
-ATOM 4347 N PHE E 9 18.111 38.245 -0.019 1.00 38.68 N
-ATOM 4348 CA PHE E 9 18.266 36.828 -0.338 1.00 38.50 C
-ATOM 4349 C PHE E 9 17.069 36.208 -1.031 1.00 38.08 C
-ATOM 4350 O PHE E 9 15.982 36.781 -1.073 1.00 38.81 O
-ATOM 4351 CB PHE E 9 18.523 36.016 0.944 1.00 36.19 C
-ATOM 4352 CG PHE E 9 17.370 35.964 1.914 1.00 31.04 C
-ATOM 4353 CD1 PHE E 9 16.463 34.917 1.852 1.00 30.36 C
-ATOM 4354 CD2 PHE E 9 17.189 36.933 2.894 1.00 27.01 C
-ATOM 4355 CE1 PHE E 9 15.413 34.822 2.738 1.00 32.84 C
-ATOM 4356 CE2 PHE E 9 16.127 36.838 3.781 1.00 24.98 C
-ATOM 4357 CZ PHE E 9 15.247 35.778 3.699 1.00 29.24 C
-ATOM 4358 H PHE E 9 17.201 38.629 0.223 1.00 0.00 H
-ATOM 4359 HA PHE E 9 19.113 36.731 -1.012 1.00 0.00 H
-ATOM 4360 1HB PHE E 9 18.767 34.990 0.686 1.00 0.00 H
-ATOM 4361 2HB PHE E 9 19.375 36.429 1.460 1.00 0.00 H
-ATOM 4362 HD1 PHE E 9 16.594 34.158 1.083 1.00 0.00 H
-ATOM 4363 HD2 PHE E 9 17.890 37.775 2.965 1.00 0.00 H
-ATOM 4364 HE1 PHE E 9 14.714 33.991 2.667 1.00 0.00 H
-ATOM 4365 HE2 PHE E 9 15.984 37.604 4.544 1.00 0.00 H
-ATOM 4366 HZ PHE E 9 14.423 35.708 4.387 1.00 0.00 H
-ATOM 4367 N VAL E 10 17.287 35.019 -1.571 1.00 37.70 N
-ATOM 4368 CA VAL E 10 16.217 34.270 -2.207 1.00 35.56 C
-ATOM 4369 C VAL E 10 16.131 32.884 -1.580 1.00 37.31 C
-ATOM 4370 O VAL E 10 17.137 32.343 -1.115 1.00 39.54 O
-ATOM 4371 CB VAL E 10 16.515 34.127 -3.713 1.00 38.13 C
-ATOM 4372 CG1 VAL E 10 16.633 35.517 -4.366 1.00 29.12 C
-ATOM 4373 CG2 VAL E 10 17.798 33.337 -3.895 1.00 34.52 C
-ATOM 4374 H VAL E 10 18.228 34.636 -1.525 1.00 0.00 H
-ATOM 4375 HA VAL E 10 15.267 34.789 -2.060 1.00 0.00 H
-ATOM 4376 HB VAL E 10 15.688 33.598 -4.196 1.00 0.00 H
-ATOM 4377 1HG1 VAL E 10 16.846 35.404 -5.419 1.00 0.00 H
-ATOM 4378 2HG1 VAL E 10 15.705 36.074 -4.235 1.00 0.00 H
-ATOM 4379 3HG1 VAL E 10 17.448 36.066 -3.903 1.00 0.00 H
-ATOM 4380 1HG2 VAL E 10 18.004 33.224 -4.958 1.00 0.00 H
-ATOM 4381 2HG2 VAL E 10 18.627 33.865 -3.418 1.00 0.00 H
-ATOM 4382 3HG2 VAL E 10 17.686 32.352 -3.440 1.00 0.00 H
-ATOM 4383 N VAL E 11 14.938 32.294 -1.600 1.00 36.87 N
-ATOM 4384 CA VAL E 11 14.752 30.930 -1.103 1.00 37.15 C
-ATOM 4385 C VAL E 11 14.428 30.023 -2.272 1.00 40.80 C
-ATOM 4386 O VAL E 11 13.456 30.263 -2.973 1.00 37.56 O
-ATOM 4387 CB VAL E 11 13.564 30.868 -0.132 1.00 36.00 C
-ATOM 4388 CG1 VAL E 11 13.370 29.451 0.370 1.00 30.17 C
-ATOM 4389 CG2 VAL E 11 13.764 31.854 1.003 1.00 30.80 C
-ATOM 4390 H VAL E 11 14.135 32.806 -1.958 1.00 0.00 H
-ATOM 4391 HA VAL E 11 15.658 30.587 -0.615 1.00 0.00 H
-ATOM 4392 HB VAL E 11 12.692 31.117 -0.668 1.00 0.00 H
-ATOM 4393 1HG1 VAL E 11 12.498 29.427 1.026 1.00 0.00 H
-ATOM 4394 2HG1 VAL E 11 13.202 28.790 -0.483 1.00 0.00 H
-ATOM 4395 3HG1 VAL E 11 14.241 29.121 0.912 1.00 0.00 H
-ATOM 4396 1HG2 VAL E 11 12.898 31.817 1.670 1.00 0.00 H
-ATOM 4397 2HG2 VAL E 11 14.648 31.598 1.554 1.00 0.00 H
-ATOM 4398 3HG2 VAL E 11 13.864 32.862 0.597 1.00 0.00 H
-ATOM 4399 N ILE E 12 15.242 28.992 -2.491 1.00 41.30 N
-ATOM 4400 CA ILE E 12 15.030 28.101 -3.628 1.00 38.42 C
-ATOM 4401 C ILE E 12 14.870 26.636 -3.197 1.00 38.25 C
-ATOM 4402 O ILE E 12 15.744 26.067 -2.544 1.00 39.89 O
-ATOM 4403 CB ILE E 12 16.222 28.220 -4.592 1.00 39.50 C
-ATOM 4404 CG1 ILE E 12 16.371 29.684 -5.054 1.00 36.54 C
-ATOM 4405 CG2 ILE E 12 15.980 27.312 -5.802 1.00 33.59 C
-ATOM 4406 CD1 ILE E 12 17.644 29.956 -5.742 1.00 34.23 C
-ATOM 4407 H ILE E 12 16.036 28.847 -1.883 1.00 0.00 H
-ATOM 4408 HA ILE E 12 14.125 28.401 -4.151 1.00 0.00 H
-ATOM 4409 HB ILE E 12 17.144 27.930 -4.083 1.00 0.00 H
-ATOM 4410 1HG1 ILE E 12 15.567 29.918 -5.728 1.00 0.00 H
-ATOM 4411 2HG1 ILE E 12 16.314 30.348 -4.201 1.00 0.00 H
-ATOM 4412 1HG2 ILE E 12 16.806 27.393 -6.491 1.00 0.00 H
-ATOM 4413 2HG2 ILE E 12 15.884 26.281 -5.469 1.00 0.00 H
-ATOM 4414 3HG2 ILE E 12 15.062 27.614 -6.305 1.00 0.00 H
-ATOM 4415 1HD1 ILE E 12 17.678 31.000 -6.050 1.00 0.00 H
-ATOM 4416 2HD1 ILE E 12 18.469 29.750 -5.060 1.00 0.00 H
-ATOM 4417 3HD1 ILE E 12 17.720 29.320 -6.596 1.00 0.00 H
-ATOM 4418 N LYS E 13 13.755 26.020 -3.588 1.00 35.71 N
-ATOM 4419 CA LYS E 13 13.487 24.621 -3.257 1.00 35.63 C
-ATOM 4420 C LYS E 13 13.407 23.702 -4.449 1.00 37.22 C
-ATOM 4421 O LYS E 13 12.639 23.922 -5.385 1.00 36.22 O
-ATOM 4422 CB LYS E 13 12.196 24.485 -2.484 1.00 33.34 C
-ATOM 4423 CG LYS E 13 11.828 23.047 -2.184 1.00 20.10 C
-ATOM 4424 CD LYS E 13 10.557 22.947 -1.402 1.00 35.89 C
-ATOM 4425 CE LYS E 13 10.158 21.496 -1.232 1.00 29.95 C
-ATOM 4426 NZ LYS E 13 8.951 21.362 -0.403 1.00 34.51 N
-ATOM 4427 H LYS E 13 13.057 26.544 -4.103 1.00 0.00 H
-ATOM 4428 HA LYS E 13 14.298 24.259 -2.631 1.00 0.00 H
-ATOM 4429 1HB LYS E 13 12.322 24.983 -1.542 1.00 0.00 H
-ATOM 4430 2HB LYS E 13 11.384 24.966 -3.018 1.00 0.00 H
-ATOM 4431 1HG LYS E 13 11.695 22.506 -3.119 1.00 0.00 H
-ATOM 4432 2HG LYS E 13 12.635 22.566 -1.625 1.00 0.00 H
-ATOM 4433 1HD LYS E 13 10.692 23.398 -0.415 1.00 0.00 H
-ATOM 4434 2HD LYS E 13 9.763 23.481 -1.926 1.00 0.00 H
-ATOM 4435 1HE LYS E 13 9.967 21.062 -2.214 1.00 0.00 H
-ATOM 4436 2HE LYS E 13 10.976 20.953 -0.755 1.00 0.00 H
-ATOM 4437 1HZ LYS E 13 8.709 20.389 -0.295 1.00 0.00 H
-ATOM 4438 2HZ LYS E 13 9.169 21.767 0.516 1.00 0.00 H
-ATOM 4439 3HZ LYS E 13 8.183 21.858 -0.824 1.00 0.00 H
-ATOM 4440 N ALA E 14 14.187 22.639 -4.425 1.00 39.21 N
-ATOM 4441 CA ALA E 14 14.151 21.712 -5.541 1.00 38.92 C
-ATOM 4442 C ALA E 14 12.846 20.926 -5.575 1.00 40.10 C
-ATOM 4443 O ALA E 14 12.469 20.282 -4.587 1.00 35.62 O
-ATOM 4444 CB ALA E 14 15.300 20.751 -5.451 1.00 39.23 C
-ATOM 4445 H ALA E 14 14.803 22.473 -3.621 1.00 0.00 H
-ATOM 4446 HA ALA E 14 14.222 22.290 -6.462 1.00 0.00 H
-ATOM 4447 1HB ALA E 14 15.289 20.063 -6.290 1.00 0.00 H
-ATOM 4448 2HB ALA E 14 16.209 21.294 -5.453 1.00 0.00 H
-ATOM 4449 3HB ALA E 14 15.202 20.208 -4.531 1.00 0.00 H
-ATOM 4450 N LEU E 15 12.188 20.910 -6.732 1.00 40.83 N
-ATOM 4451 CA LEU E 15 10.973 20.115 -6.917 1.00 42.76 C
-ATOM 4452 C LEU E 15 11.289 18.808 -7.641 1.00 45.52 C
-ATOM 4453 O LEU E 15 10.434 17.929 -7.780 1.00 49.04 O
-ATOM 4454 CB LEU E 15 9.922 20.947 -7.654 1.00 41.63 C
-ATOM 4455 CG LEU E 15 8.966 21.808 -6.761 1.00 46.79 C
-ATOM 4456 CD1 LEU E 15 9.735 22.445 -5.622 1.00 25.40 C
-ATOM 4457 CD2 LEU E 15 8.355 22.907 -7.627 1.00 33.57 C
-ATOM 4458 H LEU E 15 12.521 21.468 -7.521 1.00 0.00 H
-ATOM 4459 HA LEU E 15 10.575 19.867 -5.934 1.00 0.00 H
-ATOM 4460 1HB LEU E 15 10.441 21.629 -8.305 1.00 0.00 H
-ATOM 4461 2HB LEU E 15 9.315 20.282 -8.268 1.00 0.00 H
-ATOM 4462 HG LEU E 15 8.180 21.178 -6.340 1.00 0.00 H
-ATOM 4463 1HD1 LEU E 15 9.061 23.048 -5.015 1.00 0.00 H
-ATOM 4464 2HD1 LEU E 15 10.173 21.668 -5.002 1.00 0.00 H
-ATOM 4465 3HD1 LEU E 15 10.502 23.061 -6.022 1.00 0.00 H
-ATOM 4466 1HD2 LEU E 15 7.685 23.526 -7.031 1.00 0.00 H
-ATOM 4467 2HD2 LEU E 15 9.146 23.526 -8.035 1.00 0.00 H
-ATOM 4468 3HD2 LEU E 15 7.794 22.466 -8.439 1.00 0.00 H
-ATOM 4469 N GLU E 16 12.541 18.691 -8.072 1.00 45.55 N
-ATOM 4470 CA GLU E 16 13.052 17.521 -8.780 1.00 47.16 C
-ATOM 4471 C GLU E 16 14.541 17.345 -8.500 1.00 45.25 C
-ATOM 4472 O GLU E 16 15.205 18.260 -8.028 1.00 45.86 O
-ATOM 4473 CB GLU E 16 12.798 17.631 -10.289 1.00 39.48 C
-ATOM 4474 CG GLU E 16 13.502 18.786 -11.004 1.00 35.61 C
-ATOM 4475 CD GLU E 16 13.170 18.812 -12.487 1.00 46.16 C
-ATOM 4476 OE1 GLU E 16 12.517 17.901 -12.943 1.00 46.06 O
-ATOM 4477 OE2 GLU E 16 13.527 19.764 -13.154 1.00 42.95 O
-ATOM 4478 H GLU E 16 13.165 19.466 -7.908 1.00 0.00 H
-ATOM 4479 HA GLU E 16 12.532 16.638 -8.410 1.00 0.00 H
-ATOM 4480 1HB GLU E 16 13.096 16.702 -10.775 1.00 0.00 H
-ATOM 4481 2HB GLU E 16 11.731 17.761 -10.460 1.00 0.00 H
-ATOM 4482 1HG GLU E 16 13.206 19.727 -10.548 1.00 0.00 H
-ATOM 4483 2HG GLU E 16 14.581 18.675 -10.876 1.00 0.00 H
-ATOM 4484 N ASP E 17 15.066 16.154 -8.743 1.00 43.85 N
-ATOM 4485 CA ASP E 17 16.499 15.932 -8.564 1.00 44.90 C
-ATOM 4486 C ASP E 17 17.313 16.730 -9.579 1.00 42.54 C
-ATOM 4487 O ASP E 17 16.875 16.911 -10.714 1.00 38.73 O
-ATOM 4488 CB ASP E 17 16.823 14.446 -8.652 1.00 48.52 C
-ATOM 4489 CG ASP E 17 16.301 13.687 -7.446 1.00 49.84 C
-ATOM 4490 OD1 ASP E 17 15.925 14.328 -6.478 1.00 62.54 O
-ATOM 4491 OD2 ASP E 17 16.261 12.482 -7.495 1.00 61.15 O
-ATOM 4492 H ASP E 17 14.482 15.411 -9.102 1.00 0.00 H
-ATOM 4493 HA ASP E 17 16.774 16.274 -7.580 1.00 0.00 H
-ATOM 4494 1HB ASP E 17 16.389 14.022 -9.554 1.00 0.00 H
-ATOM 4495 2HB ASP E 17 17.910 14.313 -8.709 1.00 0.00 H
-ATOM 4496 N GLY E 18 18.515 17.169 -9.196 1.00 41.03 N
-ATOM 4497 CA GLY E 18 19.382 17.860 -10.157 1.00 38.37 C
-ATOM 4498 C GLY E 18 19.094 19.352 -10.421 1.00 40.50 C
-ATOM 4499 O GLY E 18 19.435 19.858 -11.493 1.00 41.61 O
-ATOM 4500 H GLY E 18 18.859 16.989 -8.243 1.00 0.00 H
-ATOM 4501 1HA GLY E 18 20.410 17.759 -9.814 1.00 0.00 H
-ATOM 4502 2HA GLY E 18 19.330 17.324 -11.102 1.00 0.00 H
-ATOM 4503 N VAL E 19 18.454 20.055 -9.492 1.00 38.22 N
-ATOM 4504 CA VAL E 19 18.188 21.489 -9.653 1.00 37.27 C
-ATOM 4505 C VAL E 19 19.480 22.247 -9.447 1.00 36.63 C
-ATOM 4506 O VAL E 19 20.232 21.936 -8.528 1.00 38.03 O
-ATOM 4507 CB VAL E 19 17.099 21.966 -8.678 1.00 34.20 C
-ATOM 4508 CG1 VAL E 19 16.956 23.501 -8.693 1.00 35.14 C
-ATOM 4509 CG2 VAL E 19 15.797 21.326 -9.093 1.00 35.29 C
-ATOM 4510 H VAL E 19 18.193 19.609 -8.613 1.00 0.00 H
-ATOM 4511 HA VAL E 19 17.834 21.670 -10.673 1.00 0.00 H
-ATOM 4512 HB VAL E 19 17.358 21.656 -7.684 1.00 0.00 H
-ATOM 4513 1HG1 VAL E 19 16.185 23.792 -7.991 1.00 0.00 H
-ATOM 4514 2HG1 VAL E 19 17.901 23.960 -8.395 1.00 0.00 H
-ATOM 4515 3HG1 VAL E 19 16.687 23.843 -9.698 1.00 0.00 H
-ATOM 4516 1HG2 VAL E 19 15.008 21.613 -8.427 1.00 0.00 H
-ATOM 4517 2HG2 VAL E 19 15.540 21.637 -10.103 1.00 0.00 H
-ATOM 4518 3HG2 VAL E 19 15.920 20.254 -9.072 1.00 0.00 H
-ATOM 4519 N ASN E 20 19.779 23.206 -10.308 1.00 34.47 N
-ATOM 4520 CA ASN E 20 21.039 23.926 -10.181 1.00 32.65 C
-ATOM 4521 C ASN E 20 20.871 25.428 -10.020 1.00 35.80 C
-ATOM 4522 O ASN E 20 20.248 26.099 -10.850 1.00 36.34 O
-ATOM 4523 CB ASN E 20 21.954 23.593 -11.345 1.00 44.77 C
-ATOM 4524 CG ASN E 20 22.449 22.144 -11.315 1.00 53.85 C
-ATOM 4525 OD1 ASN E 20 23.378 21.800 -10.574 1.00 61.09 O
-ATOM 4526 ND2 ASN E 20 21.842 21.296 -12.099 1.00 45.61 N
-ATOM 4527 H ASN E 20 19.121 23.441 -11.053 1.00 0.00 H
-ATOM 4528 HA ASN E 20 21.535 23.581 -9.273 1.00 0.00 H
-ATOM 4529 1HB ASN E 20 21.425 23.767 -12.283 1.00 0.00 H
-ATOM 4530 2HB ASN E 20 22.819 24.260 -11.327 1.00 0.00 H
-ATOM 4531 1HD2 ASN E 20 22.119 20.336 -12.112 1.00 0.00 H
-ATOM 4532 2HD2 ASN E 20 21.084 21.598 -12.677 1.00 0.00 H
-ATOM 4533 N VAL E 21 21.410 25.946 -8.917 1.00 35.00 N
-ATOM 4534 CA VAL E 21 21.346 27.372 -8.641 1.00 36.34 C
-ATOM 4535 C VAL E 21 22.712 27.975 -8.951 1.00 35.14 C
-ATOM 4536 O VAL E 21 23.723 27.606 -8.346 1.00 35.64 O
-ATOM 4537 CB VAL E 21 20.960 27.617 -7.180 1.00 27.75 C
-ATOM 4538 CG1 VAL E 21 20.896 29.097 -6.928 1.00 28.77 C
-ATOM 4539 CG2 VAL E 21 19.633 26.931 -6.897 1.00 28.32 C
-ATOM 4540 H VAL E 21 21.888 25.330 -8.258 1.00 0.00 H
-ATOM 4541 HA VAL E 21 20.600 27.835 -9.289 1.00 0.00 H
-ATOM 4542 HB VAL E 21 21.729 27.208 -6.526 1.00 0.00 H
-ATOM 4543 1HG1 VAL E 21 20.638 29.285 -5.891 1.00 0.00 H
-ATOM 4544 2HG1 VAL E 21 21.866 29.542 -7.145 1.00 0.00 H
-ATOM 4545 3HG1 VAL E 21 20.142 29.532 -7.578 1.00 0.00 H
-ATOM 4546 1HG2 VAL E 21 19.345 27.092 -5.859 1.00 0.00 H
-ATOM 4547 2HG2 VAL E 21 18.875 27.339 -7.557 1.00 0.00 H
-ATOM 4548 3HG2 VAL E 21 19.734 25.858 -7.079 1.00 0.00 H
-ATOM 4549 N ILE E 22 22.740 28.868 -9.930 1.00 35.05 N
-ATOM 4550 CA ILE E 22 23.985 29.385 -10.468 1.00 35.91 C
-ATOM 4551 C ILE E 22 24.277 30.819 -10.060 1.00 37.69 C
-ATOM 4552 O ILE E 22 23.447 31.712 -10.236 1.00 40.31 O
-ATOM 4553 CB ILE E 22 23.934 29.321 -11.998 1.00 36.75 C
-ATOM 4554 CG1 ILE E 22 23.705 27.880 -12.459 1.00 36.75 C
-ATOM 4555 CG2 ILE E 22 25.238 29.826 -12.567 1.00 37.85 C
-ATOM 4556 CD1 ILE E 22 23.340 27.778 -13.924 1.00 33.68 C
-ATOM 4557 H ILE E 22 21.871 29.153 -10.360 1.00 0.00 H
-ATOM 4558 HA ILE E 22 24.796 28.759 -10.118 1.00 0.00 H
-ATOM 4559 HB ILE E 22 23.112 29.924 -12.362 1.00 0.00 H
-ATOM 4560 1HG1 ILE E 22 24.614 27.305 -12.281 1.00 0.00 H
-ATOM 4561 2HG1 ILE E 22 22.895 27.439 -11.872 1.00 0.00 H
-ATOM 4562 1HG2 ILE E 22 25.182 29.769 -13.639 1.00 0.00 H
-ATOM 4563 2HG2 ILE E 22 25.408 30.853 -12.267 1.00 0.00 H
-ATOM 4564 3HG2 ILE E 22 26.060 29.203 -12.205 1.00 0.00 H
-ATOM 4565 1HD1 ILE E 22 23.191 26.730 -14.189 1.00 0.00 H
-ATOM 4566 2HD1 ILE E 22 22.417 28.335 -14.106 1.00 0.00 H
-ATOM 4567 3HD1 ILE E 22 24.142 28.196 -14.527 1.00 0.00 H
-ATOM 4568 N GLY E 23 25.467 31.044 -9.512 1.00 34.78 N
-ATOM 4569 CA GLY E 23 25.866 32.396 -9.148 1.00 33.76 C
-ATOM 4570 C GLY E 23 26.567 33.055 -10.330 1.00 36.76 C
-ATOM 4571 O GLY E 23 27.498 32.479 -10.909 1.00 38.56 O
-ATOM 4572 H GLY E 23 26.109 30.265 -9.388 1.00 0.00 H
-ATOM 4573 1HA GLY E 23 24.988 32.981 -8.863 1.00 0.00 H
-ATOM 4574 2HA GLY E 23 26.534 32.364 -8.288 1.00 0.00 H
-ATOM 4575 N LEU E 24 26.130 34.276 -10.657 1.00 35.03 N
-ATOM 4576 CA LEU E 24 26.680 35.081 -11.747 1.00 35.89 C
-ATOM 4577 C LEU E 24 27.523 36.226 -11.184 1.00 37.63 C
-ATOM 4578 O LEU E 24 27.061 36.980 -10.305 1.00 35.33 O
-ATOM 4579 CB LEU E 24 25.537 35.644 -12.591 1.00 30.73 C
-ATOM 4580 CG LEU E 24 24.850 34.679 -13.592 1.00 33.48 C
-ATOM 4581 CD1 LEU E 24 24.006 33.645 -12.838 1.00 36.93 C
-ATOM 4582 CD2 LEU E 24 23.963 35.470 -14.540 1.00 35.44 C
-ATOM 4583 H LEU E 24 25.340 34.659 -10.143 1.00 0.00 H
-ATOM 4584 HA LEU E 24 27.309 34.449 -12.368 1.00 0.00 H
-ATOM 4585 1HB LEU E 24 24.789 35.962 -11.907 1.00 0.00 H
-ATOM 4586 2HB LEU E 24 25.894 36.507 -13.132 1.00 0.00 H
-ATOM 4587 HG LEU E 24 25.608 34.159 -14.155 1.00 0.00 H
-ATOM 4588 1HD1 LEU E 24 23.539 32.969 -13.552 1.00 0.00 H
-ATOM 4589 2HD1 LEU E 24 24.625 33.077 -12.178 1.00 0.00 H
-ATOM 4590 3HD1 LEU E 24 23.233 34.152 -12.259 1.00 0.00 H
-ATOM 4591 1HD2 LEU E 24 23.490 34.787 -15.246 1.00 0.00 H
-ATOM 4592 2HD2 LEU E 24 23.198 35.988 -13.973 1.00 0.00 H
-ATOM 4593 3HD2 LEU E 24 24.560 36.195 -15.090 1.00 0.00 H
-ATOM 4594 N THR E 25 28.752 36.369 -11.699 1.00 37.25 N
-ATOM 4595 CA THR E 25 29.697 37.316 -11.112 1.00 35.94 C
-ATOM 4596 C THR E 25 29.319 38.778 -11.205 1.00 38.06 C
-ATOM 4597 O THR E 25 28.767 39.245 -12.205 1.00 41.21 O
-ATOM 4598 CB THR E 25 31.121 37.184 -11.709 1.00 40.58 C
-ATOM 4599 OG1 THR E 25 31.105 37.416 -13.125 1.00 34.18 O
-ATOM 4600 CG2 THR E 25 31.674 35.812 -11.436 1.00 30.79 C
-ATOM 4601 H THR E 25 29.053 35.740 -12.438 1.00 0.00 H
-ATOM 4602 HA THR E 25 29.776 37.060 -10.067 1.00 0.00 H
-ATOM 4603 HB THR E 25 31.780 37.917 -11.244 1.00 0.00 H
-ATOM 4604 HG1 THR E 25 31.336 38.353 -13.342 1.00 0.00 H
-ATOM 4605 1HG2 THR E 25 32.678 35.733 -11.850 1.00 0.00 H
-ATOM 4606 2HG2 THR E 25 31.712 35.652 -10.362 1.00 0.00 H
-ATOM 4607 3HG2 THR E 25 31.044 35.064 -11.885 1.00 0.00 H
-ATOM 4608 N ARG E 26 29.685 39.487 -10.139 1.00 37.59 N
-ATOM 4609 CA ARG E 26 29.553 40.929 -10.005 1.00 35.86 C
-ATOM 4610 C ARG E 26 30.728 41.645 -10.657 1.00 36.05 C
-ATOM 4611 O ARG E 26 31.886 41.308 -10.405 1.00 36.01 O
-ATOM 4612 CB ARG E 26 29.490 41.325 -8.531 1.00 29.42 C
-ATOM 4613 CG ARG E 26 29.216 42.805 -8.279 1.00 30.81 C
-ATOM 4614 CD ARG E 26 29.187 43.149 -6.825 1.00 31.23 C
-ATOM 4615 NE ARG E 26 28.143 42.440 -6.108 1.00 37.50 N
-ATOM 4616 CZ ARG E 26 26.848 42.777 -6.092 1.00 30.68 C
-ATOM 4617 NH1 ARG E 26 26.423 43.820 -6.766 1.00 29.31 N
-ATOM 4618 NH2 ARG E 26 26.031 42.033 -5.387 1.00 29.50 N
-ATOM 4619 H ARG E 26 30.077 38.963 -9.361 1.00 0.00 H
-ATOM 4620 HA ARG E 26 28.637 41.244 -10.504 1.00 0.00 H
-ATOM 4621 1HB ARG E 26 28.715 40.748 -8.025 1.00 0.00 H
-ATOM 4622 2HB ARG E 26 30.436 41.079 -8.046 1.00 0.00 H
-ATOM 4623 1HG ARG E 26 30.003 43.398 -8.742 1.00 0.00 H
-ATOM 4624 2HG ARG E 26 28.257 43.075 -8.715 1.00 0.00 H
-ATOM 4625 1HD ARG E 26 30.142 42.895 -6.372 1.00 0.00 H
-ATOM 4626 2HD ARG E 26 29.010 44.216 -6.714 1.00 0.00 H
-ATOM 4627 HE ARG E 26 28.400 41.620 -5.543 1.00 0.00 H
-ATOM 4628 1HH1 ARG E 26 27.080 44.371 -7.291 1.00 0.00 H
-ATOM 4629 2HH1 ARG E 26 25.444 44.074 -6.747 1.00 0.00 H
-ATOM 4630 1HH2 ARG E 26 26.437 41.243 -4.875 1.00 0.00 H
-ATOM 4631 2HH2 ARG E 26 25.028 42.220 -5.349 1.00 0.00 H
-ATOM 4632 N GLY E 27 30.439 42.643 -11.482 1.00 34.35 N
-ATOM 4633 CA GLY E 27 31.493 43.416 -12.127 1.00 36.26 C
-ATOM 4634 C GLY E 27 31.249 43.556 -13.619 1.00 38.67 C
-ATOM 4635 O GLY E 27 30.191 43.183 -14.126 1.00 39.41 O
-ATOM 4636 H GLY E 27 29.473 42.869 -11.671 1.00 0.00 H
-ATOM 4637 1HA GLY E 27 31.546 44.403 -11.671 1.00 0.00 H
-ATOM 4638 2HA GLY E 27 32.456 42.937 -11.959 1.00 0.00 H
-ATOM 4639 N ALA E 28 32.231 44.113 -14.327 1.00 39.86 N
-ATOM 4640 CA ALA E 28 32.119 44.333 -15.766 1.00 41.53 C
-ATOM 4641 C ALA E 28 31.898 43.021 -16.512 1.00 42.24 C
-ATOM 4642 O ALA E 28 31.183 42.978 -17.510 1.00 38.94 O
-ATOM 4643 CB ALA E 28 33.374 45.011 -16.288 1.00 23.40 C
-ATOM 4644 H ALA E 28 33.075 44.396 -13.850 1.00 0.00 H
-ATOM 4645 HA ALA E 28 31.257 44.977 -15.946 1.00 0.00 H
-ATOM 4646 1HB ALA E 28 33.273 45.190 -17.359 1.00 0.00 H
-ATOM 4647 2HB ALA E 28 33.519 45.957 -15.773 1.00 0.00 H
-ATOM 4648 3HB ALA E 28 34.233 44.362 -16.111 1.00 0.00 H
-ATOM 4649 N ASP E 29 32.538 41.960 -16.026 1.00 42.10 N
-ATOM 4650 CA ASP E 29 32.433 40.640 -16.627 1.00 40.64 C
-ATOM 4651 C ASP E 29 31.487 39.749 -15.830 1.00 41.90 C
-ATOM 4652 O ASP E 29 31.760 39.444 -14.663 1.00 40.36 O
-ATOM 4653 CB ASP E 29 33.808 39.968 -16.694 1.00 51.92 C
-ATOM 4654 CG ASP E 29 34.783 40.633 -17.679 1.00 56.63 C
-ATOM 4655 OD1 ASP E 29 34.349 41.116 -18.694 1.00 53.40 O
-ATOM 4656 OD2 ASP E 29 35.955 40.640 -17.399 1.00 57.08 O
-ATOM 4657 H ASP E 29 33.104 42.079 -15.200 1.00 0.00 H
-ATOM 4658 HA ASP E 29 32.035 40.744 -17.636 1.00 0.00 H
-ATOM 4659 1HB ASP E 29 34.258 39.967 -15.701 1.00 0.00 H
-ATOM 4660 2HB ASP E 29 33.676 38.928 -16.987 1.00 0.00 H
-ATOM 4661 N THR E 30 30.400 39.315 -16.464 1.00 40.01 N
-ATOM 4662 CA THR E 30 29.437 38.441 -15.803 1.00 36.95 C
-ATOM 4663 C THR E 30 29.633 37.003 -16.273 1.00 41.64 C
-ATOM 4664 O THR E 30 29.410 36.678 -17.438 1.00 41.56 O
-ATOM 4665 CB THR E 30 27.995 38.888 -16.071 1.00 29.76 C
-ATOM 4666 OG1 THR E 30 27.802 40.208 -15.546 1.00 42.16 O
-ATOM 4667 CG2 THR E 30 27.037 37.938 -15.403 1.00 34.63 C
-ATOM 4668 H THR E 30 30.234 39.611 -17.416 1.00 0.00 H
-ATOM 4669 HA THR E 30 29.599 38.480 -14.729 1.00 0.00 H
-ATOM 4670 HB THR E 30 27.812 38.901 -17.142 1.00 0.00 H
-ATOM 4671 HG1 THR E 30 28.040 40.212 -14.604 1.00 0.00 H
-ATOM 4672 1HG2 THR E 30 26.014 38.260 -15.592 1.00 0.00 H
-ATOM 4673 2HG2 THR E 30 27.182 36.931 -15.802 1.00 0.00 H
-ATOM 4674 3HG2 THR E 30 27.234 37.939 -14.332 1.00 0.00 H
-ATOM 4675 N ARG E 31 30.074 36.155 -15.354 1.00 43.55 N
-ATOM 4676 CA ARG E 31 30.418 34.770 -15.636 1.00 42.29 C
-ATOM 4677 C ARG E 31 29.836 33.851 -14.579 1.00 44.54 C
-ATOM 4678 O ARG E 31 29.486 34.289 -13.488 1.00 42.17 O
-ATOM 4679 CB ARG E 31 31.934 34.612 -15.654 1.00 40.91 C
-ATOM 4680 CG ARG E 31 32.654 35.488 -16.681 1.00 56.34 C
-ATOM 4681 CD ARG E 31 34.133 35.331 -16.629 1.00 58.75 C
-ATOM 4682 NE ARG E 31 34.791 36.221 -17.578 1.00 58.39 N
-ATOM 4683 CZ ARG E 31 36.121 36.421 -17.662 1.00 63.66 C
-ATOM 4684 NH1 ARG E 31 36.940 35.783 -16.852 1.00 53.38 N
-ATOM 4685 NH2 ARG E 31 36.600 37.262 -18.558 1.00 61.93 N
-ATOM 4686 H ARG E 31 30.236 36.515 -14.427 1.00 0.00 H
-ATOM 4687 HA ARG E 31 30.010 34.491 -16.607 1.00 0.00 H
-ATOM 4688 1HB ARG E 31 32.332 34.859 -14.669 1.00 0.00 H
-ATOM 4689 2HB ARG E 31 32.192 33.573 -15.859 1.00 0.00 H
-ATOM 4690 1HG ARG E 31 32.310 35.232 -17.683 1.00 0.00 H
-ATOM 4691 2HG ARG E 31 32.430 36.536 -16.479 1.00 0.00 H
-ATOM 4692 1HD ARG E 31 34.487 35.578 -15.628 1.00 0.00 H
-ATOM 4693 2HD ARG E 31 34.406 34.304 -16.871 1.00 0.00 H
-ATOM 4694 HE ARG E 31 34.204 36.734 -18.222 1.00 0.00 H
-ATOM 4695 1HH1 ARG E 31 36.574 35.140 -16.165 1.00 0.00 H
-ATOM 4696 2HH1 ARG E 31 37.935 35.941 -16.918 1.00 0.00 H
-ATOM 4697 1HH2 ARG E 31 35.969 37.757 -19.178 1.00 0.00 H
-ATOM 4698 2HH2 ARG E 31 37.592 37.425 -18.621 1.00 0.00 H
-ATOM 4699 N PHE E 32 29.724 32.570 -14.874 1.00 42.60 N
-ATOM 4700 CA PHE E 32 29.291 31.675 -13.811 1.00 44.41 C
-ATOM 4701 C PHE E 32 30.484 31.419 -12.912 1.00 43.70 C
-ATOM 4702 O PHE E 32 31.590 31.214 -13.416 1.00 47.46 O
-ATOM 4703 CB PHE E 32 28.806 30.350 -14.376 1.00 39.36 C
-ATOM 4704 CG PHE E 32 27.556 30.463 -15.139 1.00 52.91 C
-ATOM 4705 CD1 PHE E 32 26.833 31.641 -15.124 1.00 58.13 C
-ATOM 4706 CD2 PHE E 32 27.090 29.398 -15.887 1.00 50.89 C
-ATOM 4707 CE1 PHE E 32 25.668 31.749 -15.846 1.00 52.47 C
-ATOM 4708 CE2 PHE E 32 25.927 29.506 -16.606 1.00 50.89 C
-ATOM 4709 CZ PHE E 32 25.221 30.688 -16.582 1.00 47.86 C
-ATOM 4710 H PHE E 32 29.968 32.215 -15.788 1.00 0.00 H
-ATOM 4711 HA PHE E 32 28.497 32.147 -13.230 1.00 0.00 H
-ATOM 4712 1HB PHE E 32 29.570 29.927 -15.027 1.00 0.00 H
-ATOM 4713 2HB PHE E 32 28.644 29.648 -13.559 1.00 0.00 H
-ATOM 4714 HD1 PHE E 32 27.196 32.481 -14.534 1.00 0.00 H
-ATOM 4715 HD2 PHE E 32 27.659 28.467 -15.903 1.00 0.00 H
-ATOM 4716 HE1 PHE E 32 25.098 32.678 -15.843 1.00 0.00 H
-ATOM 4717 HE2 PHE E 32 25.568 28.663 -17.194 1.00 0.00 H
-ATOM 4718 HZ PHE E 32 24.311 30.783 -17.150 1.00 0.00 H
-ATOM 4719 N HIS E 33 30.283 31.398 -11.598 1.00 40.75 N
-ATOM 4720 CA HIS E 33 31.422 31.079 -10.738 1.00 35.13 C
-ATOM 4721 C HIS E 33 31.115 29.936 -9.772 1.00 33.46 C
-ATOM 4722 O HIS E 33 32.018 29.395 -9.134 1.00 33.99 O
-ATOM 4723 CB HIS E 33 31.881 32.313 -9.953 1.00 38.20 C
-ATOM 4724 CG HIS E 33 30.953 32.790 -8.863 1.00 35.81 C
-ATOM 4725 ND1 HIS E 33 30.960 32.211 -7.616 1.00 24.82 N
-ATOM 4726 CD2 HIS E 33 30.013 33.770 -8.816 1.00 30.87 C
-ATOM 4727 CE1 HIS E 33 30.083 32.813 -6.845 1.00 33.19 C
-ATOM 4728 NE2 HIS E 33 29.495 33.762 -7.542 1.00 28.32 N
-ATOM 4729 H HIS E 33 29.362 31.626 -11.225 1.00 0.00 H
-ATOM 4730 HA HIS E 33 32.261 30.756 -11.353 1.00 0.00 H
-ATOM 4731 1HB HIS E 33 32.844 32.099 -9.492 1.00 0.00 H
-ATOM 4732 2HB HIS E 33 32.036 33.128 -10.648 1.00 0.00 H
-ATOM 4733 HD2 HIS E 33 29.724 34.439 -9.621 1.00 0.00 H
-ATOM 4734 HE1 HIS E 33 29.882 32.564 -5.801 1.00 0.00 H
-ATOM 4735 HE2 HIS E 33 28.777 34.373 -7.179 1.00 0.00 H
-ATOM 4736 N HIS E 34 29.844 29.566 -9.674 1.00 31.35 N
-ATOM 4737 CA HIS E 34 29.411 28.511 -8.762 1.00 34.30 C
-ATOM 4738 C HIS E 34 28.046 27.966 -9.141 1.00 34.18 C
-ATOM 4739 O HIS E 34 27.143 28.712 -9.520 1.00 36.42 O
-ATOM 4740 CB HIS E 34 29.367 28.982 -7.302 1.00 25.61 C
-ATOM 4741 CG HIS E 34 29.074 27.853 -6.323 1.00 20.52 C
-ATOM 4742 ND1 HIS E 34 30.014 26.901 -5.984 1.00 28.12 N
-ATOM 4743 CD2 HIS E 34 27.947 27.530 -5.630 1.00 26.31 C
-ATOM 4744 CE1 HIS E 34 29.483 26.042 -5.123 1.00 25.35 C
-ATOM 4745 NE2 HIS E 34 28.229 26.401 -4.893 1.00 31.85 N
-ATOM 4746 H HIS E 34 29.161 30.043 -10.240 1.00 0.00 H
-ATOM 4747 HA HIS E 34 30.114 27.681 -8.816 1.00 0.00 H
-ATOM 4748 1HB HIS E 34 30.328 29.422 -7.031 1.00 0.00 H
-ATOM 4749 2HB HIS E 34 28.608 29.754 -7.187 1.00 0.00 H
-ATOM 4750 HD2 HIS E 34 26.995 28.061 -5.655 1.00 0.00 H
-ATOM 4751 HE1 HIS E 34 29.993 25.186 -4.681 1.00 0.00 H
-ATOM 4752 HE2 HIS E 34 27.569 25.909 -4.266 1.00 0.00 H
-ATOM 4753 N SER E 35 27.884 26.658 -9.001 1.00 34.82 N
-ATOM 4754 CA SER E 35 26.602 26.017 -9.265 1.00 36.37 C
-ATOM 4755 C SER E 35 26.268 25.036 -8.145 1.00 36.42 C
-ATOM 4756 O SER E 35 26.929 24.006 -7.989 1.00 34.00 O
-ATOM 4757 CB SER E 35 26.658 25.312 -10.610 1.00 37.90 C
-ATOM 4758 OG SER E 35 25.473 24.628 -10.873 1.00 47.40 O
-ATOM 4759 H SER E 35 28.664 26.095 -8.687 1.00 0.00 H
-ATOM 4760 HA SER E 35 25.827 26.779 -9.294 1.00 0.00 H
-ATOM 4761 1HB SER E 35 26.835 26.049 -11.396 1.00 0.00 H
-ATOM 4762 2HB SER E 35 27.493 24.615 -10.621 1.00 0.00 H
-ATOM 4763 HG SER E 35 25.380 23.984 -10.164 1.00 0.00 H
-ATOM 4764 N GLU E 36 25.264 25.387 -7.342 1.00 40.00 N
-ATOM 4765 CA GLU E 36 24.882 24.577 -6.190 1.00 42.65 C
-ATOM 4766 C GLU E 36 23.768 23.614 -6.573 1.00 43.08 C
-ATOM 4767 O GLU E 36 22.691 24.032 -7.008 1.00 42.72 O
-ATOM 4768 CB GLU E 36 24.446 25.455 -5.004 1.00 38.79 C
-ATOM 4769 CG GLU E 36 24.182 24.673 -3.691 1.00 34.96 C
-ATOM 4770 CD GLU E 36 25.463 24.087 -3.074 1.00 38.12 C
-ATOM 4771 OE1 GLU E 36 26.506 24.689 -3.230 1.00 33.27 O
-ATOM 4772 OE2 GLU E 36 25.394 23.036 -2.448 1.00 35.58 O
-ATOM 4773 H GLU E 36 24.747 26.238 -7.551 1.00 0.00 H
-ATOM 4774 HA GLU E 36 25.746 23.991 -5.878 1.00 0.00 H
-ATOM 4775 1HB GLU E 36 25.204 26.208 -4.801 1.00 0.00 H
-ATOM 4776 2HB GLU E 36 23.527 25.979 -5.264 1.00 0.00 H
-ATOM 4777 1HG GLU E 36 23.735 25.351 -2.965 1.00 0.00 H
-ATOM 4778 2HG GLU E 36 23.464 23.874 -3.887 1.00 0.00 H
-ATOM 4779 N LYS E 37 24.038 22.318 -6.461 1.00 44.40 N
-ATOM 4780 CA LYS E 37 23.045 21.329 -6.849 1.00 45.27 C
-ATOM 4781 C LYS E 37 22.094 21.010 -5.700 1.00 44.97 C
-ATOM 4782 O LYS E 37 22.533 20.755 -4.570 1.00 47.03 O
-ATOM 4783 CB LYS E 37 23.709 20.041 -7.330 1.00 43.10 C
-ATOM 4784 CG LYS E 37 22.726 19.005 -7.873 1.00 58.73 C
-ATOM 4785 CD LYS E 37 23.452 17.818 -8.498 1.00 45.00 C
-ATOM 4786 CE LYS E 37 24.072 16.935 -7.420 1.00 45.00 C
-ATOM 4787 NZ LYS E 37 24.651 15.687 -7.984 1.00 45.00 N
-ATOM 4788 H LYS E 37 24.939 22.024 -6.109 1.00 0.00 H
-ATOM 4789 HA LYS E 37 22.461 21.735 -7.672 1.00 0.00 H
-ATOM 4790 1HB LYS E 37 24.417 20.277 -8.127 1.00 0.00 H
-ATOM 4791 2HB LYS E 37 24.266 19.585 -6.514 1.00 0.00 H
-ATOM 4792 1HG LYS E 37 22.087 18.640 -7.062 1.00 0.00 H
-ATOM 4793 2HG LYS E 37 22.085 19.479 -8.625 1.00 0.00 H
-ATOM 4794 1HD LYS E 37 22.749 17.224 -9.081 1.00 0.00 H
-ATOM 4795 2HD LYS E 37 24.239 18.180 -9.161 1.00 0.00 H
-ATOM 4796 1HE LYS E 37 24.858 17.492 -6.913 1.00 0.00 H
-ATOM 4797 2HE LYS E 37 23.298 16.668 -6.693 1.00 0.00 H
-ATOM 4798 1HZ LYS E 37 25.042 15.135 -7.234 1.00 0.00 H
-ATOM 4799 2HZ LYS E 37 23.918 15.161 -8.443 1.00 0.00 H
-ATOM 4800 3HZ LYS E 37 25.374 15.916 -8.650 1.00 0.00 H
-ATOM 4801 N LEU E 38 20.797 21.042 -5.991 1.00 43.21 N
-ATOM 4802 CA LEU E 38 19.762 20.698 -5.031 1.00 39.44 C
-ATOM 4803 C LEU E 38 18.974 19.492 -5.531 1.00 40.75 C
-ATOM 4804 O LEU E 38 18.456 19.498 -6.652 1.00 40.58 O
-ATOM 4805 CB LEU E 38 18.786 21.869 -4.830 1.00 34.65 C
-ATOM 4806 CG LEU E 38 19.353 23.173 -4.351 1.00 42.25 C
-ATOM 4807 CD1 LEU E 38 18.220 24.215 -4.313 1.00 36.99 C
-ATOM 4808 CD2 LEU E 38 19.961 22.967 -3.001 1.00 43.54 C
-ATOM 4809 H LEU E 38 20.523 21.291 -6.933 1.00 0.00 H
-ATOM 4810 HA LEU E 38 20.225 20.440 -4.081 1.00 0.00 H
-ATOM 4811 1HB LEU E 38 18.320 22.076 -5.771 1.00 0.00 H
-ATOM 4812 2HB LEU E 38 18.021 21.564 -4.116 1.00 0.00 H
-ATOM 4813 HG LEU E 38 20.121 23.517 -5.051 1.00 0.00 H
-ATOM 4814 1HD1 LEU E 38 18.607 25.169 -3.981 1.00 0.00 H
-ATOM 4815 2HD1 LEU E 38 17.799 24.327 -5.312 1.00 0.00 H
-ATOM 4816 3HD1 LEU E 38 17.438 23.881 -3.624 1.00 0.00 H
-ATOM 4817 1HD2 LEU E 38 20.393 23.876 -2.647 1.00 0.00 H
-ATOM 4818 2HD2 LEU E 38 19.195 22.629 -2.304 1.00 0.00 H
-ATOM 4819 3HD2 LEU E 38 20.732 22.216 -3.085 1.00 0.00 H
-ATOM 4820 N ASP E 39 18.867 18.464 -4.710 1.00 39.70 N
-ATOM 4821 CA ASP E 39 18.063 17.314 -5.106 1.00 38.72 C
-ATOM 4822 C ASP E 39 16.664 17.519 -4.571 1.00 40.22 C
-ATOM 4823 O ASP E 39 16.465 18.419 -3.751 1.00 39.91 O
-ATOM 4824 CB ASP E 39 18.702 15.993 -4.703 1.00 46.58 C
-ATOM 4825 CG ASP E 39 19.912 15.661 -5.612 1.00 54.50 C
-ATOM 4826 OD1 ASP E 39 19.952 16.151 -6.752 1.00 58.60 O
-ATOM 4827 OD2 ASP E 39 20.778 14.934 -5.175 1.00 57.86 O
-ATOM 4828 H ASP E 39 19.325 18.503 -3.796 1.00 0.00 H
-ATOM 4829 HA ASP E 39 18.001 17.308 -6.184 1.00 0.00 H
-ATOM 4830 1HB ASP E 39 19.031 16.042 -3.659 1.00 0.00 H
-ATOM 4831 2HB ASP E 39 17.965 15.191 -4.790 1.00 0.00 H
-ATOM 4832 N LYS E 40 15.691 16.753 -5.050 1.00 40.08 N
-ATOM 4833 CA LYS E 40 14.318 17.019 -4.651 1.00 43.04 C
-ATOM 4834 C LYS E 40 14.185 17.090 -3.148 1.00 43.17 C
-ATOM 4835 O LYS E 40 14.615 16.188 -2.428 1.00 42.77 O
-ATOM 4836 CB LYS E 40 13.366 15.968 -5.214 1.00 44.64 C
-ATOM 4837 CG LYS E 40 11.895 16.244 -4.925 1.00 44.19 C
-ATOM 4838 CD LYS E 40 10.992 15.258 -5.651 1.00 53.48 C
-ATOM 4839 CE LYS E 40 9.524 15.585 -5.426 1.00 55.67 C
-ATOM 4840 NZ LYS E 40 8.633 14.664 -6.172 1.00 62.34 N
-ATOM 4841 H LYS E 40 15.885 15.984 -5.698 1.00 0.00 H
-ATOM 4842 HA LYS E 40 14.026 17.986 -5.063 1.00 0.00 H
-ATOM 4843 1HB LYS E 40 13.492 15.897 -6.280 1.00 0.00 H
-ATOM 4844 2HB LYS E 40 13.624 14.993 -4.798 1.00 0.00 H
-ATOM 4845 1HG LYS E 40 11.716 16.157 -3.855 1.00 0.00 H
-ATOM 4846 2HG LYS E 40 11.649 17.260 -5.231 1.00 0.00 H
-ATOM 4847 1HD LYS E 40 11.201 15.299 -6.722 1.00 0.00 H
-ATOM 4848 2HD LYS E 40 11.193 14.249 -5.295 1.00 0.00 H
-ATOM 4849 1HE LYS E 40 9.299 15.508 -4.364 1.00 0.00 H
-ATOM 4850 2HE LYS E 40 9.332 16.605 -5.758 1.00 0.00 H
-ATOM 4851 1HZ LYS E 40 7.673 14.917 -5.999 1.00 0.00 H
-ATOM 4852 2HZ LYS E 40 8.829 14.739 -7.162 1.00 0.00 H
-ATOM 4853 3HZ LYS E 40 8.793 13.716 -5.868 1.00 0.00 H
-ATOM 4854 N GLY E 41 13.570 18.171 -2.678 1.00 43.58 N
-ATOM 4855 CA GLY E 41 13.351 18.386 -1.257 1.00 42.40 C
-ATOM 4856 C GLY E 41 14.400 19.272 -0.577 1.00 41.68 C
-ATOM 4857 O GLY E 41 14.186 19.710 0.557 1.00 42.94 O
-ATOM 4858 H GLY E 41 13.247 18.881 -3.336 1.00 0.00 H
-ATOM 4859 1HA GLY E 41 12.366 18.830 -1.122 1.00 0.00 H
-ATOM 4860 2HA GLY E 41 13.328 17.418 -0.756 1.00 0.00 H
-ATOM 4861 N GLU E 42 15.527 19.545 -1.237 1.00 41.28 N
-ATOM 4862 CA GLU E 42 16.527 20.407 -0.602 1.00 38.45 C
-ATOM 4863 C GLU E 42 16.179 21.881 -0.774 1.00 37.10 C
-ATOM 4864 O GLU E 42 15.694 22.315 -1.827 1.00 38.37 O
-ATOM 4865 CB GLU E 42 17.948 20.121 -1.122 1.00 35.24 C
-ATOM 4866 CG GLU E 42 18.517 18.756 -0.684 1.00 36.04 C
-ATOM 4867 CD GLU E 42 19.949 18.493 -1.138 1.00 43.75 C
-ATOM 4868 OE1 GLU E 42 20.283 18.811 -2.248 1.00 38.74 O
-ATOM 4869 OE2 GLU E 42 20.712 17.967 -0.359 1.00 42.19 O
-ATOM 4870 H GLU E 42 15.697 19.149 -2.160 1.00 0.00 H
-ATOM 4871 HA GLU E 42 16.530 20.194 0.469 1.00 0.00 H
-ATOM 4872 1HB GLU E 42 17.951 20.151 -2.209 1.00 0.00 H
-ATOM 4873 2HB GLU E 42 18.625 20.896 -0.763 1.00 0.00 H
-ATOM 4874 1HG GLU E 42 18.487 18.703 0.408 1.00 0.00 H
-ATOM 4875 2HG GLU E 42 17.871 17.972 -1.074 1.00 0.00 H
-ATOM 4876 N VAL E 43 16.445 22.658 0.281 1.00 32.84 N
-ATOM 4877 CA VAL E 43 16.171 24.095 0.259 1.00 31.71 C
-ATOM 4878 C VAL E 43 17.435 24.925 0.439 1.00 32.39 C
-ATOM 4879 O VAL E 43 18.212 24.696 1.367 1.00 31.58 O
-ATOM 4880 CB VAL E 43 15.154 24.478 1.371 1.00 28.12 C
-ATOM 4881 CG1 VAL E 43 14.927 25.997 1.380 1.00 26.78 C
-ATOM 4882 CG2 VAL E 43 13.822 23.760 1.136 1.00 22.23 C
-ATOM 4883 H VAL E 43 16.844 22.230 1.117 1.00 0.00 H
-ATOM 4884 HA VAL E 43 15.735 24.346 -0.705 1.00 0.00 H
-ATOM 4885 HB VAL E 43 15.556 24.189 2.342 1.00 0.00 H
-ATOM 4886 1HG1 VAL E 43 14.221 26.257 2.166 1.00 0.00 H
-ATOM 4887 2HG1 VAL E 43 15.872 26.506 1.564 1.00 0.00 H
-ATOM 4888 3HG1 VAL E 43 14.528 26.310 0.413 1.00 0.00 H
-ATOM 4889 1HG2 VAL E 43 13.114 24.031 1.921 1.00 0.00 H
-ATOM 4890 2HG2 VAL E 43 13.427 24.056 0.184 1.00 0.00 H
-ATOM 4891 3HG2 VAL E 43 13.977 22.682 1.142 1.00 0.00 H
-ATOM 4892 N LEU E 44 17.639 25.886 -0.458 1.00 31.71 N
-ATOM 4893 CA LEU E 44 18.783 26.787 -0.388 1.00 32.81 C
-ATOM 4894 C LEU E 44 18.349 28.226 -0.185 1.00 33.84 C
-ATOM 4895 O LEU E 44 17.565 28.765 -0.962 1.00 34.20 O
-ATOM 4896 CB LEU E 44 19.602 26.721 -1.674 1.00 37.28 C
-ATOM 4897 CG LEU E 44 20.806 27.667 -1.763 1.00 37.24 C
-ATOM 4898 CD1 LEU E 44 21.840 27.275 -0.709 1.00 28.35 C
-ATOM 4899 CD2 LEU E 44 21.392 27.588 -3.165 1.00 42.22 C
-ATOM 4900 H LEU E 44 16.972 25.997 -1.213 1.00 0.00 H
-ATOM 4901 HA LEU E 44 19.408 26.496 0.452 1.00 0.00 H
-ATOM 4902 1HB LEU E 44 19.975 25.735 -1.769 1.00 0.00 H
-ATOM 4903 2HB LEU E 44 18.946 26.937 -2.515 1.00 0.00 H
-ATOM 4904 HG LEU E 44 20.484 28.690 -1.558 1.00 0.00 H
-ATOM 4905 1HD1 LEU E 44 22.688 27.946 -0.766 1.00 0.00 H
-ATOM 4906 2HD1 LEU E 44 21.394 27.341 0.281 1.00 0.00 H
-ATOM 4907 3HD1 LEU E 44 22.172 26.257 -0.894 1.00 0.00 H
-ATOM 4908 1HD2 LEU E 44 22.247 28.261 -3.248 1.00 0.00 H
-ATOM 4909 2HD2 LEU E 44 21.713 26.568 -3.369 1.00 0.00 H
-ATOM 4910 3HD2 LEU E 44 20.633 27.878 -3.887 1.00 0.00 H
-ATOM 4911 N ILE E 45 18.857 28.847 0.861 1.00 34.46 N
-ATOM 4912 CA ILE E 45 18.542 30.237 1.112 1.00 36.36 C
-ATOM 4913 C ILE E 45 19.831 31.015 0.919 1.00 37.28 C
-ATOM 4914 O ILE E 45 20.820 30.755 1.603 1.00 37.80 O
-ATOM 4915 CB ILE E 45 17.990 30.426 2.519 1.00 39.03 C
-ATOM 4916 CG1 ILE E 45 16.769 29.532 2.686 1.00 36.71 C
-ATOM 4917 CG2 ILE E 45 17.584 31.869 2.662 1.00 22.88 C
-ATOM 4918 CD1 ILE E 45 16.232 29.462 4.063 1.00 39.25 C
-ATOM 4919 H ILE E 45 19.474 28.353 1.491 1.00 0.00 H
-ATOM 4920 HA ILE E 45 17.810 30.582 0.393 1.00 0.00 H
-ATOM 4921 HB ILE E 45 18.734 30.153 3.266 1.00 0.00 H
-ATOM 4922 1HG1 ILE E 45 16.003 29.888 2.032 1.00 0.00 H
-ATOM 4923 2HG1 ILE E 45 17.038 28.521 2.383 1.00 0.00 H
-ATOM 4924 1HG2 ILE E 45 17.162 32.051 3.639 1.00 0.00 H
-ATOM 4925 2HG2 ILE E 45 18.448 32.510 2.509 1.00 0.00 H
-ATOM 4926 3HG2 ILE E 45 16.848 32.086 1.903 1.00 0.00 H
-ATOM 4927 1HD1 ILE E 45 15.372 28.804 4.069 1.00 0.00 H
-ATOM 4928 2HD1 ILE E 45 16.996 29.076 4.743 1.00 0.00 H
-ATOM 4929 3HD1 ILE E 45 15.936 30.449 4.374 1.00 0.00 H
-ATOM 4930 N ALA E 46 19.855 31.944 -0.031 1.00 35.76 N
-ATOM 4931 CA ALA E 46 21.149 32.552 -0.332 1.00 33.97 C
-ATOM 4932 C ALA E 46 21.097 34.034 -0.605 1.00 35.93 C
-ATOM 4933 O ALA E 46 20.191 34.542 -1.271 1.00 38.80 O
-ATOM 4934 CB ALA E 46 21.744 31.851 -1.546 1.00 23.85 C
-ATOM 4935 H ALA E 46 19.008 32.170 -0.547 1.00 0.00 H
-ATOM 4936 HA ALA E 46 21.798 32.409 0.527 1.00 0.00 H
-ATOM 4937 1HB ALA E 46 22.730 32.268 -1.757 1.00 0.00 H
-ATOM 4938 2HB ALA E 46 21.835 30.786 -1.343 1.00 0.00 H
-ATOM 4939 3HB ALA E 46 21.094 32.001 -2.409 1.00 0.00 H
-ATOM 4940 N GLN E 47 22.121 34.722 -0.096 1.00 31.00 N
-ATOM 4941 CA GLN E 47 22.285 36.155 -0.261 1.00 31.68 C
-ATOM 4942 C GLN E 47 23.040 36.546 -1.506 1.00 30.94 C
-ATOM 4943 O GLN E 47 23.862 35.790 -2.028 1.00 33.65 O
-ATOM 4944 CB GLN E 47 23.029 36.777 0.923 1.00 35.95 C
-ATOM 4945 CG GLN E 47 22.319 36.750 2.247 1.00 28.22 C
-ATOM 4946 CD GLN E 47 23.147 37.434 3.303 1.00 33.66 C
-ATOM 4947 OE1 GLN E 47 24.267 36.996 3.593 1.00 30.67 O
-ATOM 4948 NE2 GLN E 47 22.635 38.522 3.874 1.00 29.44 N
-ATOM 4949 H GLN E 47 22.826 34.228 0.453 1.00 0.00 H
-ATOM 4950 HA GLN E 47 21.301 36.597 -0.323 1.00 0.00 H
-ATOM 4951 1HB GLN E 47 23.989 36.275 1.046 1.00 0.00 H
-ATOM 4952 2HB GLN E 47 23.241 37.825 0.692 1.00 0.00 H
-ATOM 4953 1HG GLN E 47 21.377 37.286 2.157 1.00 0.00 H
-ATOM 4954 2HG GLN E 47 22.147 35.712 2.551 1.00 0.00 H
-ATOM 4955 1HE2 GLN E 47 23.150 39.008 4.575 1.00 0.00 H
-ATOM 4956 2HE2 GLN E 47 21.728 38.882 3.577 1.00 0.00 H
-ATOM 4957 N PHE E 48 22.816 37.779 -1.923 1.00 28.69 N
-ATOM 4958 CA PHE E 48 23.617 38.377 -2.980 1.00 33.33 C
-ATOM 4959 C PHE E 48 24.902 38.860 -2.315 1.00 34.80 C
-ATOM 4960 O PHE E 48 24.887 39.268 -1.150 1.00 35.45 O
-ATOM 4961 CB PHE E 48 22.853 39.496 -3.650 1.00 34.24 C
-ATOM 4962 CG PHE E 48 21.703 38.984 -4.449 1.00 39.49 C
-ATOM 4963 CD1 PHE E 48 21.872 38.563 -5.761 1.00 33.58 C
-ATOM 4964 CD2 PHE E 48 20.445 38.895 -3.873 1.00 29.83 C
-ATOM 4965 CE1 PHE E 48 20.800 38.068 -6.472 1.00 36.16 C
-ATOM 4966 CE2 PHE E 48 19.381 38.400 -4.583 1.00 34.03 C
-ATOM 4967 CZ PHE E 48 19.563 37.984 -5.879 1.00 33.26 C
-ATOM 4968 H PHE E 48 22.073 38.310 -1.464 1.00 0.00 H
-ATOM 4969 HA PHE E 48 23.872 37.621 -3.727 1.00 0.00 H
-ATOM 4970 1HB PHE E 48 22.482 40.201 -2.910 1.00 0.00 H
-ATOM 4971 2HB PHE E 48 23.525 40.025 -4.315 1.00 0.00 H
-ATOM 4972 HD1 PHE E 48 22.862 38.627 -6.222 1.00 0.00 H
-ATOM 4973 HD2 PHE E 48 20.310 39.217 -2.838 1.00 0.00 H
-ATOM 4974 HE1 PHE E 48 20.931 37.737 -7.491 1.00 0.00 H
-ATOM 4975 HE2 PHE E 48 18.400 38.328 -4.118 1.00 0.00 H
-ATOM 4976 HZ PHE E 48 18.738 37.584 -6.426 1.00 0.00 H
-ATOM 4977 N THR E 49 26.032 38.744 -2.999 1.00 34.30 N
-ATOM 4978 CA THR E 49 27.295 39.055 -2.333 1.00 31.43 C
-ATOM 4979 C THR E 49 28.210 39.962 -3.119 1.00 33.61 C
-ATOM 4980 O THR E 49 27.902 40.410 -4.221 1.00 37.07 O
-ATOM 4981 CB THR E 49 28.101 37.781 -1.992 1.00 32.55 C
-ATOM 4982 OG1 THR E 49 28.627 37.182 -3.196 1.00 39.52 O
-ATOM 4983 CG2 THR E 49 27.212 36.758 -1.265 1.00 25.46 C
-ATOM 4984 H THR E 49 26.009 38.464 -3.978 1.00 0.00 H
-ATOM 4985 HA THR E 49 27.067 39.566 -1.399 1.00 0.00 H
-ATOM 4986 HB THR E 49 28.930 38.043 -1.340 1.00 0.00 H
-ATOM 4987 HG1 THR E 49 27.971 36.563 -3.552 1.00 0.00 H
-ATOM 4988 1HG2 THR E 49 27.799 35.875 -1.026 1.00 0.00 H
-ATOM 4989 2HG2 THR E 49 26.819 37.193 -0.347 1.00 0.00 H
-ATOM 4990 3HG2 THR E 49 26.384 36.472 -1.908 1.00 0.00 H
-ATOM 4991 N GLU E 50 29.384 40.180 -2.547 1.00 34.73 N
-ATOM 4992 CA GLU E 50 30.471 40.912 -3.171 1.00 33.34 C
-ATOM 4993 C GLU E 50 30.858 40.270 -4.506 1.00 32.56 C
-ATOM 4994 O GLU E 50 31.399 40.944 -5.383 1.00 32.29 O
-ATOM 4995 CB GLU E 50 31.683 40.960 -2.232 1.00 30.47 C
-ATOM 4996 CG GLU E 50 32.862 41.768 -2.751 1.00 40.28 C
-ATOM 4997 CD GLU E 50 33.999 41.891 -1.745 1.00 54.29 C
-ATOM 4998 OE1 GLU E 50 33.871 41.387 -0.654 1.00 47.60 O
-ATOM 4999 OE2 GLU E 50 34.994 42.491 -2.080 1.00 61.85 O
-ATOM 5000 H GLU E 50 29.544 39.797 -1.629 1.00 0.00 H
-ATOM 5001 HA GLU E 50 30.138 41.930 -3.368 1.00 0.00 H
-ATOM 5002 1HB GLU E 50 31.384 41.391 -1.277 1.00 0.00 H
-ATOM 5003 2HB GLU E 50 32.036 39.946 -2.039 1.00 0.00 H
-ATOM 5004 1HG GLU E 50 33.240 41.279 -3.650 1.00 0.00 H
-ATOM 5005 2HG GLU E 50 32.516 42.763 -3.029 1.00 0.00 H
-ATOM 5006 N HIS E 51 30.638 38.953 -4.641 1.00 26.61 N
-ATOM 5007 CA HIS E 51 31.014 38.258 -5.857 1.00 28.83 C
-ATOM 5008 C HIS E 51 29.807 37.842 -6.708 1.00 33.61 C
-ATOM 5009 O HIS E 51 29.957 37.687 -7.916 1.00 35.25 O
-ATOM 5010 CB HIS E 51 31.872 37.034 -5.512 1.00 26.49 C
-ATOM 5011 CG HIS E 51 33.154 37.412 -4.831 1.00 34.64 C
-ATOM 5012 ND1 HIS E 51 33.237 37.634 -3.473 1.00 32.77 N
-ATOM 5013 CD2 HIS E 51 34.396 37.619 -5.321 1.00 28.18 C
-ATOM 5014 CE1 HIS E 51 34.475 37.968 -3.159 1.00 32.28 C
-ATOM 5015 NE2 HIS E 51 35.200 37.962 -4.260 1.00 35.45 N
-ATOM 5016 H HIS E 51 30.161 38.428 -3.914 1.00 0.00 H
-ATOM 5017 HA HIS E 51 31.625 38.919 -6.470 1.00 0.00 H
-ATOM 5018 1HB HIS E 51 31.313 36.359 -4.857 1.00 0.00 H
-ATOM 5019 2HB HIS E 51 32.111 36.486 -6.423 1.00 0.00 H
-ATOM 5020 HD2 HIS E 51 34.703 37.534 -6.363 1.00 0.00 H
-ATOM 5021 HE1 HIS E 51 34.833 38.210 -2.156 1.00 0.00 H
-ATOM 5022 HE2 HIS E 51 36.185 38.181 -4.321 1.00 0.00 H
-ATOM 5023 N THR E 52 28.611 37.708 -6.107 1.00 33.45 N
-ATOM 5024 CA THR E 52 27.408 37.314 -6.873 1.00 31.88 C
-ATOM 5025 C THR E 52 26.399 38.455 -7.019 1.00 33.48 C
-ATOM 5026 O THR E 52 25.841 38.933 -6.028 1.00 37.50 O
-ATOM 5027 CB THR E 52 26.653 36.139 -6.211 1.00 25.12 C
-ATOM 5028 OG1 THR E 52 27.489 34.984 -6.141 1.00 30.45 O
-ATOM 5029 CG2 THR E 52 25.385 35.796 -7.010 1.00 23.80 C
-ATOM 5030 H THR E 52 28.550 37.842 -5.106 1.00 0.00 H
-ATOM 5031 HA THR E 52 27.719 37.012 -7.872 1.00 0.00 H
-ATOM 5032 HB THR E 52 26.367 36.427 -5.202 1.00 0.00 H
-ATOM 5033 HG1 THR E 52 27.522 34.583 -7.015 1.00 0.00 H
-ATOM 5034 1HG2 THR E 52 24.859 34.974 -6.528 1.00 0.00 H
-ATOM 5035 2HG2 THR E 52 24.727 36.664 -7.055 1.00 0.00 H
-ATOM 5036 3HG2 THR E 52 25.665 35.503 -8.022 1.00 0.00 H
-ATOM 5037 N SER E 53 26.123 38.847 -8.272 1.00 31.11 N
-ATOM 5038 CA SER E 53 25.175 39.934 -8.546 1.00 29.90 C
-ATOM 5039 C SER E 53 23.855 39.398 -9.059 1.00 29.14 C
-ATOM 5040 O SER E 53 22.834 40.097 -9.059 1.00 28.99 O
-ATOM 5041 CB SER E 53 25.728 40.898 -9.561 1.00 31.04 C
-ATOM 5042 OG SER E 53 25.909 40.282 -10.806 1.00 25.29 O
-ATOM 5043 H SER E 53 26.595 38.376 -9.043 1.00 0.00 H
-ATOM 5044 HA SER E 53 24.982 40.473 -7.618 1.00 0.00 H
-ATOM 5045 1HB SER E 53 25.044 41.733 -9.664 1.00 0.00 H
-ATOM 5046 2HB SER E 53 26.660 41.287 -9.200 1.00 0.00 H
-ATOM 5047 HG SER E 53 26.332 39.428 -10.628 1.00 0.00 H
-ATOM 5048 N ALA E 54 23.872 38.152 -9.501 1.00 25.72 N
-ATOM 5049 CA ALA E 54 22.656 37.552 -10.010 1.00 32.13 C
-ATOM 5050 C ALA E 54 22.650 36.061 -9.749 1.00 31.63 C
-ATOM 5051 O ALA E 54 23.701 35.415 -9.690 1.00 32.32 O
-ATOM 5052 CB ALA E 54 22.484 37.855 -11.488 1.00 31.19 C
-ATOM 5053 H ALA E 54 24.750 37.636 -9.513 1.00 0.00 H
-ATOM 5054 HA ALA E 54 21.816 37.981 -9.473 1.00 0.00 H
-ATOM 5055 1HB ALA E 54 21.551 37.418 -11.830 1.00 0.00 H
-ATOM 5056 2HB ALA E 54 22.457 38.934 -11.629 1.00 0.00 H
-ATOM 5057 3HB ALA E 54 23.293 37.455 -12.052 1.00 0.00 H
-ATOM 5058 N ILE E 55 21.450 35.523 -9.614 1.00 32.66 N
-ATOM 5059 CA ILE E 55 21.245 34.102 -9.411 1.00 34.41 C
-ATOM 5060 C ILE E 55 20.361 33.508 -10.498 1.00 35.79 C
-ATOM 5061 O ILE E 55 19.261 34.004 -10.752 1.00 32.11 O
-ATOM 5062 CB ILE E 55 20.615 33.840 -8.026 1.00 34.57 C
-ATOM 5063 CG1 ILE E 55 21.565 34.346 -6.897 1.00 35.03 C
-ATOM 5064 CG2 ILE E 55 20.314 32.369 -7.873 1.00 27.08 C
-ATOM 5065 CD1 ILE E 55 20.946 34.333 -5.506 1.00 37.79 C
-ATOM 5066 H ILE E 55 20.641 36.133 -9.676 1.00 0.00 H
-ATOM 5067 HA ILE E 55 22.209 33.607 -9.447 1.00 0.00 H
-ATOM 5068 HB ILE E 55 19.686 34.404 -7.940 1.00 0.00 H
-ATOM 5069 1HG1 ILE E 55 22.459 33.720 -6.888 1.00 0.00 H
-ATOM 5070 2HG1 ILE E 55 21.863 35.366 -7.116 1.00 0.00 H
-ATOM 5071 1HG2 ILE E 55 19.861 32.188 -6.902 1.00 0.00 H
-ATOM 5072 2HG2 ILE E 55 19.628 32.052 -8.658 1.00 0.00 H
-ATOM 5073 3HG2 ILE E 55 21.246 31.811 -7.957 1.00 0.00 H
-ATOM 5074 1HD1 ILE E 55 21.673 34.703 -4.776 1.00 0.00 H
-ATOM 5075 2HD1 ILE E 55 20.063 34.974 -5.490 1.00 0.00 H
-ATOM 5076 3HD1 ILE E 55 20.660 33.316 -5.246 1.00 0.00 H
-ATOM 5077 N LYS E 56 20.831 32.458 -11.160 1.00 39.17 N
-ATOM 5078 CA LYS E 56 19.997 31.829 -12.179 1.00 40.26 C
-ATOM 5079 C LYS E 56 19.605 30.435 -11.729 1.00 40.72 C
-ATOM 5080 O LYS E 56 20.438 29.678 -11.234 1.00 42.44 O
-ATOM 5081 CB LYS E 56 20.663 31.814 -13.558 1.00 37.30 C
-ATOM 5082 CG LYS E 56 19.747 31.250 -14.657 1.00 46.86 C
-ATOM 5083 CD LYS E 56 20.238 31.582 -16.067 1.00 48.21 C
-ATOM 5084 CE LYS E 56 21.293 30.648 -16.599 1.00 59.48 C
-ATOM 5085 NZ LYS E 56 21.673 31.041 -18.000 1.00 54.41 N
-ATOM 5086 H LYS E 56 21.755 32.093 -10.931 1.00 0.00 H
-ATOM 5087 HA LYS E 56 19.078 32.399 -12.275 1.00 0.00 H
-ATOM 5088 1HB LYS E 56 20.937 32.828 -13.842 1.00 0.00 H
-ATOM 5089 2HB LYS E 56 21.572 31.222 -13.528 1.00 0.00 H
-ATOM 5090 1HG LYS E 56 19.676 30.162 -14.554 1.00 0.00 H
-ATOM 5091 2HG LYS E 56 18.742 31.665 -14.533 1.00 0.00 H
-ATOM 5092 1HD LYS E 56 19.396 31.493 -16.740 1.00 0.00 H
-ATOM 5093 2HD LYS E 56 20.609 32.613 -16.108 1.00 0.00 H
-ATOM 5094 1HE LYS E 56 22.178 30.665 -15.962 1.00 0.00 H
-ATOM 5095 2HE LYS E 56 20.886 29.635 -16.619 1.00 0.00 H
-ATOM 5096 1HZ LYS E 56 22.357 30.414 -18.383 1.00 0.00 H
-ATOM 5097 2HZ LYS E 56 20.854 31.038 -18.611 1.00 0.00 H
-ATOM 5098 3HZ LYS E 56 22.065 31.988 -17.984 1.00 0.00 H
-ATOM 5099 N VAL E 57 18.328 30.106 -11.853 1.00 40.68 N
-ATOM 5100 CA VAL E 57 17.869 28.804 -11.410 1.00 38.48 C
-ATOM 5101 C VAL E 57 17.417 27.955 -12.588 1.00 38.47 C
-ATOM 5102 O VAL E 57 16.566 28.362 -13.392 1.00 39.05 O
-ATOM 5103 CB VAL E 57 16.728 28.959 -10.395 1.00 33.39 C
-ATOM 5104 CG1 VAL E 57 16.264 27.570 -9.907 1.00 25.82 C
-ATOM 5105 CG2 VAL E 57 17.208 29.832 -9.260 1.00 28.19 C
-ATOM 5106 H VAL E 57 17.677 30.775 -12.252 1.00 0.00 H
-ATOM 5107 HA VAL E 57 18.692 28.289 -10.916 1.00 0.00 H
-ATOM 5108 HB VAL E 57 15.873 29.433 -10.877 1.00 0.00 H
-ATOM 5109 1HG1 VAL E 57 15.453 27.684 -9.194 1.00 0.00 H
-ATOM 5110 2HG1 VAL E 57 15.915 26.974 -10.754 1.00 0.00 H
-ATOM 5111 3HG1 VAL E 57 17.097 27.056 -9.425 1.00 0.00 H
-ATOM 5112 1HG2 VAL E 57 16.408 29.959 -8.536 1.00 0.00 H
-ATOM 5113 2HG2 VAL E 57 18.061 29.355 -8.796 1.00 0.00 H
-ATOM 5114 3HG2 VAL E 57 17.503 30.811 -9.645 1.00 0.00 H
-ATOM 5115 N ARG E 58 18.028 26.777 -12.687 1.00 40.15 N
-ATOM 5116 CA ARG E 58 17.778 25.813 -13.746 1.00 38.22 C
-ATOM 5117 C ARG E 58 17.156 24.524 -13.205 1.00 35.72 C
-ATOM 5118 O ARG E 58 17.670 23.907 -12.267 1.00 37.46 O
-ATOM 5119 CB ARG E 58 19.084 25.502 -14.457 1.00 39.57 C
-ATOM 5120 CG ARG E 58 19.019 24.444 -15.532 1.00 55.09 C
-ATOM 5121 CD ARG E 58 20.326 24.323 -16.234 1.00 63.17 C
-ATOM 5122 NE ARG E 58 20.598 25.475 -17.066 1.00 65.35 N
-ATOM 5123 CZ ARG E 58 21.781 25.753 -17.643 1.00 65.54 C
-ATOM 5124 NH1 ARG E 58 22.823 24.963 -17.474 1.00 73.92 N
-ATOM 5125 NH2 ARG E 58 21.870 26.834 -18.387 1.00 54.17 N
-ATOM 5126 H ARG E 58 18.731 26.540 -11.987 1.00 0.00 H
-ATOM 5127 HA ARG E 58 17.085 26.257 -14.463 1.00 0.00 H
-ATOM 5128 1HB ARG E 58 19.456 26.414 -14.930 1.00 0.00 H
-ATOM 5129 2HB ARG E 58 19.830 25.192 -13.723 1.00 0.00 H
-ATOM 5130 1HG ARG E 58 18.780 23.480 -15.079 1.00 0.00 H
-ATOM 5131 2HG ARG E 58 18.249 24.710 -16.262 1.00 0.00 H
-ATOM 5132 1HD ARG E 58 21.118 24.252 -15.492 1.00 0.00 H
-ATOM 5133 2HD ARG E 58 20.332 23.435 -16.861 1.00 0.00 H
-ATOM 5134 HE ARG E 58 19.835 26.140 -17.243 1.00 0.00 H
-ATOM 5135 1HH1 ARG E 58 22.744 24.135 -16.902 1.00 0.00 H
-ATOM 5136 2HH1 ARG E 58 23.704 25.188 -17.915 1.00 0.00 H
-ATOM 5137 1HH2 ARG E 58 21.031 27.416 -18.495 1.00 0.00 H
-ATOM 5138 2HH2 ARG E 58 22.738 27.072 -18.841 1.00 0.00 H
-ATOM 5139 N GLY E 59 16.058 24.099 -13.814 1.00 34.36 N
-ATOM 5140 CA GLY E 59 15.345 22.908 -13.359 1.00 33.56 C
-ATOM 5141 C GLY E 59 14.109 23.353 -12.610 1.00 35.82 C
-ATOM 5142 O GLY E 59 13.950 24.547 -12.350 1.00 33.36 O
-ATOM 5143 H GLY E 59 15.675 24.632 -14.588 1.00 0.00 H
-ATOM 5144 1HA GLY E 59 15.060 22.289 -14.211 1.00 0.00 H
-ATOM 5145 2HA GLY E 59 15.978 22.307 -12.708 1.00 0.00 H
-ATOM 5146 N LYS E 60 13.228 22.422 -12.278 1.00 36.69 N
-ATOM 5147 CA LYS E 60 11.974 22.775 -11.631 1.00 37.82 C
-ATOM 5148 C LYS E 60 12.178 23.072 -10.150 1.00 35.00 C
-ATOM 5149 O LYS E 60 12.700 22.223 -9.409 1.00 33.46 O
-ATOM 5150 CB LYS E 60 10.955 21.659 -11.833 1.00 51.48 C
-ATOM 5151 CG LYS E 60 9.542 21.953 -11.380 1.00 61.43 C
-ATOM 5152 CD LYS E 60 8.648 20.754 -11.672 1.00 62.59 C
-ATOM 5153 CE LYS E 60 7.217 20.986 -11.233 1.00 68.24 C
-ATOM 5154 NZ LYS E 60 6.348 19.827 -11.571 1.00 79.72 N
-ATOM 5155 H LYS E 60 13.418 21.444 -12.510 1.00 0.00 H
-ATOM 5156 HA LYS E 60 11.596 23.676 -12.097 1.00 0.00 H
-ATOM 5157 1HB LYS E 60 10.925 21.387 -12.892 1.00 0.00 H
-ATOM 5158 2HB LYS E 60 11.277 20.781 -11.286 1.00 0.00 H
-ATOM 5159 1HG LYS E 60 9.522 22.184 -10.325 1.00 0.00 H
-ATOM 5160 2HG LYS E 60 9.166 22.823 -11.930 1.00 0.00 H
-ATOM 5161 1HD LYS E 60 8.672 20.529 -12.741 1.00 0.00 H
-ATOM 5162 2HD LYS E 60 9.043 19.890 -11.131 1.00 0.00 H
-ATOM 5163 1HE LYS E 60 7.200 21.130 -10.160 1.00 0.00 H
-ATOM 5164 2HE LYS E 60 6.827 21.883 -11.720 1.00 0.00 H
-ATOM 5165 1HZ LYS E 60 5.399 20.004 -11.257 1.00 0.00 H
-ATOM 5166 2HZ LYS E 60 6.351 19.686 -12.573 1.00 0.00 H
-ATOM 5167 3HZ LYS E 60 6.709 19.000 -11.110 1.00 0.00 H
-ATOM 5168 N ALA E 61 11.777 24.264 -9.720 1.00 34.61 N
-ATOM 5169 CA ALA E 61 11.983 24.664 -8.328 1.00 32.29 C
-ATOM 5170 C ALA E 61 11.005 25.736 -7.871 1.00 34.99 C
-ATOM 5171 O ALA E 61 10.550 26.567 -8.653 1.00 34.51 O
-ATOM 5172 CB ALA E 61 13.401 25.176 -8.134 1.00 25.78 C
-ATOM 5173 H ALA E 61 11.330 24.894 -10.389 1.00 0.00 H
-ATOM 5174 HA ALA E 61 11.836 23.785 -7.709 1.00 0.00 H
-ATOM 5175 1HB ALA E 61 13.562 25.439 -7.092 1.00 0.00 H
-ATOM 5176 2HB ALA E 61 14.091 24.402 -8.427 1.00 0.00 H
-ATOM 5177 3HB ALA E 61 13.557 26.054 -8.747 1.00 0.00 H
-ATOM 5178 N TYR E 62 10.718 25.736 -6.579 1.00 35.89 N
-ATOM 5179 CA TYR E 62 9.883 26.768 -5.977 1.00 33.95 C
-ATOM 5180 C TYR E 62 10.751 27.858 -5.385 1.00 33.45 C
-ATOM 5181 O TYR E 62 11.651 27.581 -4.592 1.00 30.51 O
-ATOM 5182 CB TYR E 62 8.928 26.149 -4.963 1.00 35.26 C
-ATOM 5183 CG TYR E 62 8.129 27.135 -4.153 1.00 32.56 C
-ATOM 5184 CD1 TYR E 62 7.139 27.936 -4.725 1.00 28.65 C
-ATOM 5185 CD2 TYR E 62 8.362 27.195 -2.810 1.00 32.84 C
-ATOM 5186 CE1 TYR E 62 6.409 28.801 -3.924 1.00 27.21 C
-ATOM 5187 CE2 TYR E 62 7.643 28.037 -2.012 1.00 34.90 C
-ATOM 5188 CZ TYR E 62 6.670 28.842 -2.554 1.00 33.31 C
-ATOM 5189 OH TYR E 62 5.951 29.677 -1.727 1.00 35.34 O
-ATOM 5190 H TYR E 62 11.143 25.018 -5.999 1.00 0.00 H
-ATOM 5191 HA TYR E 62 9.282 27.228 -6.758 1.00 0.00 H
-ATOM 5192 1HB TYR E 62 8.228 25.498 -5.487 1.00 0.00 H
-ATOM 5193 2HB TYR E 62 9.492 25.528 -4.274 1.00 0.00 H
-ATOM 5194 HD1 TYR E 62 6.938 27.886 -5.793 1.00 0.00 H
-ATOM 5195 HD2 TYR E 62 9.121 26.557 -2.383 1.00 0.00 H
-ATOM 5196 HE1 TYR E 62 5.635 29.430 -4.364 1.00 0.00 H
-ATOM 5197 HE2 TYR E 62 7.842 28.060 -0.943 1.00 0.00 H
-ATOM 5198 HH TYR E 62 6.216 29.527 -0.816 1.00 0.00 H
-ATOM 5199 N ILE E 63 10.516 29.099 -5.807 1.00 33.23 N
-ATOM 5200 CA ILE E 63 11.362 30.195 -5.375 1.00 31.73 C
-ATOM 5201 C ILE E 63 10.576 31.290 -4.629 1.00 33.46 C
-ATOM 5202 O ILE E 63 9.530 31.752 -5.094 1.00 34.16 O
-ATOM 5203 CB ILE E 63 12.050 30.813 -6.603 1.00 25.81 C
-ATOM 5204 CG1 ILE E 63 12.843 29.747 -7.373 1.00 29.97 C
-ATOM 5205 CG2 ILE E 63 12.992 31.914 -6.163 1.00 19.12 C
-ATOM 5206 CD1 ILE E 63 13.326 30.219 -8.727 1.00 25.06 C
-ATOM 5207 H ILE E 63 9.775 29.295 -6.471 1.00 0.00 H
-ATOM 5208 HA ILE E 63 12.115 29.796 -4.721 1.00 0.00 H
-ATOM 5209 HB ILE E 63 11.310 31.207 -7.258 1.00 0.00 H
-ATOM 5210 1HG1 ILE E 63 13.684 29.445 -6.783 1.00 0.00 H
-ATOM 5211 2HG1 ILE E 63 12.208 28.878 -7.538 1.00 0.00 H
-ATOM 5212 1HG2 ILE E 63 13.460 32.340 -7.033 1.00 0.00 H
-ATOM 5213 2HG2 ILE E 63 12.434 32.672 -5.640 1.00 0.00 H
-ATOM 5214 3HG2 ILE E 63 13.752 31.504 -5.500 1.00 0.00 H
-ATOM 5215 1HD1 ILE E 63 13.867 29.419 -9.217 1.00 0.00 H
-ATOM 5216 2HD1 ILE E 63 12.469 30.503 -9.343 1.00 0.00 H
-ATOM 5217 3HD1 ILE E 63 13.982 31.078 -8.603 1.00 0.00 H
-ATOM 5218 N GLN E 64 11.077 31.704 -3.458 1.00 35.03 N
-ATOM 5219 CA GLN E 64 10.434 32.787 -2.704 1.00 34.16 C
-ATOM 5220 C GLN E 64 11.378 33.985 -2.668 1.00 35.40 C
-ATOM 5221 O GLN E 64 12.538 33.860 -2.259 1.00 37.46 O
-ATOM 5222 CB GLN E 64 10.103 32.378 -1.254 1.00 30.14 C
-ATOM 5223 CG GLN E 64 9.204 31.167 -1.103 1.00 27.77 C
-ATOM 5224 CD GLN E 64 8.985 30.757 0.362 1.00 37.54 C
-ATOM 5225 OE1 GLN E 64 9.860 30.915 1.218 1.00 38.28 O
-ATOM 5226 NE2 GLN E 64 7.800 30.219 0.626 1.00 29.20 N
-ATOM 5227 H GLN E 64 11.930 31.269 -3.118 1.00 0.00 H
-ATOM 5228 HA GLN E 64 9.521 33.092 -3.210 1.00 0.00 H
-ATOM 5229 1HB GLN E 64 10.978 32.251 -0.681 1.00 0.00 H
-ATOM 5230 2HB GLN E 64 9.563 33.208 -0.790 1.00 0.00 H
-ATOM 5231 1HG GLN E 64 8.235 31.387 -1.531 1.00 0.00 H
-ATOM 5232 2HG GLN E 64 9.660 30.327 -1.628 1.00 0.00 H
-ATOM 5233 1HE2 GLN E 64 7.568 29.895 1.565 1.00 0.00 H
-ATOM 5234 2HE2 GLN E 64 7.129 30.110 -0.111 1.00 0.00 H
-ATOM 5235 N THR E 65 10.906 35.139 -3.132 1.00 32.72 N
-ATOM 5236 CA THR E 65 11.745 36.333 -3.148 1.00 31.97 C
-ATOM 5237 C THR E 65 10.990 37.513 -2.568 1.00 33.60 C
-ATOM 5238 O THR E 65 9.802 37.442 -2.252 1.00 34.69 O
-ATOM 5239 CB THR E 65 12.197 36.768 -4.568 1.00 37.52 C
-ATOM 5240 OG1 THR E 65 11.085 37.334 -5.274 1.00 30.83 O
-ATOM 5241 CG2 THR E 65 12.729 35.598 -5.368 1.00 26.18 C
-ATOM 5242 H THR E 65 9.947 35.203 -3.468 1.00 0.00 H
-ATOM 5243 HA THR E 65 12.627 36.162 -2.530 1.00 0.00 H
-ATOM 5244 HB THR E 65 12.977 37.510 -4.477 1.00 0.00 H
-ATOM 5245 HG1 THR E 65 10.554 37.853 -4.662 1.00 0.00 H
-ATOM 5246 1HG2 THR E 65 13.036 35.946 -6.354 1.00 0.00 H
-ATOM 5247 2HG2 THR E 65 13.581 35.152 -4.858 1.00 0.00 H
-ATOM 5248 3HG2 THR E 65 11.941 34.860 -5.476 1.00 0.00 H
-ATOM 5249 N ARG E 66 11.669 38.635 -2.530 1.00 31.73 N
-ATOM 5250 CA ARG E 66 11.108 39.900 -2.099 1.00 33.45 C
-ATOM 5251 C ARG E 66 9.894 40.341 -2.905 1.00 36.82 C
-ATOM 5252 O ARG E 66 9.104 41.154 -2.426 1.00 35.21 O
-ATOM 5253 CB ARG E 66 12.175 40.969 -2.170 1.00 35.42 C
-ATOM 5254 CG ARG E 66 11.798 42.321 -1.647 1.00 51.25 C
-ATOM 5255 CD ARG E 66 13.015 43.130 -1.484 1.00 65.13 C
-ATOM 5256 NE ARG E 66 12.761 44.506 -1.155 1.00 78.05 N
-ATOM 5257 CZ ARG E 66 13.737 45.390 -0.886 1.00 80.20 C
-ATOM 5258 NH1 ARG E 66 14.996 44.985 -0.897 1.00 69.11 N
-ATOM 5259 NH2 ARG E 66 13.441 46.652 -0.607 1.00 78.94 N
-ATOM 5260 H ARG E 66 12.645 38.612 -2.790 1.00 0.00 H
-ATOM 5261 HA ARG E 66 10.788 39.793 -1.065 1.00 0.00 H
-ATOM 5262 1HB ARG E 66 13.076 40.641 -1.644 1.00 0.00 H
-ATOM 5263 2HB ARG E 66 12.443 41.120 -3.213 1.00 0.00 H
-ATOM 5264 1HG ARG E 66 11.136 42.820 -2.356 1.00 0.00 H
-ATOM 5265 2HG ARG E 66 11.302 42.219 -0.680 1.00 0.00 H
-ATOM 5266 1HD ARG E 66 13.573 42.707 -0.665 1.00 0.00 H
-ATOM 5267 2HD ARG E 66 13.618 43.091 -2.394 1.00 0.00 H
-ATOM 5268 HE ARG E 66 11.804 44.824 -1.138 1.00 0.00 H
-ATOM 5269 1HH1 ARG E 66 15.227 43.990 -1.081 1.00 0.00 H
-ATOM 5270 2HH1 ARG E 66 15.735 45.640 -0.700 1.00 0.00 H
-ATOM 5271 1HH2 ARG E 66 12.479 46.952 -0.584 1.00 0.00 H
-ATOM 5272 2HH2 ARG E 66 14.180 47.312 -0.407 1.00 0.00 H
-ATOM 5273 N HIS E 67 9.755 39.855 -4.142 1.00 36.86 N
-ATOM 5274 CA HIS E 67 8.666 40.343 -4.969 1.00 38.75 C
-ATOM 5275 C HIS E 67 7.498 39.355 -5.027 1.00 39.61 C
-ATOM 5276 O HIS E 67 6.596 39.503 -5.855 1.00 39.14 O
-ATOM 5277 CB HIS E 67 9.171 40.615 -6.383 1.00 36.83 C
-ATOM 5278 CG HIS E 67 10.331 41.546 -6.407 1.00 26.70 C
-ATOM 5279 ND1 HIS E 67 10.451 42.616 -5.546 1.00 29.47 N
-ATOM 5280 CD2 HIS E 67 11.409 41.593 -7.213 1.00 21.20 C
-ATOM 5281 CE1 HIS E 67 11.574 43.253 -5.806 1.00 26.21 C
-ATOM 5282 NE2 HIS E 67 12.159 42.660 -6.820 1.00 32.59 N
-ATOM 5283 H HIS E 67 10.380 39.139 -4.509 1.00 0.00 H
-ATOM 5284 HA HIS E 67 8.287 41.277 -4.558 1.00 0.00 H
-ATOM 5285 1HB HIS E 67 9.471 39.676 -6.857 1.00 0.00 H
-ATOM 5286 2HB HIS E 67 8.374 41.055 -6.980 1.00 0.00 H
-ATOM 5287 HD2 HIS E 67 11.638 40.916 -8.031 1.00 0.00 H
-ATOM 5288 HE1 HIS E 67 11.944 44.132 -5.285 1.00 0.00 H
-ATOM 5289 HE2 HIS E 67 13.027 42.952 -7.255 1.00 0.00 H
-ATOM 5290 N GLY E 68 7.510 38.343 -4.157 1.00 38.17 N
-ATOM 5291 CA GLY E 68 6.460 37.330 -4.181 1.00 32.69 C
-ATOM 5292 C GLY E 68 7.077 35.976 -4.473 1.00 34.22 C
-ATOM 5293 O GLY E 68 8.223 35.718 -4.107 1.00 34.43 O
-ATOM 5294 H GLY E 68 8.263 38.256 -3.477 1.00 0.00 H
-ATOM 5295 1HA GLY E 68 5.949 37.306 -3.219 1.00 0.00 H
-ATOM 5296 2HA GLY E 68 5.721 37.574 -4.942 1.00 0.00 H
-ATOM 5297 N VAL E 69 6.311 35.083 -5.080 1.00 34.34 N
-ATOM 5298 CA VAL E 69 6.855 33.759 -5.343 1.00 37.45 C
-ATOM 5299 C VAL E 69 6.813 33.469 -6.827 1.00 37.90 C
-ATOM 5300 O VAL E 69 6.037 34.078 -7.571 1.00 36.22 O
-ATOM 5301 CB VAL E 69 6.085 32.675 -4.574 1.00 49.57 C
-ATOM 5302 CG1 VAL E 69 6.183 32.935 -3.084 1.00 52.41 C
-ATOM 5303 CG2 VAL E 69 4.642 32.640 -5.028 1.00 51.77 C
-ATOM 5304 H VAL E 69 5.371 35.321 -5.364 1.00 0.00 H
-ATOM 5305 HA VAL E 69 7.896 33.733 -5.024 1.00 0.00 H
-ATOM 5306 HB VAL E 69 6.555 31.709 -4.768 1.00 0.00 H
-ATOM 5307 1HG1 VAL E 69 5.661 32.148 -2.544 1.00 0.00 H
-ATOM 5308 2HG1 VAL E 69 7.222 32.948 -2.796 1.00 0.00 H
-ATOM 5309 3HG1 VAL E 69 5.731 33.893 -2.847 1.00 0.00 H
-ATOM 5310 1HG2 VAL E 69 4.113 31.856 -4.486 1.00 0.00 H
-ATOM 5311 2HG2 VAL E 69 4.172 33.602 -4.828 1.00 0.00 H
-ATOM 5312 3HG2 VAL E 69 4.607 32.430 -6.097 1.00 0.00 H
-ATOM 5313 N ILE E 70 7.677 32.563 -7.255 1.00 37.11 N
-ATOM 5314 CA ILE E 70 7.742 32.166 -8.650 1.00 35.98 C
-ATOM 5315 C ILE E 70 8.261 30.738 -8.739 1.00 37.05 C
-ATOM 5316 O ILE E 70 9.019 30.304 -7.876 1.00 37.83 O
-ATOM 5317 CB ILE E 70 8.651 33.149 -9.431 1.00 42.11 C
-ATOM 5318 CG1 ILE E 70 8.500 32.953 -10.924 1.00 40.58 C
-ATOM 5319 CG2 ILE E 70 10.107 32.957 -9.027 1.00 39.04 C
-ATOM 5320 CD1 ILE E 70 9.065 34.100 -11.714 1.00 37.62 C
-ATOM 5321 H ILE E 70 8.305 32.134 -6.580 1.00 0.00 H
-ATOM 5322 HA ILE E 70 6.741 32.198 -9.074 1.00 0.00 H
-ATOM 5323 HB ILE E 70 8.352 34.172 -9.205 1.00 0.00 H
-ATOM 5324 1HG1 ILE E 70 9.016 32.041 -11.227 1.00 0.00 H
-ATOM 5325 2HG1 ILE E 70 7.441 32.852 -11.161 1.00 0.00 H
-ATOM 5326 1HG2 ILE E 70 10.738 33.654 -9.564 1.00 0.00 H
-ATOM 5327 2HG2 ILE E 70 10.205 33.132 -7.953 1.00 0.00 H
-ATOM 5328 3HG2 ILE E 70 10.408 31.937 -9.266 1.00 0.00 H
-ATOM 5329 1HD1 ILE E 70 8.914 33.911 -12.755 1.00 0.00 H
-ATOM 5330 2HD1 ILE E 70 8.555 35.025 -11.439 1.00 0.00 H
-ATOM 5331 3HD1 ILE E 70 10.125 34.196 -11.506 1.00 0.00 H
-ATOM 5332 N GLU E 71 7.849 29.995 -9.754 1.00 37.09 N
-ATOM 5333 CA GLU E 71 8.419 28.663 -9.920 1.00 38.16 C
-ATOM 5334 C GLU E 71 9.239 28.602 -11.198 1.00 42.87 C
-ATOM 5335 O GLU E 71 8.829 29.145 -12.229 1.00 44.45 O
-ATOM 5336 CB GLU E 71 7.330 27.579 -9.958 1.00 34.48 C
-ATOM 5337 CG GLU E 71 6.568 27.393 -8.658 1.00 37.03 C
-ATOM 5338 CD GLU E 71 5.551 26.277 -8.713 1.00 32.53 C
-ATOM 5339 OE1 GLU E 71 5.382 25.693 -9.756 1.00 44.21 O
-ATOM 5340 OE2 GLU E 71 4.946 26.009 -7.700 1.00 48.42 O
-ATOM 5341 H GLU E 71 7.188 30.362 -10.421 1.00 0.00 H
-ATOM 5342 HA GLU E 71 9.087 28.458 -9.087 1.00 0.00 H
-ATOM 5343 1HB GLU E 71 6.607 27.815 -10.736 1.00 0.00 H
-ATOM 5344 2HB GLU E 71 7.788 26.619 -10.214 1.00 0.00 H
-ATOM 5345 1HG GLU E 71 7.282 27.167 -7.883 1.00 0.00 H
-ATOM 5346 2HG GLU E 71 6.070 28.326 -8.403 1.00 0.00 H
-ATOM 5347 N SER E 72 10.380 27.921 -11.120 1.00 44.08 N
-ATOM 5348 CA SER E 72 11.225 27.709 -12.286 1.00 46.09 C
-ATOM 5349 C SER E 72 10.833 26.394 -12.918 1.00 47.54 C
-ATOM 5350 O SER E 72 10.235 25.547 -12.249 1.00 47.15 O
-ATOM 5351 CB SER E 72 12.693 27.721 -11.897 1.00 38.46 C
-ATOM 5352 OG SER E 72 13.004 26.649 -11.075 1.00 34.66 O
-ATOM 5353 H SER E 72 10.636 27.506 -10.231 1.00 0.00 H
-ATOM 5354 HA SER E 72 11.045 28.501 -13.012 1.00 0.00 H
-ATOM 5355 1HB SER E 72 13.316 27.691 -12.793 1.00 0.00 H
-ATOM 5356 2HB SER E 72 12.917 28.647 -11.375 1.00 0.00 H
-ATOM 5357 HG SER E 72 13.235 25.911 -11.665 1.00 0.00 H
-ATOM 5358 N GLU E 73 11.176 26.233 -14.191 1.00 50.56 N
-ATOM 5359 CA GLU E 73 10.874 25.037 -14.971 1.00 58.13 C
-ATOM 5360 C GLU E 73 12.070 24.620 -15.827 1.00 60.47 C
-ATOM 5361 O GLU E 73 13.143 25.222 -15.764 1.00 60.25 O
-ATOM 5362 CB GLU E 73 9.622 25.254 -15.846 1.00 55.82 C
-ATOM 5363 CG GLU E 73 8.341 25.589 -15.075 1.00 66.41 C
-ATOM 5364 CD GLU E 73 7.145 25.758 -15.965 1.00 69.25 C
-ATOM 5365 OE1 GLU E 73 6.754 24.807 -16.599 1.00 80.98 O
-ATOM 5366 OE2 GLU E 73 6.619 26.856 -16.017 1.00 58.66 O
-ATOM 5367 H GLU E 73 11.676 26.990 -14.652 1.00 0.00 H
-ATOM 5368 HA GLU E 73 10.662 24.221 -14.282 1.00 0.00 H
-ATOM 5369 1HB GLU E 73 9.787 26.060 -16.536 1.00 0.00 H
-ATOM 5370 2HB GLU E 73 9.421 24.358 -16.436 1.00 0.00 H
-ATOM 5371 1HG GLU E 73 8.135 24.791 -14.359 1.00 0.00 H
-ATOM 5372 2HG GLU E 73 8.492 26.510 -14.518 1.00 0.00 H
-ATOM 5373 N GLY E 74 11.903 23.551 -16.593 1.00 64.05 N
-ATOM 5374 CA GLY E 74 12.952 23.085 -17.487 1.00 69.49 C
-ATOM 5375 C GLY E 74 12.490 21.859 -18.261 1.00 72.64 C
-ATOM 5376 O GLY E 74 11.423 21.310 -17.979 1.00 74.13 O
-ATOM 5377 H GLY E 74 11.014 23.073 -16.585 1.00 0.00 H
-ATOM 5378 1HA GLY E 74 13.217 23.883 -18.185 1.00 0.00 H
-ATOM 5379 2HA GLY E 74 13.845 22.846 -16.914 1.00 0.00 H
-ATOM 5380 N LYS E 75 13.296 21.436 -19.228 1.00 74.02 N
-ATOM 5381 CA LYS E 75 12.967 20.290 -20.068 1.00 75.02 C
-ATOM 5382 C LYS E 75 14.184 19.857 -20.874 1.00 76.38 C
-ATOM 5383 O LYS E 75 15.226 20.510 -20.829 1.00 77.12 O
-ATOM 5384 OXT LYS E 75 14.168 18.779 -21.473 1.00 0.00 O
-ATOM 5385 CB LYS E 75 11.794 20.639 -20.999 1.00 71.81 C
-ATOM 5386 CG LYS E 75 11.278 19.496 -21.862 1.00 45.00 C
-ATOM 5387 CD LYS E 75 10.020 19.917 -22.635 1.00 45.00 C
-ATOM 5388 CE LYS E 75 9.473 18.772 -23.478 1.00 45.00 C
-ATOM 5389 NZ LYS E 75 8.248 19.167 -24.235 1.00 45.00 N
-ATOM 5390 H LYS E 75 14.158 21.934 -19.394 1.00 0.00 H
-ATOM 5391 HA LYS E 75 12.673 19.458 -19.427 1.00 0.00 H
-ATOM 5392 1HB LYS E 75 10.949 20.997 -20.412 1.00 0.00 H
-ATOM 5393 2HB LYS E 75 12.090 21.450 -21.666 1.00 0.00 H
-ATOM 5394 1HG LYS E 75 12.052 19.208 -22.574 1.00 0.00 H
-ATOM 5395 2HG LYS E 75 11.045 18.638 -21.234 1.00 0.00 H
-ATOM 5396 1HD LYS E 75 9.252 20.237 -21.927 1.00 0.00 H
-ATOM 5397 2HD LYS E 75 10.255 20.758 -23.289 1.00 0.00 H
-ATOM 5398 1HE LYS E 75 10.238 18.454 -24.184 1.00 0.00 H
-ATOM 5399 2HE LYS E 75 9.227 17.937 -22.823 1.00 0.00 H
-ATOM 5400 1HZ LYS E 75 7.919 18.381 -24.778 1.00 0.00 H
-ATOM 5401 2HZ LYS E 75 7.527 19.454 -23.588 1.00 0.00 H
-ATOM 5402 3HZ LYS E 75 8.467 19.934 -24.855 1.00 0.00 H
-TER
-ATOM 5404 N SER F 7 20.123 47.131 -2.232 1.00 53.23 N
-ATOM 5405 CA SER F 7 20.392 46.959 -3.652 1.00 52.37 C
-ATOM 5406 C SER F 7 19.265 46.184 -4.331 1.00 49.16 C
-ATOM 5407 O SER F 7 19.146 44.958 -4.201 1.00 51.08 O
-ATOM 5408 CB SER F 7 21.725 46.269 -3.844 1.00 59.52 C
-ATOM 5409 OG SER F 7 21.989 46.041 -5.199 1.00 70.93 O
-ATOM 5410 1H SER F 7 20.830 47.722 -1.817 1.00 0.00 H
-ATOM 5411 2H SER F 7 19.216 47.561 -2.119 1.00 0.00 H
-ATOM 5412 3H SER F 7 20.128 46.231 -1.778 1.00 0.00 H
-ATOM 5413 HA SER F 7 20.450 47.944 -4.115 1.00 0.00 H
-ATOM 5414 1HB SER F 7 22.512 46.891 -3.427 1.00 0.00 H
-ATOM 5415 2HB SER F 7 21.728 45.335 -3.296 1.00 0.00 H
-ATOM 5416 HG SER F 7 22.081 46.908 -5.606 1.00 0.00 H
-ATOM 5417 N ASP F 8 18.452 46.926 -5.075 1.00 45.53 N
-ATOM 5418 CA ASP F 8 17.284 46.411 -5.786 1.00 45.17 C
-ATOM 5419 C ASP F 8 17.622 45.370 -6.838 1.00 42.72 C
-ATOM 5420 O ASP F 8 18.678 45.436 -7.480 1.00 41.25 O
-ATOM 5421 CB ASP F 8 16.549 47.572 -6.464 1.00 53.26 C
-ATOM 5422 CG ASP F 8 15.788 48.442 -5.479 1.00 58.02 C
-ATOM 5423 OD1 ASP F 8 14.800 47.988 -4.942 1.00 58.06 O
-ATOM 5424 OD2 ASP F 8 16.246 49.533 -5.214 1.00 48.46 O
-ATOM 5425 H ASP F 8 18.637 47.915 -5.145 1.00 0.00 H
-ATOM 5426 HA ASP F 8 16.616 45.952 -5.059 1.00 0.00 H
-ATOM 5427 1HB ASP F 8 17.259 48.194 -7.013 1.00 0.00 H
-ATOM 5428 2HB ASP F 8 15.839 47.171 -7.196 1.00 0.00 H
-ATOM 5429 N PHE F 9 16.680 44.449 -7.031 1.00 41.22 N
-ATOM 5430 CA PHE F 9 16.783 43.402 -8.034 1.00 40.11 C
-ATOM 5431 C PHE F 9 15.441 43.128 -8.661 1.00 38.59 C
-ATOM 5432 O PHE F 9 14.404 43.518 -8.116 1.00 34.95 O
-ATOM 5433 CB PHE F 9 17.286 42.070 -7.442 1.00 35.28 C
-ATOM 5434 CG PHE F 9 16.370 41.390 -6.469 1.00 40.55 C
-ATOM 5435 CD1 PHE F 9 15.432 40.477 -6.926 1.00 31.87 C
-ATOM 5436 CD2 PHE F 9 16.462 41.617 -5.108 1.00 46.80 C
-ATOM 5437 CE1 PHE F 9 14.599 39.810 -6.054 1.00 42.85 C
-ATOM 5438 CE2 PHE F 9 15.626 40.945 -4.232 1.00 49.21 C
-ATOM 5439 CZ PHE F 9 14.699 40.044 -4.710 1.00 45.04 C
-ATOM 5440 H PHE F 9 15.858 44.479 -6.445 1.00 0.00 H
-ATOM 5441 HA PHE F 9 17.452 43.737 -8.822 1.00 0.00 H
-ATOM 5442 1HB PHE F 9 17.460 41.368 -8.242 1.00 0.00 H
-ATOM 5443 2HB PHE F 9 18.216 42.227 -6.955 1.00 0.00 H
-ATOM 5444 HD1 PHE F 9 15.360 40.291 -7.997 1.00 0.00 H
-ATOM 5445 HD2 PHE F 9 17.204 42.325 -4.728 1.00 0.00 H
-ATOM 5446 HE1 PHE F 9 13.867 39.100 -6.437 1.00 0.00 H
-ATOM 5447 HE2 PHE F 9 15.699 41.124 -3.159 1.00 0.00 H
-ATOM 5448 HZ PHE F 9 14.054 39.526 -4.018 1.00 0.00 H
-ATOM 5449 N VAL F 10 15.478 42.463 -9.805 1.00 39.17 N
-ATOM 5450 CA VAL F 10 14.280 42.062 -10.524 1.00 36.93 C
-ATOM 5451 C VAL F 10 14.341 40.570 -10.838 1.00 36.74 C
-ATOM 5452 O VAL F 10 15.422 39.974 -10.860 1.00 37.47 O
-ATOM 5453 CB VAL F 10 14.160 42.884 -11.826 1.00 41.43 C
-ATOM 5454 CG1 VAL F 10 14.075 44.390 -11.502 1.00 33.61 C
-ATOM 5455 CG2 VAL F 10 15.362 42.614 -12.698 1.00 43.36 C
-ATOM 5456 H VAL F 10 16.395 42.224 -10.180 1.00 0.00 H
-ATOM 5457 HA VAL F 10 13.405 42.254 -9.902 1.00 0.00 H
-ATOM 5458 HB VAL F 10 13.246 42.591 -12.352 1.00 0.00 H
-ATOM 5459 1HG1 VAL F 10 13.993 44.946 -12.416 1.00 0.00 H
-ATOM 5460 2HG1 VAL F 10 13.207 44.585 -10.875 1.00 0.00 H
-ATOM 5461 3HG1 VAL F 10 14.975 44.704 -10.981 1.00 0.00 H
-ATOM 5462 1HG2 VAL F 10 15.276 43.181 -13.628 1.00 0.00 H
-ATOM 5463 2HG2 VAL F 10 16.271 42.910 -12.172 1.00 0.00 H
-ATOM 5464 3HG2 VAL F 10 15.405 41.553 -12.919 1.00 0.00 H
-ATOM 5465 N VAL F 11 13.187 39.963 -11.099 1.00 36.96 N
-ATOM 5466 CA VAL F 11 13.130 38.542 -11.451 1.00 37.10 C
-ATOM 5467 C VAL F 11 12.592 38.362 -12.862 1.00 40.55 C
-ATOM 5468 O VAL F 11 11.531 38.890 -13.173 1.00 40.75 O
-ATOM 5469 CB VAL F 11 12.185 37.778 -10.494 1.00 30.32 C
-ATOM 5470 CG1 VAL F 11 12.139 36.307 -10.874 1.00 25.69 C
-ATOM 5471 CG2 VAL F 11 12.617 37.963 -9.037 1.00 32.64 C
-ATOM 5472 H VAL F 11 12.323 40.501 -11.048 1.00 0.00 H
-ATOM 5473 HA VAL F 11 14.130 38.120 -11.395 1.00 0.00 H
-ATOM 5474 HB VAL F 11 11.195 38.157 -10.624 1.00 0.00 H
-ATOM 5475 1HG1 VAL F 11 11.445 35.797 -10.212 1.00 0.00 H
-ATOM 5476 2HG1 VAL F 11 11.798 36.202 -11.905 1.00 0.00 H
-ATOM 5477 3HG1 VAL F 11 13.126 35.876 -10.775 1.00 0.00 H
-ATOM 5478 1HG2 VAL F 11 11.923 37.433 -8.378 1.00 0.00 H
-ATOM 5479 2HG2 VAL F 11 13.592 37.576 -8.904 1.00 0.00 H
-ATOM 5480 3HG2 VAL F 11 12.615 39.015 -8.784 1.00 0.00 H
-ATOM 5481 N ILE F 12 13.306 37.629 -13.717 1.00 39.33 N
-ATOM 5482 CA ILE F 12 12.833 37.351 -15.073 1.00 36.54 C
-ATOM 5483 C ILE F 12 12.710 35.851 -15.338 1.00 36.07 C
-ATOM 5484 O ILE F 12 13.694 35.115 -15.242 1.00 37.62 O
-ATOM 5485 CB ILE F 12 13.768 37.924 -16.155 1.00 35.23 C
-ATOM 5486 CG1 ILE F 12 13.994 39.411 -15.952 1.00 39.75 C
-ATOM 5487 CG2 ILE F 12 13.151 37.688 -17.542 1.00 44.40 C
-ATOM 5488 CD1 ILE F 12 15.241 39.716 -15.160 1.00 39.72 C
-ATOM 5489 H ILE F 12 14.194 37.242 -13.407 1.00 0.00 H
-ATOM 5490 HA ILE F 12 11.840 37.795 -15.198 1.00 0.00 H
-ATOM 5491 HB ILE F 12 14.738 37.429 -16.096 1.00 0.00 H
-ATOM 5492 1HG1 ILE F 12 14.089 39.875 -16.924 1.00 0.00 H
-ATOM 5493 2HG1 ILE F 12 13.135 39.844 -15.442 1.00 0.00 H
-ATOM 5494 1HG2 ILE F 12 13.809 38.078 -18.309 1.00 0.00 H
-ATOM 5495 2HG2 ILE F 12 13.010 36.619 -17.703 1.00 0.00 H
-ATOM 5496 3HG2 ILE F 12 12.187 38.192 -17.602 1.00 0.00 H
-ATOM 5497 1HD1 ILE F 12 15.351 40.791 -15.073 1.00 0.00 H
-ATOM 5498 2HD1 ILE F 12 15.168 39.272 -14.163 1.00 0.00 H
-ATOM 5499 3HD1 ILE F 12 16.100 39.304 -15.669 1.00 0.00 H
-ATOM 5500 N LYS F 13 11.514 35.397 -15.699 1.00 34.73 N
-ATOM 5501 CA LYS F 13 11.305 33.996 -16.044 1.00 38.44 C
-ATOM 5502 C LYS F 13 11.027 33.812 -17.515 1.00 39.35 C
-ATOM 5503 O LYS F 13 10.094 34.387 -18.069 1.00 38.41 O
-ATOM 5504 CB LYS F 13 10.166 33.394 -15.259 1.00 38.13 C
-ATOM 5505 CG LYS F 13 9.887 31.964 -15.652 1.00 36.41 C
-ATOM 5506 CD LYS F 13 8.759 31.369 -14.876 1.00 36.71 C
-ATOM 5507 CE LYS F 13 8.409 30.003 -15.443 1.00 34.98 C
-ATOM 5508 NZ LYS F 13 7.347 29.346 -14.673 1.00 42.98 N
-ATOM 5509 H LYS F 13 10.729 36.036 -15.726 1.00 0.00 H
-ATOM 5510 HA LYS F 13 12.209 33.439 -15.813 1.00 0.00 H
-ATOM 5511 1HB LYS F 13 10.428 33.403 -14.217 1.00 0.00 H
-ATOM 5512 2HB LYS F 13 9.276 33.981 -15.384 1.00 0.00 H
-ATOM 5513 1HG LYS F 13 9.638 31.920 -16.711 1.00 0.00 H
-ATOM 5514 2HG LYS F 13 10.785 31.363 -15.493 1.00 0.00 H
-ATOM 5515 1HD LYS F 13 9.039 31.266 -13.823 1.00 0.00 H
-ATOM 5516 2HD LYS F 13 7.888 32.021 -14.945 1.00 0.00 H
-ATOM 5517 1HE LYS F 13 8.075 30.128 -16.471 1.00 0.00 H
-ATOM 5518 2HE LYS F 13 9.296 29.366 -15.431 1.00 0.00 H
-ATOM 5519 1HZ LYS F 13 7.128 28.426 -15.090 1.00 0.00 H
-ATOM 5520 2HZ LYS F 13 7.703 29.223 -13.709 1.00 0.00 H
-ATOM 5521 3HZ LYS F 13 6.517 29.910 -14.668 1.00 0.00 H
-ATOM 5522 N ALA F 14 11.837 33.012 -18.178 1.00 40.96 N
-ATOM 5523 CA ALA F 14 11.610 32.825 -19.603 1.00 44.82 C
-ATOM 5524 C ALA F 14 10.319 32.060 -19.858 1.00 48.48 C
-ATOM 5525 O ALA F 14 10.112 30.972 -19.314 1.00 47.55 O
-ATOM 5526 CB ALA F 14 12.761 32.070 -20.208 1.00 38.69 C
-ATOM 5527 H ALA F 14 12.600 32.534 -17.693 1.00 0.00 H
-ATOM 5528 HA ALA F 14 11.523 33.803 -20.065 1.00 0.00 H
-ATOM 5529 1HB ALA F 14 12.603 31.933 -21.274 1.00 0.00 H
-ATOM 5530 2HB ALA F 14 13.672 32.609 -20.051 1.00 0.00 H
-ATOM 5531 3HB ALA F 14 12.813 31.121 -19.718 1.00 0.00 H
-ATOM 5532 N LEU F 15 9.478 32.575 -20.754 1.00 50.08 N
-ATOM 5533 CA LEU F 15 8.256 31.866 -21.134 1.00 51.95 C
-ATOM 5534 C LEU F 15 8.448 31.149 -22.468 1.00 52.96 C
-ATOM 5535 O LEU F 15 7.616 30.327 -22.876 1.00 55.35 O
-ATOM 5536 CB LEU F 15 7.075 32.841 -21.166 1.00 44.44 C
-ATOM 5537 CG LEU F 15 6.288 33.026 -19.819 1.00 42.57 C
-ATOM 5538 CD1 LEU F 15 7.234 33.049 -18.638 1.00 46.26 C
-ATOM 5539 CD2 LEU F 15 5.534 34.355 -19.882 1.00 37.34 C
-ATOM 5540 H LEU F 15 9.663 33.480 -21.185 1.00 0.00 H
-ATOM 5541 HA LEU F 15 8.044 31.114 -20.377 1.00 0.00 H
-ATOM 5542 1HB LEU F 15 7.445 33.808 -21.457 1.00 0.00 H
-ATOM 5543 2HB LEU F 15 6.370 32.504 -21.924 1.00 0.00 H
-ATOM 5544 HG LEU F 15 5.589 32.201 -19.682 1.00 0.00 H
-ATOM 5545 1HD1 LEU F 15 6.670 33.187 -17.718 1.00 0.00 H
-ATOM 5546 2HD1 LEU F 15 7.778 32.110 -18.583 1.00 0.00 H
-ATOM 5547 3HD1 LEU F 15 7.913 33.846 -18.758 1.00 0.00 H
-ATOM 5548 1HD2 LEU F 15 4.975 34.511 -18.957 1.00 0.00 H
-ATOM 5549 2HD2 LEU F 15 6.237 35.168 -20.015 1.00 0.00 H
-ATOM 5550 3HD2 LEU F 15 4.848 34.346 -20.709 1.00 0.00 H
-ATOM 5551 N GLU F 16 9.582 31.433 -23.103 1.00 53.20 N
-ATOM 5552 CA GLU F 16 9.974 30.843 -24.382 1.00 54.01 C
-ATOM 5553 C GLU F 16 11.491 30.704 -24.462 1.00 53.96 C
-ATOM 5554 O GLU F 16 12.224 31.321 -23.697 1.00 53.25 O
-ATOM 5555 CB GLU F 16 9.450 31.668 -25.571 1.00 47.21 C
-ATOM 5556 CG GLU F 16 9.940 33.116 -25.654 1.00 53.28 C
-ATOM 5557 CD GLU F 16 9.363 33.856 -26.864 1.00 59.94 C
-ATOM 5558 OE1 GLU F 16 8.702 33.229 -27.658 1.00 66.15 O
-ATOM 5559 OE2 GLU F 16 9.544 35.055 -26.960 1.00 55.63 O
-ATOM 5560 H GLU F 16 10.194 32.113 -22.679 1.00 0.00 H
-ATOM 5561 HA GLU F 16 9.546 29.843 -24.449 1.00 0.00 H
-ATOM 5562 1HB GLU F 16 9.749 31.181 -26.502 1.00 0.00 H
-ATOM 5563 2HB GLU F 16 8.360 31.690 -25.549 1.00 0.00 H
-ATOM 5564 1HG GLU F 16 9.654 33.636 -24.742 1.00 0.00 H
-ATOM 5565 2HG GLU F 16 11.031 33.120 -25.713 1.00 0.00 H
-ATOM 5566 N ASP F 17 11.970 29.858 -25.360 1.00 54.13 N
-ATOM 5567 CA ASP F 17 13.409 29.709 -25.541 1.00 52.21 C
-ATOM 5568 C ASP F 17 14.042 30.989 -26.072 1.00 49.99 C
-ATOM 5569 O ASP F 17 13.420 31.708 -26.854 1.00 47.14 O
-ATOM 5570 CB ASP F 17 13.713 28.532 -26.458 1.00 46.18 C
-ATOM 5571 CG ASP F 17 13.436 27.200 -25.783 1.00 56.57 C
-ATOM 5572 OD1 ASP F 17 13.252 27.194 -24.575 1.00 65.92 O
-ATOM 5573 OD2 ASP F 17 13.392 26.205 -26.461 1.00 53.46 O
-ATOM 5574 H ASP F 17 11.332 29.347 -25.954 1.00 0.00 H
-ATOM 5575 HA ASP F 17 13.853 29.497 -24.578 1.00 0.00 H
-ATOM 5576 1HB ASP F 17 13.115 28.604 -27.365 1.00 0.00 H
-ATOM 5577 2HB ASP F 17 14.767 28.563 -26.749 1.00 0.00 H
-ATOM 5578 N GLY F 18 15.287 31.261 -25.681 1.00 47.52 N
-ATOM 5579 CA GLY F 18 15.999 32.418 -26.217 1.00 44.92 C
-ATOM 5580 C GLY F 18 15.671 33.796 -25.611 1.00 45.01 C
-ATOM 5581 O GLY F 18 15.883 34.812 -26.271 1.00 50.15 O
-ATOM 5582 H GLY F 18 15.779 30.629 -25.038 1.00 0.00 H
-ATOM 5583 1HA GLY F 18 17.066 32.237 -26.098 1.00 0.00 H
-ATOM 5584 2HA GLY F 18 15.821 32.460 -27.289 1.00 0.00 H
-ATOM 5585 N VAL F 19 15.136 33.857 -24.391 1.00 43.49 N
-ATOM 5586 CA VAL F 19 14.852 35.164 -23.788 1.00 42.10 C
-ATOM 5587 C VAL F 19 16.159 35.841 -23.435 1.00 39.62 C
-ATOM 5588 O VAL F 19 17.061 35.214 -22.885 1.00 39.76 O
-ATOM 5589 CB VAL F 19 13.957 35.037 -22.541 1.00 53.61 C
-ATOM 5590 CG1 VAL F 19 13.845 36.392 -21.808 1.00 47.46 C
-ATOM 5591 CG2 VAL F 19 12.591 34.586 -22.987 1.00 39.48 C
-ATOM 5592 H VAL F 19 14.976 33.010 -23.852 1.00 0.00 H
-ATOM 5593 HA VAL F 19 14.325 35.780 -24.517 1.00 0.00 H
-ATOM 5594 HB VAL F 19 14.378 34.317 -21.871 1.00 0.00 H
-ATOM 5595 1HG1 VAL F 19 13.216 36.283 -20.934 1.00 0.00 H
-ATOM 5596 2HG1 VAL F 19 14.837 36.718 -21.490 1.00 0.00 H
-ATOM 5597 3HG1 VAL F 19 13.413 37.139 -22.479 1.00 0.00 H
-ATOM 5598 1HG2 VAL F 19 11.941 34.478 -22.140 1.00 0.00 H
-ATOM 5599 2HG2 VAL F 19 12.168 35.317 -23.669 1.00 0.00 H
-ATOM 5600 3HG2 VAL F 19 12.685 33.638 -23.494 1.00 0.00 H
-ATOM 5601 N ASN F 20 16.284 37.113 -23.783 1.00 38.75 N
-ATOM 5602 CA ASN F 20 17.522 37.826 -23.525 1.00 39.53 C
-ATOM 5603 C ASN F 20 17.367 38.964 -22.529 1.00 40.54 C
-ATOM 5604 O ASN F 20 16.601 39.910 -22.750 1.00 39.41 O
-ATOM 5605 CB ASN F 20 18.125 38.318 -24.827 1.00 56.19 C
-ATOM 5606 CG ASN F 20 18.610 37.178 -25.711 1.00 62.75 C
-ATOM 5607 OD1 ASN F 20 19.492 36.401 -25.319 1.00 68.35 O
-ATOM 5608 ND2 ASN F 20 18.058 37.068 -26.893 1.00 55.15 N
-ATOM 5609 H ASN F 20 15.503 37.593 -24.226 1.00 0.00 H
-ATOM 5610 HA ASN F 20 18.232 37.125 -23.085 1.00 0.00 H
-ATOM 5611 1HB ASN F 20 17.375 38.886 -25.377 1.00 0.00 H
-ATOM 5612 2HB ASN F 20 18.956 38.990 -24.615 1.00 0.00 H
-ATOM 5613 1HD2 ASN F 20 18.339 36.333 -27.510 1.00 0.00 H
-ATOM 5614 2HD2 ASN F 20 17.348 37.709 -27.175 1.00 0.00 H
-ATOM 5615 N VAL F 21 18.082 38.855 -21.412 1.00 39.54 N
-ATOM 5616 CA VAL F 21 18.052 39.905 -20.406 1.00 40.49 C
-ATOM 5617 C VAL F 21 19.343 40.693 -20.544 1.00 39.67 C
-ATOM 5618 O VAL F 21 20.443 40.159 -20.377 1.00 40.01 O
-ATOM 5619 CB VAL F 21 17.903 39.336 -18.997 1.00 35.10 C
-ATOM 5620 CG1 VAL F 21 17.884 40.468 -18.012 1.00 34.18 C
-ATOM 5621 CG2 VAL F 21 16.635 38.537 -18.932 1.00 28.34 C
-ATOM 5622 H VAL F 21 18.671 38.032 -21.272 1.00 0.00 H
-ATOM 5623 HA VAL F 21 17.212 40.572 -20.600 1.00 0.00 H
-ATOM 5624 HB VAL F 21 18.755 38.700 -18.759 1.00 0.00 H
-ATOM 5625 1HG1 VAL F 21 17.783 40.087 -17.005 1.00 0.00 H
-ATOM 5626 2HG1 VAL F 21 18.813 41.031 -18.093 1.00 0.00 H
-ATOM 5627 3HG1 VAL F 21 17.044 41.115 -18.243 1.00 0.00 H
-ATOM 5628 1HG2 VAL F 21 16.512 38.133 -17.936 1.00 0.00 H
-ATOM 5629 2HG2 VAL F 21 15.796 39.180 -19.172 1.00 0.00 H
-ATOM 5630 3HG2 VAL F 21 16.690 37.721 -19.655 1.00 0.00 H
-ATOM 5631 N ILE F 22 19.202 41.949 -20.917 1.00 39.44 N
-ATOM 5632 CA ILE F 22 20.332 42.760 -21.308 1.00 38.00 C
-ATOM 5633 C ILE F 22 20.713 43.828 -20.299 1.00 36.94 C
-ATOM 5634 O ILE F 22 19.883 44.629 -19.866 1.00 38.49 O
-ATOM 5635 CB ILE F 22 20.021 43.427 -22.648 1.00 38.59 C
-ATOM 5636 CG1 ILE F 22 19.732 42.363 -23.709 1.00 40.78 C
-ATOM 5637 CG2 ILE F 22 21.180 44.285 -23.076 1.00 33.56 C
-ATOM 5638 CD1 ILE F 22 19.163 42.936 -24.989 1.00 37.80 C
-ATOM 5639 H ILE F 22 18.274 42.340 -20.997 1.00 0.00 H
-ATOM 5640 HA ILE F 22 21.179 42.104 -21.444 1.00 0.00 H
-ATOM 5641 HB ILE F 22 19.139 44.024 -22.549 1.00 0.00 H
-ATOM 5642 1HG1 ILE F 22 20.650 41.832 -23.934 1.00 0.00 H
-ATOM 5643 2HG1 ILE F 22 19.007 41.649 -23.308 1.00 0.00 H
-ATOM 5644 1HG2 ILE F 22 20.930 44.738 -24.017 1.00 0.00 H
-ATOM 5645 2HG2 ILE F 22 21.368 45.055 -22.337 1.00 0.00 H
-ATOM 5646 3HG2 ILE F 22 22.073 43.666 -23.188 1.00 0.00 H
-ATOM 5647 1HD1 ILE F 22 18.977 42.128 -25.697 1.00 0.00 H
-ATOM 5648 2HD1 ILE F 22 18.225 43.454 -24.773 1.00 0.00 H
-ATOM 5649 3HD1 ILE F 22 19.875 43.637 -25.416 1.00 0.00 H
-ATOM 5650 N GLY F 23 21.983 43.835 -19.915 1.00 34.33 N
-ATOM 5651 CA GLY F 23 22.480 44.848 -19.003 1.00 36.67 C
-ATOM 5652 C GLY F 23 22.991 46.044 -19.793 1.00 39.62 C
-ATOM 5653 O GLY F 23 23.802 45.892 -20.726 1.00 37.69 O
-ATOM 5654 H GLY F 23 22.615 43.144 -20.300 1.00 0.00 H
-ATOM 5655 1HA GLY F 23 21.683 45.164 -18.327 1.00 0.00 H
-ATOM 5656 2HA GLY F 23 23.282 44.435 -18.393 1.00 0.00 H
-ATOM 5657 N LEU F 24 22.538 47.233 -19.367 1.00 38.88 N
-ATOM 5658 CA LEU F 24 22.904 48.534 -19.927 1.00 40.32 C
-ATOM 5659 C LEU F 24 23.844 49.256 -18.967 1.00 43.68 C
-ATOM 5660 O LEU F 24 23.558 49.366 -17.760 1.00 42.09 O
-ATOM 5661 CB LEU F 24 21.656 49.391 -20.143 1.00 38.65 C
-ATOM 5662 CG LEU F 24 20.789 49.071 -21.379 1.00 44.42 C
-ATOM 5663 CD1 LEU F 24 20.061 47.733 -21.181 1.00 38.53 C
-ATOM 5664 CD2 LEU F 24 19.782 50.192 -21.606 1.00 37.93 C
-ATOM 5665 H LEU F 24 21.856 47.234 -18.611 1.00 0.00 H
-ATOM 5666 HA LEU F 24 23.410 48.383 -20.876 1.00 0.00 H
-ATOM 5667 1HB LEU F 24 21.045 49.246 -19.283 1.00 0.00 H
-ATOM 5668 2HB LEU F 24 21.951 50.437 -20.189 1.00 0.00 H
-ATOM 5669 HG LEU F 24 21.426 48.991 -22.241 1.00 0.00 H
-ATOM 5670 1HD1 LEU F 24 19.466 47.513 -22.062 1.00 0.00 H
-ATOM 5671 2HD1 LEU F 24 20.773 46.944 -21.037 1.00 0.00 H
-ATOM 5672 3HD1 LEU F 24 19.410 47.789 -20.308 1.00 0.00 H
-ATOM 5673 1HD2 LEU F 24 19.179 49.967 -22.490 1.00 0.00 H
-ATOM 5674 2HD2 LEU F 24 19.131 50.278 -20.744 1.00 0.00 H
-ATOM 5675 3HD2 LEU F 24 20.308 51.134 -21.761 1.00 0.00 H
-ATOM 5676 N THR F 25 24.955 49.763 -19.506 1.00 44.59 N
-ATOM 5677 CA THR F 25 26.000 50.337 -18.664 1.00 44.82 C
-ATOM 5678 C THR F 25 25.624 51.591 -17.900 1.00 45.84 C
-ATOM 5679 O THR F 25 24.942 52.480 -18.409 1.00 47.96 O
-ATOM 5680 CB THR F 25 27.260 50.681 -19.485 1.00 44.21 C
-ATOM 5681 OG1 THR F 25 26.930 51.610 -20.524 1.00 42.26 O
-ATOM 5682 CG2 THR F 25 27.841 49.442 -20.097 1.00 24.51 C
-ATOM 5683 H THR F 25 25.104 49.669 -20.507 1.00 0.00 H
-ATOM 5684 HA THR F 25 26.274 49.578 -17.944 1.00 0.00 H
-ATOM 5685 HB THR F 25 28.006 51.138 -18.832 1.00 0.00 H
-ATOM 5686 HG1 THR F 25 27.148 52.538 -20.245 1.00 0.00 H
-ATOM 5687 1HG2 THR F 25 28.729 49.701 -20.670 1.00 0.00 H
-ATOM 5688 2HG2 THR F 25 28.108 48.747 -19.303 1.00 0.00 H
-ATOM 5689 3HG2 THR F 25 27.112 48.983 -20.750 1.00 0.00 H
-ATOM 5690 N ARG F 26 26.158 51.658 -16.682 1.00 46.16 N
-ATOM 5691 CA ARG F 26 26.057 52.814 -15.801 1.00 43.69 C
-ATOM 5692 C ARG F 26 27.106 53.861 -16.154 1.00 42.02 C
-ATOM 5693 O ARG F 26 28.280 53.535 -16.332 1.00 40.52 O
-ATOM 5694 CB ARG F 26 26.251 52.405 -14.344 1.00 34.37 C
-ATOM 5695 CG ARG F 26 26.038 53.537 -13.337 1.00 34.18 C
-ATOM 5696 CD ARG F 26 26.264 53.105 -11.932 1.00 43.66 C
-ATOM 5697 NE ARG F 26 25.354 52.054 -11.532 1.00 45.04 N
-ATOM 5698 CZ ARG F 26 24.084 52.235 -11.145 1.00 45.20 C
-ATOM 5699 NH1 ARG F 26 23.559 53.439 -11.105 1.00 34.87 N
-ATOM 5700 NH2 ARG F 26 23.389 51.175 -10.812 1.00 35.35 N
-ATOM 5701 H ARG F 26 26.652 50.835 -16.351 1.00 0.00 H
-ATOM 5702 HA ARG F 26 25.070 53.256 -15.922 1.00 0.00 H
-ATOM 5703 1HB ARG F 26 25.566 51.593 -14.091 1.00 0.00 H
-ATOM 5704 2HB ARG F 26 27.262 52.024 -14.205 1.00 0.00 H
-ATOM 5705 1HG ARG F 26 26.740 54.342 -13.545 1.00 0.00 H
-ATOM 5706 2HG ARG F 26 25.021 53.913 -13.422 1.00 0.00 H
-ATOM 5707 1HD ARG F 26 27.281 52.737 -11.824 1.00 0.00 H
-ATOM 5708 2HD ARG F 26 26.117 53.953 -11.269 1.00 0.00 H
-ATOM 5709 HE ARG F 26 25.695 51.084 -11.521 1.00 0.00 H
-ATOM 5710 1HH1 ARG F 26 24.120 54.234 -11.360 1.00 0.00 H
-ATOM 5711 2HH1 ARG F 26 22.602 53.567 -10.804 1.00 0.00 H
-ATOM 5712 1HH2 ARG F 26 23.863 50.266 -10.854 1.00 0.00 H
-ATOM 5713 2HH2 ARG F 26 22.411 51.241 -10.530 1.00 0.00 H
-ATOM 5714 N GLY F 27 26.696 55.124 -16.227 1.00 42.51 N
-ATOM 5715 CA GLY F 27 27.636 56.208 -16.498 1.00 45.89 C
-ATOM 5716 C GLY F 27 27.192 57.049 -17.685 1.00 49.67 C
-ATOM 5717 O GLY F 27 26.109 56.851 -18.229 1.00 48.89 O
-ATOM 5718 H GLY F 27 25.717 55.337 -16.098 1.00 0.00 H
-ATOM 5719 1HA GLY F 27 27.722 56.839 -15.614 1.00 0.00 H
-ATOM 5720 2HA GLY F 27 28.627 55.799 -16.689 1.00 0.00 H
-ATOM 5721 N ALA F 28 28.034 58.009 -18.077 1.00 49.63 N
-ATOM 5722 CA ALA F 28 27.693 58.907 -19.181 1.00 49.70 C
-ATOM 5723 C ALA F 28 27.461 58.118 -20.461 1.00 48.81 C
-ATOM 5724 O ALA F 28 26.576 58.451 -21.252 1.00 47.72 O
-ATOM 5725 CB ALA F 28 28.820 59.906 -19.400 1.00 45.40 C
-ATOM 5726 H ALA F 28 28.908 58.127 -17.592 1.00 0.00 H
-ATOM 5727 HA ALA F 28 26.780 59.437 -18.926 1.00 0.00 H
-ATOM 5728 1HB ALA F 28 28.552 60.582 -20.212 1.00 0.00 H
-ATOM 5729 2HB ALA F 28 28.979 60.479 -18.492 1.00 0.00 H
-ATOM 5730 3HB ALA F 28 29.734 59.373 -19.661 1.00 0.00 H
-ATOM 5731 N ASP F 29 28.245 57.069 -20.669 1.00 48.40 N
-ATOM 5732 CA ASP F 29 28.090 56.225 -21.837 1.00 48.54 C
-ATOM 5733 C ASP F 29 27.184 55.048 -21.511 1.00 49.46 C
-ATOM 5734 O ASP F 29 27.548 54.194 -20.691 1.00 50.85 O
-ATOM 5735 CB ASP F 29 29.439 55.706 -22.338 1.00 52.70 C
-ATOM 5736 CG ASP F 29 30.331 56.792 -22.928 1.00 63.30 C
-ATOM 5737 OD1 ASP F 29 29.821 57.704 -23.527 1.00 66.10 O
-ATOM 5738 OD2 ASP F 29 31.520 56.693 -22.773 1.00 69.63 O
-ATOM 5739 H ASP F 29 28.956 56.845 -19.983 1.00 0.00 H
-ATOM 5740 HA ASP F 29 27.619 56.807 -22.632 1.00 0.00 H
-ATOM 5741 1HB ASP F 29 29.970 55.225 -21.515 1.00 0.00 H
-ATOM 5742 2HB ASP F 29 29.268 54.947 -23.102 1.00 0.00 H
-ATOM 5743 N THR F 30 26.031 54.991 -22.164 1.00 47.92 N
-ATOM 5744 CA THR F 30 25.082 53.914 -21.928 1.00 45.68 C
-ATOM 5745 C THR F 30 25.053 52.991 -23.138 1.00 47.12 C
-ATOM 5746 O THR F 30 24.754 53.425 -24.252 1.00 47.27 O
-ATOM 5747 CB THR F 30 23.663 54.444 -21.641 1.00 35.92 C
-ATOM 5748 OG1 THR F 30 23.671 55.279 -20.466 1.00 44.04 O
-ATOM 5749 CG2 THR F 30 22.709 53.263 -21.406 1.00 41.74 C
-ATOM 5750 H THR F 30 25.802 55.726 -22.823 1.00 0.00 H
-ATOM 5751 HA THR F 30 25.400 53.341 -21.063 1.00 0.00 H
-ATOM 5752 HB THR F 30 23.316 55.029 -22.482 1.00 0.00 H
-ATOM 5753 HG1 THR F 30 24.194 56.073 -20.627 1.00 0.00 H
-ATOM 5754 1HG2 THR F 30 21.711 53.642 -21.201 1.00 0.00 H
-ATOM 5755 2HG2 THR F 30 22.683 52.630 -22.295 1.00 0.00 H
-ATOM 5756 3HG2 THR F 30 23.065 52.679 -20.553 1.00 0.00 H
-ATOM 5757 N ARG F 31 25.376 51.726 -22.921 1.00 48.43 N
-ATOM 5758 CA ARG F 31 25.440 50.753 -24.005 1.00 48.66 C
-ATOM 5759 C ARG F 31 25.225 49.343 -23.480 1.00 50.52 C
-ATOM 5760 O ARG F 31 25.238 49.110 -22.274 1.00 53.76 O
-ATOM 5761 CB ARG F 31 26.791 50.870 -24.700 1.00 39.75 C
-ATOM 5762 CG ARG F 31 27.986 50.543 -23.810 1.00 47.22 C
-ATOM 5763 CD ARG F 31 29.270 51.120 -24.330 1.00 53.34 C
-ATOM 5764 NE ARG F 31 29.699 50.524 -25.587 1.00 67.16 N
-ATOM 5765 CZ ARG F 31 30.727 50.991 -26.342 1.00 66.09 C
-ATOM 5766 NH1 ARG F 31 31.416 52.058 -25.951 1.00 72.25 N
-ATOM 5767 NH2 ARG F 31 31.039 50.375 -27.475 1.00 63.93 N
-ATOM 5768 H ARG F 31 25.656 51.462 -21.983 1.00 0.00 H
-ATOM 5769 HA ARG F 31 24.653 50.978 -24.725 1.00 0.00 H
-ATOM 5770 1HB ARG F 31 26.820 50.205 -25.564 1.00 0.00 H
-ATOM 5771 2HB ARG F 31 26.923 51.889 -25.066 1.00 0.00 H
-ATOM 5772 1HG ARG F 31 27.810 50.960 -22.819 1.00 0.00 H
-ATOM 5773 2HG ARG F 31 28.098 49.459 -23.733 1.00 0.00 H
-ATOM 5774 1HD ARG F 31 29.150 52.197 -24.486 1.00 0.00 H
-ATOM 5775 2HD ARG F 31 30.053 50.947 -23.589 1.00 0.00 H
-ATOM 5776 HE ARG F 31 29.198 49.705 -25.919 1.00 0.00 H
-ATOM 5777 1HH1 ARG F 31 31.183 52.534 -25.083 1.00 0.00 H
-ATOM 5778 2HH1 ARG F 31 32.182 52.403 -26.518 1.00 0.00 H
-ATOM 5779 1HH2 ARG F 31 30.514 49.560 -27.775 1.00 0.00 H
-ATOM 5780 2HH2 ARG F 31 31.806 50.722 -28.040 1.00 0.00 H
-ATOM 5781 N PHE F 32 25.005 48.384 -24.365 1.00 50.15 N
-ATOM 5782 CA PHE F 32 24.839 47.025 -23.870 1.00 49.06 C
-ATOM 5783 C PHE F 32 26.196 46.476 -23.474 1.00 48.26 C
-ATOM 5784 O PHE F 32 27.173 46.673 -24.200 1.00 48.50 O
-ATOM 5785 CB PHE F 32 24.249 46.116 -24.943 1.00 46.05 C
-ATOM 5786 CG PHE F 32 22.841 46.431 -25.306 1.00 48.52 C
-ATOM 5787 CD1 PHE F 32 22.097 47.319 -24.554 1.00 55.28 C
-ATOM 5788 CD2 PHE F 32 22.253 45.835 -26.410 1.00 50.28 C
-ATOM 5789 CE1 PHE F 32 20.789 47.609 -24.900 1.00 49.22 C
-ATOM 5790 CE2 PHE F 32 20.952 46.121 -26.756 1.00 45.34 C
-ATOM 5791 CZ PHE F 32 20.223 47.009 -25.998 1.00 51.46 C
-ATOM 5792 H PHE F 32 24.973 48.581 -25.356 1.00 0.00 H
-ATOM 5793 HA PHE F 32 24.189 47.033 -22.994 1.00 0.00 H
-ATOM 5794 1HB PHE F 32 24.858 46.172 -25.841 1.00 0.00 H
-ATOM 5795 2HB PHE F 32 24.284 45.083 -24.588 1.00 0.00 H
-ATOM 5796 HD1 PHE F 32 22.556 47.784 -23.687 1.00 0.00 H
-ATOM 5797 HD2 PHE F 32 22.834 45.133 -27.008 1.00 0.00 H
-ATOM 5798 HE1 PHE F 32 20.203 48.315 -24.309 1.00 0.00 H
-ATOM 5799 HE2 PHE F 32 20.502 45.649 -27.627 1.00 0.00 H
-ATOM 5800 HZ PHE F 32 19.203 47.242 -26.269 1.00 0.00 H
-ATOM 5801 N HIS F 33 26.261 45.761 -22.356 1.00 44.71 N
-ATOM 5802 CA HIS F 33 27.527 45.135 -21.988 1.00 39.77 C
-ATOM 5803 C HIS F 33 27.366 43.630 -21.798 1.00 37.49 C
-ATOM 5804 O HIS F 33 28.336 42.881 -21.911 1.00 36.38 O
-ATOM 5805 CB HIS F 33 28.105 45.773 -20.723 1.00 37.86 C
-ATOM 5806 CG HIS F 33 27.367 45.482 -19.462 1.00 40.95 C
-ATOM 5807 ND1 HIS F 33 27.579 44.327 -18.752 1.00 40.61 N
-ATOM 5808 CD2 HIS F 33 26.423 46.171 -18.783 1.00 39.10 C
-ATOM 5809 CE1 HIS F 33 26.810 44.318 -17.689 1.00 41.12 C
-ATOM 5810 NE2 HIS F 33 26.098 45.422 -17.682 1.00 42.95 N
-ATOM 5811 H HIS F 33 25.434 45.674 -21.772 1.00 0.00 H
-ATOM 5812 HA HIS F 33 28.252 45.281 -22.785 1.00 0.00 H
-ATOM 5813 1HB HIS F 33 29.131 45.433 -20.590 1.00 0.00 H
-ATOM 5814 2HB HIS F 33 28.139 46.835 -20.860 1.00 0.00 H
-ATOM 5815 HD2 HIS F 33 26.001 47.132 -19.057 1.00 0.00 H
-ATOM 5816 HE1 HIS F 33 26.772 43.527 -16.940 1.00 0.00 H
-ATOM 5817 HE2 HIS F 33 25.428 45.661 -16.967 1.00 0.00 H
-ATOM 5818 N HIS F 34 26.137 43.181 -21.544 1.00 33.93 N
-ATOM 5819 CA HIS F 34 25.904 41.751 -21.314 1.00 34.60 C
-ATOM 5820 C HIS F 34 24.490 41.321 -21.648 1.00 34.04 C
-ATOM 5821 O HIS F 34 23.526 42.013 -21.341 1.00 31.77 O
-ATOM 5822 CB HIS F 34 26.199 41.342 -19.865 1.00 38.00 C
-ATOM 5823 CG HIS F 34 26.061 39.841 -19.624 1.00 39.78 C
-ATOM 5824 ND1 HIS F 34 26.987 38.924 -20.084 1.00 44.47 N
-ATOM 5825 CD2 HIS F 34 25.101 39.117 -18.983 1.00 44.75 C
-ATOM 5826 CE1 HIS F 34 26.603 37.699 -19.734 1.00 38.55 C
-ATOM 5827 NE2 HIS F 34 25.463 37.791 -19.069 1.00 43.91 N
-ATOM 5828 H HIS F 34 25.374 43.852 -21.455 1.00 0.00 H
-ATOM 5829 HA HIS F 34 26.571 41.178 -21.957 1.00 0.00 H
-ATOM 5830 1HB HIS F 34 27.217 41.637 -19.605 1.00 0.00 H
-ATOM 5831 2HB HIS F 34 25.521 41.866 -19.192 1.00 0.00 H
-ATOM 5832 HD2 HIS F 34 24.207 39.510 -18.499 1.00 0.00 H
-ATOM 5833 HE1 HIS F 34 27.133 36.774 -19.960 1.00 0.00 H
-ATOM 5834 HE2 HIS F 34 24.926 36.998 -18.680 1.00 0.00 H
-ATOM 5835 N SER F 35 24.365 40.145 -22.252 1.00 34.66 N
-ATOM 5836 CA SER F 35 23.054 39.588 -22.569 1.00 40.44 C
-ATOM 5837 C SER F 35 22.946 38.156 -22.059 1.00 41.28 C
-ATOM 5838 O SER F 35 23.622 37.254 -22.561 1.00 39.54 O
-ATOM 5839 CB SER F 35 22.825 39.634 -24.072 1.00 44.91 C
-ATOM 5840 OG SER F 35 21.611 39.038 -24.416 1.00 49.51 O
-ATOM 5841 H SER F 35 25.198 39.619 -22.484 1.00 0.00 H
-ATOM 5842 HA SER F 35 22.289 40.179 -22.074 1.00 0.00 H
-ATOM 5843 1HB SER F 35 22.834 40.672 -24.409 1.00 0.00 H
-ATOM 5844 2HB SER F 35 23.637 39.118 -24.578 1.00 0.00 H
-ATOM 5845 HG SER F 35 21.695 38.109 -24.175 1.00 0.00 H
-ATOM 5846 N GLU F 36 22.112 37.957 -21.037 1.00 43.47 N
-ATOM 5847 CA GLU F 36 21.951 36.642 -20.429 1.00 42.45 C
-ATOM 5848 C GLU F 36 20.831 35.882 -21.117 1.00 44.76 C
-ATOM 5849 O GLU F 36 19.693 36.354 -21.182 1.00 42.51 O
-ATOM 5850 CB GLU F 36 21.660 36.736 -18.923 1.00 37.11 C
-ATOM 5851 CG GLU F 36 21.624 35.370 -18.217 1.00 29.33 C
-ATOM 5852 CD GLU F 36 22.993 34.729 -18.095 1.00 29.12 C
-ATOM 5853 OE1 GLU F 36 23.980 35.425 -18.217 1.00 37.20 O
-ATOM 5854 OE2 GLU F 36 23.057 33.530 -17.900 1.00 35.63 O
-ATOM 5855 H GLU F 36 21.573 38.743 -20.683 1.00 0.00 H
-ATOM 5856 HA GLU F 36 22.876 36.080 -20.565 1.00 0.00 H
-ATOM 5857 1HB GLU F 36 22.415 37.352 -18.437 1.00 0.00 H
-ATOM 5858 2HB GLU F 36 20.694 37.215 -18.769 1.00 0.00 H
-ATOM 5859 1HG GLU F 36 21.222 35.496 -17.216 1.00 0.00 H
-ATOM 5860 2HG GLU F 36 20.958 34.702 -18.763 1.00 0.00 H
-ATOM 5861 N LYS F 37 21.163 34.716 -21.659 1.00 46.11 N
-ATOM 5862 CA LYS F 37 20.185 33.902 -22.369 1.00 49.04 C
-ATOM 5863 C LYS F 37 19.432 32.975 -21.417 1.00 48.90 C
-ATOM 5864 O LYS F 37 20.045 32.164 -20.713 1.00 46.53 O
-ATOM 5865 CB LYS F 37 20.885 33.081 -23.454 1.00 53.95 C
-ATOM 5866 CG LYS F 37 19.959 32.227 -24.327 1.00 48.69 C
-ATOM 5867 CD LYS F 37 20.756 31.459 -25.402 1.00 45.00 C
-ATOM 5868 CE LYS F 37 19.860 30.527 -26.214 1.00 45.00 C
-ATOM 5869 NZ LYS F 37 20.635 29.698 -27.185 1.00 45.00 N
-ATOM 5870 H LYS F 37 22.116 34.395 -21.575 1.00 0.00 H
-ATOM 5871 HA LYS F 37 19.463 34.563 -22.844 1.00 0.00 H
-ATOM 5872 1HB LYS F 37 21.427 33.760 -24.117 1.00 0.00 H
-ATOM 5873 2HB LYS F 37 21.618 32.418 -22.992 1.00 0.00 H
-ATOM 5874 1HG LYS F 37 19.409 31.511 -23.700 1.00 0.00 H
-ATOM 5875 2HG LYS F 37 19.231 32.878 -24.817 1.00 0.00 H
-ATOM 5876 1HD LYS F 37 21.214 32.181 -26.080 1.00 0.00 H
-ATOM 5877 2HD LYS F 37 21.547 30.873 -24.934 1.00 0.00 H
-ATOM 5878 1HE LYS F 37 19.332 29.866 -25.534 1.00 0.00 H
-ATOM 5879 2HE LYS F 37 19.134 31.122 -26.766 1.00 0.00 H
-ATOM 5880 1HZ LYS F 37 19.996 29.097 -27.692 1.00 0.00 H
-ATOM 5881 2HZ LYS F 37 21.127 30.295 -27.836 1.00 0.00 H
-ATOM 5882 3HZ LYS F 37 21.299 29.127 -26.678 1.00 0.00 H
-ATOM 5883 N LEU F 38 18.108 33.116 -21.389 1.00 49.50 N
-ATOM 5884 CA LEU F 38 17.246 32.306 -20.539 1.00 49.73 C
-ATOM 5885 C LEU F 38 16.343 31.449 -21.429 1.00 50.68 C
-ATOM 5886 O LEU F 38 15.569 31.982 -22.228 1.00 48.59 O
-ATOM 5887 CB LEU F 38 16.372 33.209 -19.649 1.00 41.32 C
-ATOM 5888 CG LEU F 38 17.092 34.262 -18.831 1.00 48.31 C
-ATOM 5889 CD1 LEU F 38 16.052 35.086 -18.052 1.00 34.51 C
-ATOM 5890 CD2 LEU F 38 18.074 33.609 -17.923 1.00 51.29 C
-ATOM 5891 H LEU F 38 17.683 33.817 -21.984 1.00 0.00 H
-ATOM 5892 HA LEU F 38 17.855 31.649 -19.920 1.00 0.00 H
-ATOM 5893 1HB LEU F 38 15.685 33.733 -20.272 1.00 0.00 H
-ATOM 5894 2HB LEU F 38 15.805 32.579 -18.956 1.00 0.00 H
-ATOM 5895 HG LEU F 38 17.626 34.937 -19.509 1.00 0.00 H
-ATOM 5896 1HD1 LEU F 38 16.558 35.854 -17.483 1.00 0.00 H
-ATOM 5897 2HD1 LEU F 38 15.356 35.555 -18.749 1.00 0.00 H
-ATOM 5898 3HD1 LEU F 38 15.497 34.436 -17.369 1.00 0.00 H
-ATOM 5899 1HD2 LEU F 38 18.607 34.364 -17.366 1.00 0.00 H
-ATOM 5900 2HD2 LEU F 38 17.545 32.943 -17.241 1.00 0.00 H
-ATOM 5901 3HD2 LEU F 38 18.786 33.039 -18.515 1.00 0.00 H
-ATOM 5902 N ASP F 39 16.446 30.133 -21.319 1.00 52.46 N
-ATOM 5903 CA ASP F 39 15.593 29.292 -22.152 1.00 53.07 C
-ATOM 5904 C ASP F 39 14.308 29.023 -21.399 1.00 53.16 C
-ATOM 5905 O ASP F 39 14.228 29.367 -20.221 1.00 53.06 O
-ATOM 5906 CB ASP F 39 16.306 28.039 -22.635 1.00 61.00 C
-ATOM 5907 CG ASP F 39 17.356 28.385 -23.716 1.00 66.70 C
-ATOM 5908 OD1 ASP F 39 17.127 29.321 -24.490 1.00 58.50 O
-ATOM 5909 OD2 ASP F 39 18.361 27.719 -23.776 1.00 63.86 O
-ATOM 5910 H ASP F 39 17.097 29.722 -20.648 1.00 0.00 H
-ATOM 5911 HA ASP F 39 15.334 29.854 -23.040 1.00 0.00 H
-ATOM 5912 1HB ASP F 39 16.798 27.542 -21.792 1.00 0.00 H
-ATOM 5913 2HB ASP F 39 15.576 27.343 -23.060 1.00 0.00 H
-ATOM 5914 N LYS F 40 13.291 28.478 -22.063 1.00 51.08 N
-ATOM 5915 CA LYS F 40 11.988 28.371 -21.426 1.00 48.08 C
-ATOM 5916 C LYS F 40 12.080 27.716 -20.056 1.00 46.10 C
-ATOM 5917 O LYS F 40 12.603 26.607 -19.908 1.00 41.07 O
-ATOM 5918 CB LYS F 40 11.031 27.581 -22.324 1.00 48.20 C
-ATOM 5919 CG LYS F 40 9.594 27.528 -21.844 1.00 41.66 C
-ATOM 5920 CD LYS F 40 8.701 26.802 -22.860 1.00 50.67 C
-ATOM 5921 CE LYS F 40 7.256 26.726 -22.387 1.00 51.73 C
-ATOM 5922 NZ LYS F 40 6.605 28.066 -22.395 1.00 61.40 N
-ATOM 5923 H LYS F 40 13.394 28.156 -23.030 1.00 0.00 H
-ATOM 5924 HA LYS F 40 11.588 29.377 -21.295 1.00 0.00 H
-ATOM 5925 1HB LYS F 40 11.043 27.998 -23.327 1.00 0.00 H
-ATOM 5926 2HB LYS F 40 11.389 26.555 -22.407 1.00 0.00 H
-ATOM 5927 1HG LYS F 40 9.554 27.009 -20.887 1.00 0.00 H
-ATOM 5928 2HG LYS F 40 9.228 28.537 -21.702 1.00 0.00 H
-ATOM 5929 1HD LYS F 40 8.730 27.343 -23.807 1.00 0.00 H
-ATOM 5930 2HD LYS F 40 9.076 25.793 -23.025 1.00 0.00 H
-ATOM 5931 1HE LYS F 40 6.696 26.057 -23.038 1.00 0.00 H
-ATOM 5932 2HE LYS F 40 7.237 26.333 -21.372 1.00 0.00 H
-ATOM 5933 1HZ LYS F 40 5.656 27.993 -22.072 1.00 0.00 H
-ATOM 5934 2HZ LYS F 40 7.119 28.699 -21.793 1.00 0.00 H
-ATOM 5935 3HZ LYS F 40 6.611 28.458 -23.330 1.00 0.00 H
-ATOM 5936 N GLY F 41 11.537 28.408 -19.056 1.00 44.45 N
-ATOM 5937 CA GLY F 41 11.520 27.932 -17.684 1.00 45.77 C
-ATOM 5938 C GLY F 41 12.679 28.431 -16.815 1.00 45.28 C
-ATOM 5939 O GLY F 41 12.618 28.327 -15.587 1.00 44.22 O
-ATOM 5940 H GLY F 41 11.120 29.318 -19.246 1.00 0.00 H
-ATOM 5941 1HA GLY F 41 10.578 28.223 -17.225 1.00 0.00 H
-ATOM 5942 2HA GLY F 41 11.537 26.847 -17.702 1.00 0.00 H
-ATOM 5943 N GLU F 42 13.734 28.983 -17.408 1.00 43.93 N
-ATOM 5944 CA GLU F 42 14.833 29.444 -16.557 1.00 42.40 C
-ATOM 5945 C GLU F 42 14.464 30.745 -15.852 1.00 42.47 C
-ATOM 5946 O GLU F 42 13.844 31.636 -16.442 1.00 41.54 O
-ATOM 5947 CB GLU F 42 16.150 29.607 -17.343 1.00 41.23 C
-ATOM 5948 CG GLU F 42 16.790 28.269 -17.796 1.00 47.47 C
-ATOM 5949 CD GLU F 42 18.165 28.407 -18.431 1.00 46.98 C
-ATOM 5950 OE1 GLU F 42 18.295 29.090 -19.415 1.00 38.26 O
-ATOM 5951 OE2 GLU F 42 19.095 27.810 -17.925 1.00 51.01 O
-ATOM 5952 H GLU F 42 13.783 29.063 -18.422 1.00 0.00 H
-ATOM 5953 HA GLU F 42 15.008 28.689 -15.786 1.00 0.00 H
-ATOM 5954 1HB GLU F 42 15.964 30.203 -18.238 1.00 0.00 H
-ATOM 5955 2HB GLU F 42 16.879 30.145 -16.733 1.00 0.00 H
-ATOM 5956 1HG GLU F 42 16.884 27.624 -16.921 1.00 0.00 H
-ATOM 5957 2HG GLU F 42 16.117 27.782 -18.503 1.00 0.00 H
-ATOM 5958 N VAL F 43 14.858 30.852 -14.577 1.00 39.47 N
-ATOM 5959 CA VAL F 43 14.572 32.066 -13.807 1.00 39.31 C
-ATOM 5960 C VAL F 43 15.839 32.798 -13.420 1.00 41.06 C
-ATOM 5961 O VAL F 43 16.752 32.217 -12.838 1.00 39.97 O
-ATOM 5962 CB VAL F 43 13.768 31.751 -12.515 1.00 38.51 C
-ATOM 5963 CG1 VAL F 43 13.555 33.039 -11.710 1.00 33.82 C
-ATOM 5964 CG2 VAL F 43 12.414 31.167 -12.878 1.00 30.32 C
-ATOM 5965 H VAL F 43 15.365 30.079 -14.144 1.00 0.00 H
-ATOM 5966 HA VAL F 43 13.972 32.729 -14.421 1.00 0.00 H
-ATOM 5967 HB VAL F 43 14.329 31.047 -11.902 1.00 0.00 H
-ATOM 5968 1HG1 VAL F 43 12.991 32.823 -10.803 1.00 0.00 H
-ATOM 5969 2HG1 VAL F 43 14.517 33.472 -11.439 1.00 0.00 H
-ATOM 5970 3HG1 VAL F 43 12.998 33.748 -12.325 1.00 0.00 H
-ATOM 5971 1HG2 VAL F 43 11.844 30.948 -11.974 1.00 0.00 H
-ATOM 5972 2HG2 VAL F 43 11.883 31.883 -13.467 1.00 0.00 H
-ATOM 5973 3HG2 VAL F 43 12.553 30.256 -13.453 1.00 0.00 H
-ATOM 5974 N LEU F 44 15.890 34.079 -13.760 1.00 38.07 N
-ATOM 5975 CA LEU F 44 17.034 34.914 -13.440 1.00 39.91 C
-ATOM 5976 C LEU F 44 16.673 35.998 -12.446 1.00 38.48 C
-ATOM 5977 O LEU F 44 15.754 36.779 -12.674 1.00 40.44 O
-ATOM 5978 CB LEU F 44 17.564 35.575 -14.703 1.00 37.17 C
-ATOM 5979 CG LEU F 44 18.738 36.538 -14.516 1.00 41.27 C
-ATOM 5980 CD1 LEU F 44 19.962 35.759 -14.028 1.00 29.55 C
-ATOM 5981 CD2 LEU F 44 19.008 37.245 -15.834 1.00 28.52 C
-ATOM 5982 H LEU F 44 15.107 34.484 -14.262 1.00 0.00 H
-ATOM 5983 HA LEU F 44 17.813 34.293 -13.005 1.00 0.00 H
-ATOM 5984 1HB LEU F 44 17.882 34.794 -15.360 1.00 0.00 H
-ATOM 5985 2HB LEU F 44 16.749 36.123 -15.172 1.00 0.00 H
-ATOM 5986 HG LEU F 44 18.486 37.278 -13.754 1.00 0.00 H
-ATOM 5987 1HD1 LEU F 44 20.790 36.443 -13.885 1.00 0.00 H
-ATOM 5988 2HD1 LEU F 44 19.729 35.270 -13.081 1.00 0.00 H
-ATOM 5989 3HD1 LEU F 44 20.234 35.008 -14.767 1.00 0.00 H
-ATOM 5990 1HD2 LEU F 44 19.837 37.942 -15.718 1.00 0.00 H
-ATOM 5991 2HD2 LEU F 44 19.256 36.516 -16.597 1.00 0.00 H
-ATOM 5992 3HD2 LEU F 44 18.117 37.787 -16.132 1.00 0.00 H
-ATOM 5993 N ILE F 45 17.387 36.034 -11.336 1.00 36.57 N
-ATOM 5994 CA ILE F 45 17.140 37.048 -10.332 1.00 34.97 C
-ATOM 5995 C ILE F 45 18.373 37.944 -10.330 1.00 35.10 C
-ATOM 5996 O ILE F 45 19.481 37.464 -10.099 1.00 37.12 O
-ATOM 5997 CB ILE F 45 16.920 36.401 -8.962 1.00 42.90 C
-ATOM 5998 CG1 ILE F 45 15.764 35.372 -9.077 1.00 33.26 C
-ATOM 5999 CG2 ILE F 45 16.553 37.498 -7.996 1.00 34.01 C
-ATOM 6000 CD1 ILE F 45 15.537 34.520 -7.872 1.00 40.62 C
-ATOM 6001 H ILE F 45 18.113 35.347 -11.181 1.00 0.00 H
-ATOM 6002 HA ILE F 45 16.271 37.637 -10.601 1.00 0.00 H
-ATOM 6003 HB ILE F 45 17.817 35.884 -8.632 1.00 0.00 H
-ATOM 6004 1HG1 ILE F 45 14.860 35.888 -9.301 1.00 0.00 H
-ATOM 6005 2HG1 ILE F 45 15.991 34.703 -9.905 1.00 0.00 H
-ATOM 6006 1HG2 ILE F 45 16.369 37.090 -7.009 1.00 0.00 H
-ATOM 6007 2HG2 ILE F 45 17.360 38.223 -7.950 1.00 0.00 H
-ATOM 6008 3HG2 ILE F 45 15.668 37.990 -8.351 1.00 0.00 H
-ATOM 6009 1HD1 ILE F 45 14.723 33.837 -8.082 1.00 0.00 H
-ATOM 6010 2HD1 ILE F 45 16.441 33.951 -7.639 1.00 0.00 H
-ATOM 6011 3HD1 ILE F 45 15.274 35.150 -7.032 1.00 0.00 H
-ATOM 6012 N ALA F 46 18.216 39.231 -10.631 1.00 33.06 N
-ATOM 6013 CA ALA F 46 19.430 40.032 -10.813 1.00 33.25 C
-ATOM 6014 C ALA F 46 19.346 41.441 -10.264 1.00 37.47 C
-ATOM 6015 O ALA F 46 18.342 42.138 -10.419 1.00 38.14 O
-ATOM 6016 CB ALA F 46 19.739 40.107 -12.303 1.00 22.68 C
-ATOM 6017 H ALA F 46 17.285 39.617 -10.771 1.00 0.00 H
-ATOM 6018 HA ALA F 46 20.245 39.535 -10.296 1.00 0.00 H
-ATOM 6019 1HB ALA F 46 20.664 40.666 -12.453 1.00 0.00 H
-ATOM 6020 2HB ALA F 46 19.853 39.101 -12.703 1.00 0.00 H
-ATOM 6021 3HB ALA F 46 18.922 40.613 -12.818 1.00 0.00 H
-ATOM 6022 N GLN F 47 20.451 41.858 -9.637 1.00 37.58 N
-ATOM 6023 CA GLN F 47 20.591 43.182 -9.045 1.00 39.40 C
-ATOM 6024 C GLN F 47 21.099 44.241 -9.992 1.00 40.67 C
-ATOM 6025 O GLN F 47 21.814 43.955 -10.954 1.00 42.55 O
-ATOM 6026 CB GLN F 47 21.540 43.151 -7.844 1.00 34.99 C
-ATOM 6027 CG GLN F 47 21.047 42.379 -6.651 1.00 32.98 C
-ATOM 6028 CD GLN F 47 22.020 42.414 -5.522 1.00 36.63 C
-ATOM 6029 OE1 GLN F 47 23.185 42.017 -5.681 1.00 32.46 O
-ATOM 6030 NE2 GLN F 47 21.572 42.896 -4.363 1.00 32.16 N
-ATOM 6031 H GLN F 47 21.239 41.217 -9.545 1.00 0.00 H
-ATOM 6032 HA GLN F 47 19.623 43.502 -8.694 1.00 0.00 H
-ATOM 6033 1HB GLN F 47 22.497 42.730 -8.150 1.00 0.00 H
-ATOM 6034 2HB GLN F 47 21.729 44.179 -7.514 1.00 0.00 H
-ATOM 6035 1HG GLN F 47 20.149 42.861 -6.289 1.00 0.00 H
-ATOM 6036 2HG GLN F 47 20.850 41.342 -6.929 1.00 0.00 H
-ATOM 6037 1HE2 GLN F 47 22.178 42.946 -3.574 1.00 0.00 H
-ATOM 6038 2HE2 GLN F 47 20.619 43.265 -4.290 1.00 0.00 H
-ATOM 6039 N PHE F 48 20.786 45.483 -9.653 1.00 37.11 N
-ATOM 6040 CA PHE F 48 21.385 46.622 -10.329 1.00 35.94 C
-ATOM 6041 C PHE F 48 22.743 46.810 -9.666 1.00 36.28 C
-ATOM 6042 O PHE F 48 22.882 46.574 -8.464 1.00 33.96 O
-ATOM 6043 CB PHE F 48 20.509 47.853 -10.197 1.00 37.00 C
-ATOM 6044 CG PHE F 48 19.246 47.739 -10.982 1.00 46.55 C
-ATOM 6045 CD1 PHE F 48 19.248 47.953 -12.349 1.00 45.42 C
-ATOM 6046 CD2 PHE F 48 18.049 47.398 -10.357 1.00 42.67 C
-ATOM 6047 CE1 PHE F 48 18.088 47.825 -13.070 1.00 48.04 C
-ATOM 6048 CE2 PHE F 48 16.890 47.269 -11.086 1.00 45.74 C
-ATOM 6049 CZ PHE F 48 16.919 47.478 -12.444 1.00 42.16 C
-ATOM 6050 H PHE F 48 20.136 45.623 -8.880 1.00 0.00 H
-ATOM 6051 HA PHE F 48 21.532 46.395 -11.387 1.00 0.00 H
-ATOM 6052 1HB PHE F 48 20.257 48.025 -9.153 1.00 0.00 H
-ATOM 6053 2HB PHE F 48 21.062 48.712 -10.559 1.00 0.00 H
-ATOM 6054 HD1 PHE F 48 20.183 48.220 -12.849 1.00 0.00 H
-ATOM 6055 HD2 PHE F 48 18.042 47.226 -9.281 1.00 0.00 H
-ATOM 6056 HE1 PHE F 48 18.097 47.985 -14.135 1.00 0.00 H
-ATOM 6057 HE2 PHE F 48 15.957 46.995 -10.593 1.00 0.00 H
-ATOM 6058 HZ PHE F 48 16.030 47.362 -13.020 1.00 0.00 H
-ATOM 6059 N THR F 49 23.762 47.148 -10.448 1.00 39.52 N
-ATOM 6060 CA THR F 49 25.119 47.189 -9.908 1.00 37.75 C
-ATOM 6061 C THR F 49 25.901 48.435 -10.261 1.00 39.59 C
-ATOM 6062 O THR F 49 25.417 49.346 -10.929 1.00 44.02 O
-ATOM 6063 CB THR F 49 25.963 45.990 -10.387 1.00 37.49 C
-ATOM 6064 OG1 THR F 49 26.252 46.132 -11.791 1.00 35.66 O
-ATOM 6065 CG2 THR F 49 25.216 44.661 -10.160 1.00 28.68 C
-ATOM 6066 H THR F 49 23.586 47.394 -11.420 1.00 0.00 H
-ATOM 6067 HA THR F 49 25.053 47.146 -8.821 1.00 0.00 H
-ATOM 6068 HB THR F 49 26.897 45.961 -9.832 1.00 0.00 H
-ATOM 6069 HG1 THR F 49 25.502 45.774 -12.284 1.00 0.00 H
-ATOM 6070 1HG2 THR F 49 25.837 43.838 -10.504 1.00 0.00 H
-ATOM 6071 2HG2 THR F 49 24.994 44.530 -9.101 1.00 0.00 H
-ATOM 6072 3HG2 THR F 49 24.285 44.662 -10.720 1.00 0.00 H
-ATOM 6073 N GLU F 50 27.156 48.430 -9.843 1.00 38.96 N
-ATOM 6074 CA GLU F 50 28.126 49.455 -10.176 1.00 40.51 C
-ATOM 6075 C GLU F 50 28.284 49.605 -11.693 1.00 41.70 C
-ATOM 6076 O GLU F 50 28.671 50.672 -12.170 1.00 42.95 O
-ATOM 6077 CB GLU F 50 29.476 49.116 -9.538 1.00 38.92 C
-ATOM 6078 CG GLU F 50 30.562 50.148 -9.761 1.00 43.54 C
-ATOM 6079 CD GLU F 50 31.840 49.836 -9.010 1.00 52.50 C
-ATOM 6080 OE1 GLU F 50 31.876 48.849 -8.313 1.00 59.45 O
-ATOM 6081 OE2 GLU F 50 32.779 50.587 -9.138 1.00 57.33 O
-ATOM 6082 H GLU F 50 27.468 47.658 -9.275 1.00 0.00 H
-ATOM 6083 HA GLU F 50 27.775 50.407 -9.775 1.00 0.00 H
-ATOM 6084 1HB GLU F 50 29.348 48.994 -8.463 1.00 0.00 H
-ATOM 6085 2HB GLU F 50 29.835 48.167 -9.936 1.00 0.00 H
-ATOM 6086 1HG GLU F 50 30.783 50.192 -10.831 1.00 0.00 H
-ATOM 6087 2HG GLU F 50 30.191 51.123 -9.453 1.00 0.00 H
-ATOM 6088 N HIS F 51 28.049 48.520 -12.448 1.00 39.35 N
-ATOM 6089 CA HIS F 51 28.230 48.566 -13.890 1.00 41.65 C
-ATOM 6090 C HIS F 51 26.904 48.539 -14.664 1.00 43.23 C
-ATOM 6091 O HIS F 51 26.869 49.007 -15.801 1.00 42.73 O
-ATOM 6092 CB HIS F 51 29.131 47.403 -14.342 1.00 37.97 C
-ATOM 6093 CG HIS F 51 30.535 47.491 -13.792 1.00 43.93 C
-ATOM 6094 ND1 HIS F 51 30.873 47.043 -12.533 1.00 44.86 N
-ATOM 6095 CD2 HIS F 51 31.674 47.975 -14.337 1.00 44.06 C
-ATOM 6096 CE1 HIS F 51 32.163 47.258 -12.323 1.00 35.24 C
-ATOM 6097 NE2 HIS F 51 32.672 47.819 -13.403 1.00 45.59 N
-ATOM 6098 H HIS F 51 27.693 47.666 -12.029 1.00 0.00 H
-ATOM 6099 HA HIS F 51 28.737 49.492 -14.154 1.00 0.00 H
-ATOM 6100 1HB HIS F 51 28.692 46.454 -14.026 1.00 0.00 H
-ATOM 6101 2HB HIS F 51 29.192 47.388 -15.431 1.00 0.00 H
-ATOM 6102 HD2 HIS F 51 31.781 48.410 -15.330 1.00 0.00 H
-ATOM 6103 HE1 HIS F 51 32.711 47.012 -11.411 1.00 0.00 H
-ATOM 6104 HE2 HIS F 51 33.637 48.096 -13.528 1.00 0.00 H
-ATOM 6105 N THR F 52 25.815 48.042 -14.052 1.00 42.28 N
-ATOM 6106 CA THR F 52 24.506 47.982 -14.738 1.00 41.21 C
-ATOM 6107 C THR F 52 23.476 48.925 -14.106 1.00 41.29 C
-ATOM 6108 O THR F 52 23.119 48.768 -12.935 1.00 39.68 O
-ATOM 6109 CB THR F 52 23.891 46.558 -14.704 1.00 37.38 C
-ATOM 6110 OG1 THR F 52 24.761 45.614 -15.349 1.00 42.45 O
-ATOM 6111 CG2 THR F 52 22.525 46.554 -15.410 1.00 28.93 C
-ATOM 6112 H THR F 52 25.911 47.663 -13.117 1.00 0.00 H
-ATOM 6113 HA THR F 52 24.643 48.282 -15.778 1.00 0.00 H
-ATOM 6114 HB THR F 52 23.746 46.250 -13.668 1.00 0.00 H
-ATOM 6115 HG1 THR F 52 25.534 45.458 -14.798 1.00 0.00 H
-ATOM 6116 1HG2 THR F 52 22.092 45.555 -15.375 1.00 0.00 H
-ATOM 6117 2HG2 THR F 52 21.851 47.252 -14.912 1.00 0.00 H
-ATOM 6118 3HG2 THR F 52 22.653 46.856 -16.448 1.00 0.00 H
-ATOM 6119 N SER F 53 22.958 49.872 -14.901 1.00 38.82 N
-ATOM 6120 CA SER F 53 21.967 50.836 -14.396 1.00 37.09 C
-ATOM 6121 C SER F 53 20.579 50.551 -14.942 1.00 37.53 C
-ATOM 6122 O SER F 53 19.574 51.057 -14.430 1.00 36.46 O
-ATOM 6123 CB SER F 53 22.355 52.252 -14.741 1.00 39.56 C
-ATOM 6124 OG SER F 53 22.370 52.450 -16.118 1.00 49.50 O
-ATOM 6125 H SER F 53 23.272 49.918 -15.871 1.00 0.00 H
-ATOM 6126 HA SER F 53 21.921 50.748 -13.309 1.00 0.00 H
-ATOM 6127 1HB SER F 53 21.649 52.938 -14.280 1.00 0.00 H
-ATOM 6128 2HB SER F 53 23.324 52.461 -14.329 1.00 0.00 H
-ATOM 6129 HG SER F 53 21.453 52.426 -16.403 1.00 0.00 H
-ATOM 6130 N ALA F 54 20.519 49.734 -15.985 1.00 34.98 N
-ATOM 6131 CA ALA F 54 19.223 49.393 -16.545 1.00 37.24 C
-ATOM 6132 C ALA F 54 19.240 47.981 -17.091 1.00 36.65 C
-ATOM 6133 O ALA F 54 20.265 47.484 -17.569 1.00 35.23 O
-ATOM 6134 CB ALA F 54 18.803 50.387 -17.616 1.00 41.85 C
-ATOM 6135 H ALA F 54 21.381 49.375 -16.397 1.00 0.00 H
-ATOM 6136 HA ALA F 54 18.488 49.428 -15.746 1.00 0.00 H
-ATOM 6137 1HB ALA F 54 17.815 50.106 -17.985 1.00 0.00 H
-ATOM 6138 2HB ALA F 54 18.762 51.382 -17.186 1.00 0.00 H
-ATOM 6139 3HB ALA F 54 19.492 50.389 -18.423 1.00 0.00 H
-ATOM 6140 N ILE F 55 18.076 47.354 -17.033 1.00 37.60 N
-ATOM 6141 CA ILE F 55 17.875 46.016 -17.549 1.00 39.01 C
-ATOM 6142 C ILE F 55 16.804 46.000 -18.627 1.00 40.52 C
-ATOM 6143 O ILE F 55 15.684 46.470 -18.428 1.00 40.76 O
-ATOM 6144 CB ILE F 55 17.516 45.037 -16.410 1.00 34.26 C
-ATOM 6145 CG1 ILE F 55 18.691 44.964 -15.383 1.00 36.78 C
-ATOM 6146 CG2 ILE F 55 17.202 43.672 -16.988 1.00 22.30 C
-ATOM 6147 CD1 ILE F 55 18.363 44.206 -14.099 1.00 38.69 C
-ATOM 6148 H ILE F 55 17.286 47.846 -16.628 1.00 0.00 H
-ATOM 6149 HA ILE F 55 18.806 45.680 -17.994 1.00 0.00 H
-ATOM 6150 HB ILE F 55 16.642 45.411 -15.874 1.00 0.00 H
-ATOM 6151 1HG1 ILE F 55 19.541 44.479 -15.866 1.00 0.00 H
-ATOM 6152 2HG1 ILE F 55 18.983 45.969 -15.109 1.00 0.00 H
-ATOM 6153 1HG2 ILE F 55 16.943 42.982 -16.187 1.00 0.00 H
-ATOM 6154 2HG2 ILE F 55 16.367 43.750 -17.683 1.00 0.00 H
-ATOM 6155 3HG2 ILE F 55 18.083 43.309 -17.519 1.00 0.00 H
-ATOM 6156 1HD1 ILE F 55 19.239 44.206 -13.442 1.00 0.00 H
-ATOM 6157 2HD1 ILE F 55 17.532 44.692 -13.586 1.00 0.00 H
-ATOM 6158 3HD1 ILE F 55 18.091 43.180 -14.338 1.00 0.00 H
-ATOM 6159 N LYS F 56 17.152 45.474 -19.785 1.00 42.15 N
-ATOM 6160 CA LYS F 56 16.208 45.409 -20.887 1.00 41.15 C
-ATOM 6161 C LYS F 56 15.853 43.958 -21.164 1.00 40.69 C
-ATOM 6162 O LYS F 56 16.736 43.110 -21.255 1.00 40.17 O
-ATOM 6163 CB LYS F 56 16.796 46.106 -22.110 1.00 45.74 C
-ATOM 6164 CG LYS F 56 15.913 46.157 -23.320 1.00 54.20 C
-ATOM 6165 CD LYS F 56 16.605 46.932 -24.433 1.00 60.27 C
-ATOM 6166 CE LYS F 56 15.701 47.108 -25.635 1.00 60.97 C
-ATOM 6167 NZ LYS F 56 16.358 47.897 -26.722 1.00 54.86 N
-ATOM 6168 H LYS F 56 18.099 45.114 -19.898 1.00 0.00 H
-ATOM 6169 HA LYS F 56 15.293 45.925 -20.604 1.00 0.00 H
-ATOM 6170 1HB LYS F 56 17.039 47.133 -21.848 1.00 0.00 H
-ATOM 6171 2HB LYS F 56 17.714 45.630 -22.394 1.00 0.00 H
-ATOM 6172 1HG LYS F 56 15.701 45.139 -23.662 1.00 0.00 H
-ATOM 6173 2HG LYS F 56 14.965 46.642 -23.068 1.00 0.00 H
-ATOM 6174 1HD LYS F 56 16.903 47.921 -24.069 1.00 0.00 H
-ATOM 6175 2HD LYS F 56 17.502 46.392 -24.738 1.00 0.00 H
-ATOM 6176 1HE LYS F 56 15.417 46.132 -26.025 1.00 0.00 H
-ATOM 6177 2HE LYS F 56 14.814 47.621 -25.315 1.00 0.00 H
-ATOM 6178 1HZ LYS F 56 15.716 48.014 -27.506 1.00 0.00 H
-ATOM 6179 2HZ LYS F 56 16.637 48.821 -26.381 1.00 0.00 H
-ATOM 6180 3HZ LYS F 56 17.179 47.419 -27.035 1.00 0.00 H
-ATOM 6181 N VAL F 57 14.567 43.653 -21.248 1.00 39.19 N
-ATOM 6182 CA VAL F 57 14.174 42.274 -21.479 1.00 40.91 C
-ATOM 6183 C VAL F 57 13.509 42.113 -22.837 1.00 45.03 C
-ATOM 6184 O VAL F 57 12.522 42.788 -23.166 1.00 49.06 O
-ATOM 6185 CB VAL F 57 13.229 41.774 -20.372 1.00 42.08 C
-ATOM 6186 CG1 VAL F 57 12.854 40.302 -20.655 1.00 39.52 C
-ATOM 6187 CG2 VAL F 57 13.903 41.937 -19.005 1.00 31.84 C
-ATOM 6188 H VAL F 57 13.867 44.378 -21.149 1.00 0.00 H
-ATOM 6189 HA VAL F 57 15.065 41.647 -21.463 1.00 0.00 H
-ATOM 6190 HB VAL F 57 12.310 42.358 -20.393 1.00 0.00 H
-ATOM 6191 1HG1 VAL F 57 12.177 39.933 -19.892 1.00 0.00 H
-ATOM 6192 2HG1 VAL F 57 12.366 40.225 -21.630 1.00 0.00 H
-ATOM 6193 3HG1 VAL F 57 13.759 39.693 -20.657 1.00 0.00 H
-ATOM 6194 1HG2 VAL F 57 13.228 41.594 -18.228 1.00 0.00 H
-ATOM 6195 2HG2 VAL F 57 14.815 41.354 -18.983 1.00 0.00 H
-ATOM 6196 3HG2 VAL F 57 14.139 42.990 -18.836 1.00 0.00 H
-ATOM 6197 N ARG F 58 14.081 41.209 -23.627 1.00 44.12 N
-ATOM 6198 CA ARG F 58 13.630 40.901 -24.977 1.00 43.27 C
-ATOM 6199 C ARG F 58 13.158 39.450 -25.087 1.00 43.21 C
-ATOM 6200 O ARG F 58 13.875 38.513 -24.725 1.00 42.23 O
-ATOM 6201 CB ARG F 58 14.766 41.145 -25.955 1.00 45.50 C
-ATOM 6202 CG ARG F 58 14.485 40.754 -27.393 1.00 45.00 C
-ATOM 6203 CD ARG F 58 15.674 40.980 -28.254 1.00 45.00 C
-ATOM 6204 NE ARG F 58 15.912 42.366 -28.445 1.00 45.00 N
-ATOM 6205 CZ ARG F 58 17.029 42.904 -28.923 1.00 45.00 C
-ATOM 6206 NH1 ARG F 58 18.075 42.149 -29.265 1.00 45.00 N
-ATOM 6207 NH2 ARG F 58 17.036 44.215 -29.039 1.00 45.00 N
-ATOM 6208 H ARG F 58 14.899 40.715 -23.276 1.00 0.00 H
-ATOM 6209 HA ARG F 58 12.796 41.558 -25.225 1.00 0.00 H
-ATOM 6210 1HB ARG F 58 15.010 42.215 -25.953 1.00 0.00 H
-ATOM 6211 2HB ARG F 58 15.654 40.612 -25.625 1.00 0.00 H
-ATOM 6212 1HG ARG F 58 14.216 39.703 -27.445 1.00 0.00 H
-ATOM 6213 2HG ARG F 58 13.660 41.369 -27.773 1.00 0.00 H
-ATOM 6214 1HD ARG F 58 16.551 40.549 -27.776 1.00 0.00 H
-ATOM 6215 2HD ARG F 58 15.524 40.521 -29.229 1.00 0.00 H
-ATOM 6216 HE ARG F 58 15.158 43.020 -28.200 1.00 0.00 H
-ATOM 6217 1HH1 ARG F 58 18.030 41.140 -29.164 1.00 0.00 H
-ATOM 6218 2HH1 ARG F 58 18.917 42.574 -29.629 1.00 0.00 H
-ATOM 6219 1HH2 ARG F 58 16.174 44.715 -28.769 1.00 0.00 H
-ATOM 6220 2HH2 ARG F 58 17.839 44.701 -29.395 1.00 0.00 H
-ATOM 6221 N GLY F 59 11.957 39.257 -25.614 1.00 43.49 N
-ATOM 6222 CA GLY F 59 11.376 37.921 -25.714 1.00 41.33 C
-ATOM 6223 C GLY F 59 10.287 37.801 -24.667 1.00 42.08 C
-ATOM 6224 O GLY F 59 10.181 38.662 -23.796 1.00 36.65 O
-ATOM 6225 H GLY F 59 11.404 40.052 -25.916 1.00 0.00 H
-ATOM 6226 1HA GLY F 59 10.958 37.763 -26.709 1.00 0.00 H
-ATOM 6227 2HA GLY F 59 12.138 37.161 -25.551 1.00 0.00 H
-ATOM 6228 N LYS F 60 9.465 36.764 -24.762 1.00 44.93 N
-ATOM 6229 CA LYS F 60 8.342 36.616 -23.845 1.00 47.81 C
-ATOM 6230 C LYS F 60 8.809 36.078 -22.503 1.00 46.31 C
-ATOM 6231 O LYS F 60 9.458 35.028 -22.435 1.00 42.85 O
-ATOM 6232 CB LYS F 60 7.271 35.736 -24.502 1.00 55.52 C
-ATOM 6233 CG LYS F 60 5.928 35.625 -23.794 1.00 65.79 C
-ATOM 6234 CD LYS F 60 4.934 34.907 -24.726 1.00 71.29 C
-ATOM 6235 CE LYS F 60 3.505 34.925 -24.200 1.00 68.65 C
-ATOM 6236 NZ LYS F 60 3.305 33.995 -23.077 1.00 64.87 N
-ATOM 6237 H LYS F 60 9.604 36.080 -25.503 1.00 0.00 H
-ATOM 6238 HA LYS F 60 7.922 37.592 -23.668 1.00 0.00 H
-ATOM 6239 1HB LYS F 60 7.082 36.101 -25.514 1.00 0.00 H
-ATOM 6240 2HB LYS F 60 7.648 34.726 -24.596 1.00 0.00 H
-ATOM 6241 1HG LYS F 60 6.040 35.062 -22.876 1.00 0.00 H
-ATOM 6242 2HG LYS F 60 5.548 36.619 -23.549 1.00 0.00 H
-ATOM 6243 1HD LYS F 60 4.955 35.387 -25.707 1.00 0.00 H
-ATOM 6244 2HD LYS F 60 5.249 33.865 -24.849 1.00 0.00 H
-ATOM 6245 1HE LYS F 60 3.272 35.937 -23.860 1.00 0.00 H
-ATOM 6246 2HE LYS F 60 2.827 34.658 -25.010 1.00 0.00 H
-ATOM 6247 1HZ LYS F 60 2.345 34.050 -22.760 1.00 0.00 H
-ATOM 6248 2HZ LYS F 60 3.509 33.049 -23.382 1.00 0.00 H
-ATOM 6249 3HZ LYS F 60 3.924 34.246 -22.322 1.00 0.00 H
-ATOM 6250 N ALA F 61 8.494 36.819 -21.442 1.00 46.54 N
-ATOM 6251 CA ALA F 61 8.957 36.458 -20.105 1.00 48.19 C
-ATOM 6252 C ALA F 61 8.093 37.072 -19.006 1.00 47.38 C
-ATOM 6253 O ALA F 61 7.511 38.143 -19.163 1.00 46.24 O
-ATOM 6254 CB ALA F 61 10.400 36.898 -19.919 1.00 40.31 C
-ATOM 6255 H ALA F 61 7.922 37.650 -21.588 1.00 0.00 H
-ATOM 6256 HA ALA F 61 8.904 35.379 -20.016 1.00 0.00 H
-ATOM 6257 1HB ALA F 61 10.751 36.597 -18.939 1.00 0.00 H
-ATOM 6258 2HB ALA F 61 11.004 36.431 -20.682 1.00 0.00 H
-ATOM 6259 3HB ALA F 61 10.472 37.977 -20.008 1.00 0.00 H
-ATOM 6260 N TYR F 62 8.047 36.395 -17.869 1.00 47.92 N
-ATOM 6261 CA TYR F 62 7.339 36.896 -16.695 1.00 46.84 C
-ATOM 6262 C TYR F 62 8.308 37.653 -15.806 1.00 45.28 C
-ATOM 6263 O TYR F 62 9.327 37.106 -15.388 1.00 43.46 O
-ATOM 6264 CB TYR F 62 6.648 35.743 -15.966 1.00 49.47 C
-ATOM 6265 CG TYR F 62 5.990 36.101 -14.650 1.00 51.98 C
-ATOM 6266 CD1 TYR F 62 5.196 37.240 -14.507 1.00 54.77 C
-ATOM 6267 CD2 TYR F 62 6.172 35.253 -13.578 1.00 55.38 C
-ATOM 6268 CE1 TYR F 62 4.606 37.511 -13.283 1.00 54.94 C
-ATOM 6269 CE2 TYR F 62 5.585 35.524 -12.369 1.00 58.89 C
-ATOM 6270 CZ TYR F 62 4.809 36.645 -12.215 1.00 56.20 C
-ATOM 6271 OH TYR F 62 4.230 36.892 -10.995 1.00 56.87 O
-ATOM 6272 H TYR F 62 8.564 35.522 -17.814 1.00 0.00 H
-ATOM 6273 HA TYR F 62 6.578 37.600 -17.021 1.00 0.00 H
-ATOM 6274 1HB TYR F 62 5.877 35.327 -16.618 1.00 0.00 H
-ATOM 6275 2HB TYR F 62 7.358 34.959 -15.782 1.00 0.00 H
-ATOM 6276 HD1 TYR F 62 5.038 37.915 -15.348 1.00 0.00 H
-ATOM 6277 HD2 TYR F 62 6.783 34.362 -13.695 1.00 0.00 H
-ATOM 6278 HE1 TYR F 62 3.985 38.388 -13.164 1.00 0.00 H
-ATOM 6279 HE2 TYR F 62 5.734 34.846 -11.528 1.00 0.00 H
-ATOM 6280 HH TYR F 62 4.178 36.071 -10.493 1.00 0.00 H
-ATOM 6281 N ILE F 63 8.022 38.929 -15.561 1.00 43.73 N
-ATOM 6282 CA ILE F 63 8.937 39.768 -14.810 1.00 42.42 C
-ATOM 6283 C ILE F 63 8.345 40.268 -13.486 1.00 41.80 C
-ATOM 6284 O ILE F 63 7.212 40.755 -13.432 1.00 38.64 O
-ATOM 6285 CB ILE F 63 9.344 40.980 -15.661 1.00 30.73 C
-ATOM 6286 CG1 ILE F 63 10.002 40.521 -16.956 1.00 37.38 C
-ATOM 6287 CG2 ILE F 63 10.303 41.872 -14.884 1.00 24.99 C
-ATOM 6288 CD1 ILE F 63 10.139 41.630 -17.960 1.00 33.93 C
-ATOM 6289 H ILE F 63 7.174 39.355 -15.922 1.00 0.00 H
-ATOM 6290 HA ILE F 63 9.816 39.186 -14.600 1.00 0.00 H
-ATOM 6291 HB ILE F 63 8.470 41.537 -15.922 1.00 0.00 H
-ATOM 6292 1HG1 ILE F 63 10.986 40.121 -16.732 1.00 0.00 H
-ATOM 6293 2HG1 ILE F 63 9.401 39.733 -17.406 1.00 0.00 H
-ATOM 6294 1HG2 ILE F 63 10.566 42.715 -15.500 1.00 0.00 H
-ATOM 6295 2HG2 ILE F 63 9.825 42.222 -13.975 1.00 0.00 H
-ATOM 6296 3HG2 ILE F 63 11.202 41.309 -14.626 1.00 0.00 H
-ATOM 6297 1HD1 ILE F 63 10.602 41.248 -18.857 1.00 0.00 H
-ATOM 6298 2HD1 ILE F 63 9.149 42.020 -18.204 1.00 0.00 H
-ATOM 6299 3HD1 ILE F 63 10.752 42.428 -17.548 1.00 0.00 H
-ATOM 6300 N GLN F 64 9.109 40.132 -12.405 1.00 40.47 N
-ATOM 6301 CA GLN F 64 8.648 40.654 -11.123 1.00 40.71 C
-ATOM 6302 C GLN F 64 9.612 41.749 -10.687 1.00 40.44 C
-ATOM 6303 O GLN F 64 10.831 41.568 -10.751 1.00 41.30 O
-ATOM 6304 CB GLN F 64 8.613 39.557 -10.043 1.00 38.86 C
-ATOM 6305 CG GLN F 64 7.761 38.320 -10.382 1.00 37.64 C
-ATOM 6306 CD GLN F 64 7.763 37.255 -9.265 1.00 39.68 C
-ATOM 6307 OE1 GLN F 64 8.772 37.065 -8.577 1.00 39.30 O
-ATOM 6308 NE2 GLN F 64 6.623 36.576 -9.100 1.00 36.74 N
-ATOM 6309 H GLN F 64 10.021 39.695 -12.500 1.00 0.00 H
-ATOM 6310 HA GLN F 64 7.661 41.095 -11.236 1.00 0.00 H
-ATOM 6311 1HB GLN F 64 9.604 39.265 -9.769 1.00 0.00 H
-ATOM 6312 2HB GLN F 64 8.164 39.987 -9.149 1.00 0.00 H
-ATOM 6313 1HG GLN F 64 6.736 38.614 -10.567 1.00 0.00 H
-ATOM 6314 2HG GLN F 64 8.175 37.854 -11.281 1.00 0.00 H
-ATOM 6315 1HE2 GLN F 64 6.534 35.839 -8.399 1.00 0.00 H
-ATOM 6316 2HE2 GLN F 64 5.835 36.780 -9.687 1.00 0.00 H
-ATOM 6317 N THR F 65 9.079 42.884 -10.248 1.00 39.50 N
-ATOM 6318 CA THR F 65 9.932 43.963 -9.773 1.00 40.24 C
-ATOM 6319 C THR F 65 9.368 44.492 -8.475 1.00 42.33 C
-ATOM 6320 O THR F 65 8.269 44.122 -8.051 1.00 42.64 O
-ATOM 6321 CB THR F 65 10.044 45.163 -10.746 1.00 40.05 C
-ATOM 6322 OG1 THR F 65 8.835 45.930 -10.708 1.00 38.71 O
-ATOM 6323 CG2 THR F 65 10.273 44.687 -12.182 1.00 44.02 C
-ATOM 6324 H THR F 65 8.068 43.006 -10.228 1.00 0.00 H
-ATOM 6325 HA THR F 65 10.933 43.576 -9.575 1.00 0.00 H
-ATOM 6326 HB THR F 65 10.879 45.786 -10.442 1.00 0.00 H
-ATOM 6327 HG1 THR F 65 8.508 45.958 -9.803 1.00 0.00 H
-ATOM 6328 1HG2 THR F 65 10.355 45.547 -12.841 1.00 0.00 H
-ATOM 6329 2HG2 THR F 65 11.188 44.103 -12.234 1.00 0.00 H
-ATOM 6330 3HG2 THR F 65 9.434 44.073 -12.497 1.00 0.00 H
-ATOM 6331 N ARG F 66 10.068 45.428 -7.873 1.00 42.28 N
-ATOM 6332 CA ARG F 66 9.608 46.048 -6.644 1.00 44.02 C
-ATOM 6333 C ARG F 66 8.286 46.810 -6.815 1.00 46.87 C
-ATOM 6334 O ARG F 66 7.626 47.125 -5.824 1.00 44.44 O
-ATOM 6335 CB ARG F 66 10.683 46.934 -6.026 1.00 51.68 C
-ATOM 6336 CG ARG F 66 10.334 47.387 -4.616 1.00 60.76 C
-ATOM 6337 CD ARG F 66 11.522 47.849 -3.810 1.00 73.60 C
-ATOM 6338 NE ARG F 66 12.128 49.079 -4.268 1.00 83.93 N
-ATOM 6339 CZ ARG F 66 11.633 50.308 -4.001 1.00 90.09 C
-ATOM 6340 NH1 ARG F 66 12.259 51.391 -4.392 1.00 83.98 N
-ATOM 6341 NH2 ARG F 66 10.503 50.420 -3.321 1.00 92.57 N
-ATOM 6342 H ARG F 66 10.962 45.694 -8.262 1.00 0.00 H
-ATOM 6343 HA ARG F 66 9.417 45.249 -5.926 1.00 0.00 H
-ATOM 6344 1HB ARG F 66 11.639 46.410 -5.998 1.00 0.00 H
-ATOM 6345 2HB ARG F 66 10.816 47.829 -6.635 1.00 0.00 H
-ATOM 6346 1HG ARG F 66 9.621 48.211 -4.675 1.00 0.00 H
-ATOM 6347 2HG ARG F 66 9.873 46.551 -4.087 1.00 0.00 H
-ATOM 6348 1HD ARG F 66 11.219 47.990 -2.772 1.00 0.00 H
-ATOM 6349 2HD ARG F 66 12.292 47.074 -3.850 1.00 0.00 H
-ATOM 6350 HE ARG F 66 13.031 49.000 -4.756 1.00 0.00 H
-ATOM 6351 1HH1 ARG F 66 13.130 51.330 -4.902 1.00 0.00 H
-ATOM 6352 2HH1 ARG F 66 11.876 52.305 -4.162 1.00 0.00 H
-ATOM 6353 1HH2 ARG F 66 10.015 49.590 -3.015 1.00 0.00 H
-ATOM 6354 2HH2 ARG F 66 10.135 51.331 -3.104 1.00 0.00 H
-ATOM 6355 N HIS F 67 7.910 47.153 -8.057 1.00 47.18 N
-ATOM 6356 CA HIS F 67 6.692 47.933 -8.259 1.00 45.39 C
-ATOM 6357 C HIS F 67 5.500 47.061 -8.677 1.00 46.54 C
-ATOM 6358 O HIS F 67 4.457 47.586 -9.071 1.00 47.55 O
-ATOM 6359 CB HIS F 67 6.899 48.985 -9.351 1.00 40.52 C
-ATOM 6360 CG HIS F 67 8.000 49.947 -9.070 1.00 45.54 C
-ATOM 6361 ND1 HIS F 67 8.222 50.497 -7.823 1.00 48.04 N
-ATOM 6362 CD2 HIS F 67 8.927 50.485 -9.890 1.00 48.44 C
-ATOM 6363 CE1 HIS F 67 9.257 51.318 -7.894 1.00 35.50 C
-ATOM 6364 NE2 HIS F 67 9.690 51.330 -9.137 1.00 53.17 N
-ATOM 6365 H HIS F 67 8.439 46.852 -8.873 1.00 0.00 H
-ATOM 6366 HA HIS F 67 6.428 48.443 -7.335 1.00 0.00 H
-ATOM 6367 1HB HIS F 67 7.115 48.482 -10.298 1.00 0.00 H
-ATOM 6368 2HB HIS F 67 5.976 49.554 -9.491 1.00 0.00 H
-ATOM 6369 HD2 HIS F 67 9.045 50.293 -10.955 1.00 0.00 H
-ATOM 6370 HE1 HIS F 67 9.675 51.901 -7.075 1.00 0.00 H
-ATOM 6371 HE2 HIS F 67 10.461 51.880 -9.507 1.00 0.00 H
-ATOM 6372 N GLY F 68 5.647 45.734 -8.612 1.00 45.83 N
-ATOM 6373 CA GLY F 68 4.569 44.843 -9.043 1.00 48.29 C
-ATOM 6374 C GLY F 68 5.080 43.885 -10.110 1.00 50.24 C
-ATOM 6375 O GLY F 68 6.262 43.547 -10.130 1.00 48.89 O
-ATOM 6376 H GLY F 68 6.518 45.327 -8.274 1.00 0.00 H
-ATOM 6377 1HA GLY F 68 4.196 44.283 -8.188 1.00 0.00 H
-ATOM 6378 2HA GLY F 68 3.738 45.426 -9.437 1.00 0.00 H
-ATOM 6379 N VAL F 69 4.192 43.401 -10.971 1.00 50.76 N
-ATOM 6380 CA VAL F 69 4.643 42.450 -11.982 1.00 52.66 C
-ATOM 6381 C VAL F 69 4.259 42.919 -13.375 1.00 54.67 C
-ATOM 6382 O VAL F 69 3.364 43.753 -13.532 1.00 54.76 O
-ATOM 6383 CB VAL F 69 4.057 41.056 -11.735 1.00 59.25 C
-ATOM 6384 CG1 VAL F 69 4.477 40.543 -10.360 1.00 39.74 C
-ATOM 6385 CG2 VAL F 69 2.552 41.100 -11.867 1.00 56.20 C
-ATOM 6386 H VAL F 69 3.224 43.690 -10.932 1.00 0.00 H
-ATOM 6387 HA VAL F 69 5.729 42.379 -11.941 1.00 0.00 H
-ATOM 6388 HB VAL F 69 4.472 40.383 -12.473 1.00 0.00 H
-ATOM 6389 1HG1 VAL F 69 4.083 39.538 -10.209 1.00 0.00 H
-ATOM 6390 2HG1 VAL F 69 5.555 40.523 -10.294 1.00 0.00 H
-ATOM 6391 3HG1 VAL F 69 4.085 41.198 -9.585 1.00 0.00 H
-ATOM 6392 1HG2 VAL F 69 2.146 40.100 -11.713 1.00 0.00 H
-ATOM 6393 2HG2 VAL F 69 2.136 41.778 -11.121 1.00 0.00 H
-ATOM 6394 3HG2 VAL F 69 2.287 41.450 -12.866 1.00 0.00 H
-ATOM 6395 N ILE F 70 4.955 42.390 -14.376 1.00 56.98 N
-ATOM 6396 CA ILE F 70 4.687 42.723 -15.767 1.00 55.30 C
-ATOM 6397 C ILE F 70 5.177 41.587 -16.668 1.00 56.78 C
-ATOM 6398 O ILE F 70 6.107 40.876 -16.299 1.00 55.68 O
-ATOM 6399 CB ILE F 70 5.378 44.059 -16.123 1.00 53.90 C
-ATOM 6400 CG1 ILE F 70 4.863 44.619 -17.432 1.00 64.42 C
-ATOM 6401 CG2 ILE F 70 6.889 43.848 -16.216 1.00 42.40 C
-ATOM 6402 CD1 ILE F 70 5.232 46.072 -17.619 1.00 63.04 C
-ATOM 6403 H ILE F 70 5.698 41.728 -14.157 1.00 0.00 H
-ATOM 6404 HA ILE F 70 3.610 42.831 -15.902 1.00 0.00 H
-ATOM 6405 HB ILE F 70 5.165 44.790 -15.349 1.00 0.00 H
-ATOM 6406 1HG1 ILE F 70 5.278 44.052 -18.263 1.00 0.00 H
-ATOM 6407 2HG1 ILE F 70 3.776 44.533 -17.454 1.00 0.00 H
-ATOM 6408 1HG2 ILE F 70 7.380 44.785 -16.455 1.00 0.00 H
-ATOM 6409 2HG2 ILE F 70 7.263 43.473 -15.264 1.00 0.00 H
-ATOM 6410 3HG2 ILE F 70 7.095 43.124 -17.006 1.00 0.00 H
-ATOM 6411 1HD1 ILE F 70 4.822 46.417 -18.553 1.00 0.00 H
-ATOM 6412 2HD1 ILE F 70 4.811 46.663 -16.804 1.00 0.00 H
-ATOM 6413 3HD1 ILE F 70 6.313 46.183 -17.622 1.00 0.00 H
-ATOM 6414 N GLU F 71 4.560 41.396 -17.824 1.00 57.47 N
-ATOM 6415 CA GLU F 71 5.099 40.396 -18.746 1.00 56.39 C
-ATOM 6416 C GLU F 71 5.640 41.063 -20.004 1.00 57.69 C
-ATOM 6417 O GLU F 71 5.032 42.006 -20.526 1.00 57.45 O
-ATOM 6418 CB GLU F 71 4.034 39.355 -19.138 1.00 50.41 C
-ATOM 6419 CG GLU F 71 3.533 38.471 -17.992 1.00 63.38 C
-ATOM 6420 CD GLU F 71 2.532 37.420 -18.429 1.00 69.41 C
-ATOM 6421 OE1 GLU F 71 2.170 37.405 -19.584 1.00 72.35 O
-ATOM 6422 OE2 GLU F 71 2.136 36.631 -17.605 1.00 77.08 O
-ATOM 6423 H GLU F 71 3.766 41.962 -18.080 1.00 0.00 H
-ATOM 6424 HA GLU F 71 5.925 39.876 -18.264 1.00 0.00 H
-ATOM 6425 1HB GLU F 71 3.176 39.861 -19.578 1.00 0.00 H
-ATOM 6426 2HB GLU F 71 4.453 38.697 -19.902 1.00 0.00 H
-ATOM 6427 1HG GLU F 71 4.381 37.964 -17.554 1.00 0.00 H
-ATOM 6428 2HG GLU F 71 3.082 39.099 -17.226 1.00 0.00 H
-ATOM 6429 N SER F 72 6.772 40.555 -20.493 1.00 56.47 N
-ATOM 6430 CA SER F 72 7.377 41.021 -21.742 1.00 54.99 C
-ATOM 6431 C SER F 72 6.898 40.115 -22.853 1.00 55.01 C
-ATOM 6432 O SER F 72 6.403 39.020 -22.565 1.00 51.39 O
-ATOM 6433 CB SER F 72 8.891 41.019 -21.644 1.00 34.06 C
-ATOM 6434 OG SER F 72 9.387 39.723 -21.517 1.00 31.33 O
-ATOM 6435 H SER F 72 7.205 39.781 -19.996 1.00 0.00 H
-ATOM 6436 HA SER F 72 7.037 42.036 -21.954 1.00 0.00 H
-ATOM 6437 1HB SER F 72 9.319 41.495 -22.530 1.00 0.00 H
-ATOM 6438 2HB SER F 72 9.190 41.604 -20.787 1.00 0.00 H
-ATOM 6439 HG SER F 72 9.489 39.378 -22.426 1.00 0.00 H
-ATOM 6440 N GLU F 73 7.070 40.539 -24.105 1.00 58.38 N
-ATOM 6441 CA GLU F 73 6.620 39.745 -25.247 1.00 60.64 C
-ATOM 6442 C GLU F 73 7.694 39.622 -26.334 1.00 61.16 C
-ATOM 6443 O GLU F 73 8.677 40.368 -26.348 1.00 57.90 O
-ATOM 6444 CB GLU F 73 5.333 40.345 -25.825 1.00 58.58 C
-ATOM 6445 CG GLU F 73 4.210 40.489 -24.801 1.00 66.14 C
-ATOM 6446 CD GLU F 73 2.948 41.083 -25.351 1.00 65.17 C
-ATOM 6447 OE1 GLU F 73 2.667 40.886 -26.509 1.00 70.03 O
-ATOM 6448 OE2 GLU F 73 2.278 41.780 -24.610 1.00 58.56 O
-ATOM 6449 H GLU F 73 7.499 41.449 -24.260 1.00 0.00 H
-ATOM 6450 HA GLU F 73 6.384 38.743 -24.902 1.00 0.00 H
-ATOM 6451 1HB GLU F 73 5.529 41.307 -26.236 1.00 0.00 H
-ATOM 6452 2HB GLU F 73 4.969 39.715 -26.642 1.00 0.00 H
-ATOM 6453 1HG GLU F 73 3.989 39.506 -24.381 1.00 0.00 H
-ATOM 6454 2HG GLU F 73 4.558 41.126 -23.991 1.00 0.00 H
-ATOM 6455 N GLY F 74 7.511 38.646 -27.218 1.00 64.24 N
-ATOM 6456 CA GLY F 74 8.427 38.399 -28.325 1.00 66.54 C
-ATOM 6457 C GLY F 74 7.727 38.583 -29.667 1.00 70.23 C
-ATOM 6458 O GLY F 74 6.515 38.364 -29.773 1.00 73.50 O
-ATOM 6459 OXT GLY F 74 8.385 38.910 -30.658 1.00 0.00 O
-ATOM 6460 H GLY F 74 6.690 38.067 -27.131 1.00 0.00 H
-ATOM 6461 1HA GLY F 74 9.279 39.074 -28.261 1.00 0.00 H
-ATOM 6462 2HA GLY F 74 8.814 37.383 -28.251 1.00 0.00 H
-TER
-ATOM 6464 N SER G 7 18.234 52.299 -5.063 1.00 61.74 N
-ATOM 6465 CA SER G 7 17.947 53.519 -5.800 1.00 59.95 C
-ATOM 6466 C SER G 7 16.788 53.286 -6.758 1.00 58.71 C
-ATOM 6467 O SER G 7 16.761 52.308 -7.517 1.00 58.07 O
-ATOM 6468 CB SER G 7 19.174 54.007 -6.538 1.00 61.54 C
-ATOM 6469 OG SER G 7 18.858 55.110 -7.324 1.00 72.12 O
-ATOM 6470 1H SER G 7 19.071 52.417 -4.515 1.00 0.00 H
-ATOM 6471 2H SER G 7 17.452 52.098 -4.452 1.00 0.00 H
-ATOM 6472 3H SER G 7 18.353 51.534 -5.710 1.00 0.00 H
-ATOM 6473 HA SER G 7 17.646 54.290 -5.089 1.00 0.00 H
-ATOM 6474 1HB SER G 7 19.951 54.278 -5.820 1.00 0.00 H
-ATOM 6475 2HB SER G 7 19.569 53.218 -7.164 1.00 0.00 H
-ATOM 6476 HG SER G 7 18.144 54.817 -7.906 1.00 0.00 H
-ATOM 6477 N ASP G 8 15.833 54.204 -6.725 1.00 54.37 N
-ATOM 6478 CA ASP G 8 14.601 54.075 -7.488 1.00 53.26 C
-ATOM 6479 C ASP G 8 14.788 53.958 -8.990 1.00 52.36 C
-ATOM 6480 O ASP G 8 15.705 54.554 -9.585 1.00 51.01 O
-ATOM 6481 CB ASP G 8 13.642 55.217 -7.160 1.00 46.34 C
-ATOM 6482 CG ASP G 8 13.066 55.084 -5.747 1.00 60.09 C
-ATOM 6483 OD1 ASP G 8 13.280 54.076 -5.117 1.00 49.06 O
-ATOM 6484 OD2 ASP G 8 12.398 55.986 -5.317 1.00 53.19 O
-ATOM 6485 H ASP G 8 15.941 55.004 -6.115 1.00 0.00 H
-ATOM 6486 HA ASP G 8 14.114 53.153 -7.161 1.00 0.00 H
-ATOM 6487 1HB ASP G 8 14.158 56.174 -7.245 1.00 0.00 H
-ATOM 6488 2HB ASP G 8 12.821 55.218 -7.877 1.00 0.00 H
-ATOM 6489 N PHE G 9 13.867 53.198 -9.571 1.00 49.81 N
-ATOM 6490 CA PHE G 9 13.787 52.873 -10.983 1.00 49.91 C
-ATOM 6491 C PHE G 9 12.355 52.868 -11.462 1.00 48.07 C
-ATOM 6492 O PHE G 9 11.420 52.871 -10.655 1.00 46.42 O
-ATOM 6493 CB PHE G 9 14.376 51.475 -11.252 1.00 41.56 C
-ATOM 6494 CG PHE G 9 13.642 50.345 -10.583 1.00 43.04 C
-ATOM 6495 CD1 PHE G 9 12.613 49.687 -11.239 1.00 41.62 C
-ATOM 6496 CD2 PHE G 9 13.990 49.921 -9.307 1.00 48.72 C
-ATOM 6497 CE1 PHE G 9 11.942 48.639 -10.646 1.00 50.60 C
-ATOM 6498 CE2 PHE G 9 13.318 48.871 -8.707 1.00 48.80 C
-ATOM 6499 CZ PHE G 9 12.293 48.231 -9.381 1.00 47.21 C
-ATOM 6500 H PHE G 9 13.173 52.786 -8.963 1.00 0.00 H
-ATOM 6501 HA PHE G 9 14.324 53.632 -11.545 1.00 0.00 H
-ATOM 6502 1HB PHE G 9 14.352 51.275 -12.316 1.00 0.00 H
-ATOM 6503 2HB PHE G 9 15.396 51.440 -10.944 1.00 0.00 H
-ATOM 6504 HD1 PHE G 9 12.335 50.014 -12.238 1.00 0.00 H
-ATOM 6505 HD2 PHE G 9 14.804 50.425 -8.773 1.00 0.00 H
-ATOM 6506 HE1 PHE G 9 11.136 48.141 -11.182 1.00 0.00 H
-ATOM 6507 HE2 PHE G 9 13.597 48.547 -7.700 1.00 0.00 H
-ATOM 6508 HZ PHE G 9 11.769 47.414 -8.911 1.00 0.00 H
-ATOM 6509 N VAL G 10 12.190 52.861 -12.777 1.00 47.01 N
-ATOM 6510 CA VAL G 10 10.870 52.781 -13.383 1.00 47.50 C
-ATOM 6511 C VAL G 10 10.835 51.597 -14.345 1.00 46.98 C
-ATOM 6512 O VAL G 10 11.876 51.203 -14.883 1.00 46.57 O
-ATOM 6513 CB VAL G 10 10.572 54.088 -14.153 1.00 50.73 C
-ATOM 6514 CG1 VAL G 10 10.638 55.298 -13.193 1.00 48.99 C
-ATOM 6515 CG2 VAL G 10 11.572 54.243 -15.294 1.00 51.83 C
-ATOM 6516 H VAL G 10 13.020 52.906 -13.364 1.00 0.00 H
-ATOM 6517 HA VAL G 10 10.117 52.632 -12.604 1.00 0.00 H
-ATOM 6518 HB VAL G 10 9.557 54.043 -14.559 1.00 0.00 H
-ATOM 6519 1HG1 VAL G 10 10.424 56.206 -13.739 1.00 0.00 H
-ATOM 6520 2HG1 VAL G 10 9.913 55.172 -12.389 1.00 0.00 H
-ATOM 6521 3HG1 VAL G 10 11.639 55.371 -12.768 1.00 0.00 H
-ATOM 6522 1HG2 VAL G 10 11.358 55.159 -15.845 1.00 0.00 H
-ATOM 6523 2HG2 VAL G 10 12.585 54.289 -14.889 1.00 0.00 H
-ATOM 6524 3HG2 VAL G 10 11.491 53.387 -15.968 1.00 0.00 H
-ATOM 6525 N VAL G 11 9.647 51.046 -14.590 1.00 49.48 N
-ATOM 6526 CA VAL G 11 9.498 49.955 -15.557 1.00 48.67 C
-ATOM 6527 C VAL G 11 8.682 50.437 -16.742 1.00 51.49 C
-ATOM 6528 O VAL G 11 7.569 50.921 -16.560 1.00 50.61 O
-ATOM 6529 CB VAL G 11 8.750 48.762 -14.940 1.00 47.41 C
-ATOM 6530 CG1 VAL G 11 8.617 47.650 -15.968 1.00 31.06 C
-ATOM 6531 CG2 VAL G 11 9.440 48.298 -13.668 1.00 50.37 C
-ATOM 6532 H VAL G 11 8.827 51.387 -14.090 1.00 0.00 H
-ATOM 6533 HA VAL G 11 10.478 49.638 -15.903 1.00 0.00 H
-ATOM 6534 HB VAL G 11 7.765 49.069 -14.710 1.00 0.00 H
-ATOM 6535 1HG1 VAL G 11 8.055 46.829 -15.531 1.00 0.00 H
-ATOM 6536 2HG1 VAL G 11 8.084 48.027 -16.844 1.00 0.00 H
-ATOM 6537 3HG1 VAL G 11 9.594 47.301 -16.267 1.00 0.00 H
-ATOM 6538 1HG2 VAL G 11 8.870 47.472 -13.237 1.00 0.00 H
-ATOM 6539 2HG2 VAL G 11 10.433 47.969 -13.883 1.00 0.00 H
-ATOM 6540 3HG2 VAL G 11 9.477 49.117 -12.958 1.00 0.00 H
-ATOM 6541 N ILE G 12 9.230 50.327 -17.950 1.00 51.84 N
-ATOM 6542 CA ILE G 12 8.532 50.798 -19.142 1.00 48.13 C
-ATOM 6543 C ILE G 12 8.319 49.674 -20.164 1.00 45.09 C
-ATOM 6544 O ILE G 12 9.282 49.058 -20.624 1.00 41.90 O
-ATOM 6545 CB ILE G 12 9.362 51.915 -19.803 1.00 46.36 C
-ATOM 6546 CG1 ILE G 12 9.587 53.066 -18.801 1.00 48.98 C
-ATOM 6547 CG2 ILE G 12 8.613 52.439 -21.041 1.00 56.08 C
-ATOM 6548 CD1 ILE G 12 10.634 54.027 -19.235 1.00 46.08 C
-ATOM 6549 H ILE G 12 10.158 49.935 -18.038 1.00 0.00 H
-ATOM 6550 HA ILE G 12 7.559 51.192 -18.857 1.00 0.00 H
-ATOM 6551 HB ILE G 12 10.337 51.526 -20.096 1.00 0.00 H
-ATOM 6552 1HG1 ILE G 12 8.665 53.606 -18.677 1.00 0.00 H
-ATOM 6553 2HG1 ILE G 12 9.886 52.663 -17.837 1.00 0.00 H
-ATOM 6554 1HG2 ILE G 12 9.189 53.227 -21.513 1.00 0.00 H
-ATOM 6555 2HG2 ILE G 12 8.469 51.623 -21.750 1.00 0.00 H
-ATOM 6556 3HG2 ILE G 12 7.644 52.831 -20.742 1.00 0.00 H
-ATOM 6557 1HD1 ILE G 12 10.735 54.820 -18.494 1.00 0.00 H
-ATOM 6558 2HD1 ILE G 12 11.584 53.504 -19.342 1.00 0.00 H
-ATOM 6559 3HD1 ILE G 12 10.354 54.447 -20.181 1.00 0.00 H
-ATOM 6560 N LYS G 13 7.062 49.422 -20.542 1.00 43.78 N
-ATOM 6561 CA LYS G 13 6.766 48.391 -21.542 1.00 47.68 C
-ATOM 6562 C LYS G 13 6.162 48.933 -22.810 1.00 51.29 C
-ATOM 6563 O LYS G 13 5.093 49.546 -22.804 1.00 52.50 O
-ATOM 6564 CB LYS G 13 5.811 47.340 -21.022 1.00 34.03 C
-ATOM 6565 CG LYS G 13 5.450 46.310 -22.093 1.00 34.55 C
-ATOM 6566 CD LYS G 13 4.520 45.250 -21.583 1.00 42.29 C
-ATOM 6567 CE LYS G 13 4.054 44.354 -22.726 1.00 41.48 C
-ATOM 6568 NZ LYS G 13 3.176 43.266 -22.250 1.00 45.77 N
-ATOM 6569 H LYS G 13 6.300 49.939 -20.115 1.00 0.00 H
-ATOM 6570 HA LYS G 13 7.697 47.901 -21.815 1.00 0.00 H
-ATOM 6571 1HB LYS G 13 6.268 46.826 -20.196 1.00 0.00 H
-ATOM 6572 2HB LYS G 13 4.904 47.807 -20.670 1.00 0.00 H
-ATOM 6573 1HG LYS G 13 4.962 46.813 -22.929 1.00 0.00 H
-ATOM 6574 2HG LYS G 13 6.363 45.841 -22.468 1.00 0.00 H
-ATOM 6575 1HD LYS G 13 5.040 44.638 -20.843 1.00 0.00 H
-ATOM 6576 2HD LYS G 13 3.656 45.713 -21.113 1.00 0.00 H
-ATOM 6577 1HE LYS G 13 3.509 44.959 -23.451 1.00 0.00 H
-ATOM 6578 2HE LYS G 13 4.921 43.912 -23.213 1.00 0.00 H
-ATOM 6579 1HZ LYS G 13 2.882 42.677 -23.049 1.00 0.00 H
-ATOM 6580 2HZ LYS G 13 3.725 42.705 -21.584 1.00 0.00 H
-ATOM 6581 3HZ LYS G 13 2.364 43.644 -21.796 1.00 0.00 H
-ATOM 6582 N ALA G 14 6.837 48.706 -23.920 1.00 52.49 N
-ATOM 6583 CA ALA G 14 6.303 49.231 -25.162 1.00 54.97 C
-ATOM 6584 C ALA G 14 4.993 48.553 -25.518 1.00 55.39 C
-ATOM 6585 O ALA G 14 4.909 47.322 -25.567 1.00 55.52 O
-ATOM 6586 CB ALA G 14 7.296 49.026 -26.272 1.00 43.15 C
-ATOM 6587 H ALA G 14 7.706 48.168 -23.897 1.00 0.00 H
-ATOM 6588 HA ALA G 14 6.109 50.287 -25.024 1.00 0.00 H
-ATOM 6589 1HB ALA G 14 6.913 49.432 -27.203 1.00 0.00 H
-ATOM 6590 2HB ALA G 14 8.190 49.522 -26.010 1.00 0.00 H
-ATOM 6591 3HB ALA G 14 7.480 47.972 -26.381 1.00 0.00 H
-ATOM 6592 N LEU G 15 3.987 49.351 -25.860 1.00 59.73 N
-ATOM 6593 CA LEU G 15 2.717 48.782 -26.291 1.00 63.06 C
-ATOM 6594 C LEU G 15 2.600 48.867 -27.813 1.00 65.63 C
-ATOM 6595 O LEU G 15 1.664 48.335 -28.418 1.00 67.89 O
-ATOM 6596 CB LEU G 15 1.573 49.489 -25.563 1.00 65.37 C
-ATOM 6597 CG LEU G 15 1.596 49.327 -23.989 1.00 59.88 C
-ATOM 6598 CD1 LEU G 15 0.484 50.166 -23.354 1.00 53.58 C
-ATOM 6599 CD2 LEU G 15 1.444 47.870 -23.627 1.00 56.74 C
-ATOM 6600 H LEU G 15 4.080 50.366 -25.810 1.00 0.00 H
-ATOM 6601 HA LEU G 15 2.693 47.732 -26.010 1.00 0.00 H
-ATOM 6602 1HB LEU G 15 1.643 50.538 -25.795 1.00 0.00 H
-ATOM 6603 2HB LEU G 15 0.627 49.108 -25.935 1.00 0.00 H
-ATOM 6604 HG LEU G 15 2.535 49.659 -23.609 1.00 0.00 H
-ATOM 6605 1HD1 LEU G 15 0.506 50.057 -22.276 1.00 0.00 H
-ATOM 6606 2HD1 LEU G 15 0.628 51.208 -23.596 1.00 0.00 H
-ATOM 6607 3HD1 LEU G 15 -0.482 49.833 -23.727 1.00 0.00 H
-ATOM 6608 1HD2 LEU G 15 1.480 47.759 -22.541 1.00 0.00 H
-ATOM 6609 2HD2 LEU G 15 0.490 47.497 -23.998 1.00 0.00 H
-ATOM 6610 3HD2 LEU G 15 2.259 47.301 -24.075 1.00 0.00 H
-ATOM 6611 N GLU G 16 3.594 49.512 -28.422 1.00 65.50 N
-ATOM 6612 CA GLU G 16 3.690 49.683 -29.869 1.00 64.73 C
-ATOM 6613 C GLU G 16 5.158 49.759 -30.284 1.00 63.18 C
-ATOM 6614 O GLU G 16 6.031 50.026 -29.464 1.00 61.52 O
-ATOM 6615 CB GLU G 16 2.928 50.929 -30.346 1.00 58.04 C
-ATOM 6616 CG GLU G 16 3.444 52.277 -29.845 1.00 63.44 C
-ATOM 6617 CD GLU G 16 2.596 53.432 -30.375 1.00 62.85 C
-ATOM 6618 OE1 GLU G 16 1.740 53.179 -31.189 1.00 57.09 O
-ATOM 6619 OE2 GLU G 16 2.775 54.548 -29.934 1.00 60.30 O
-ATOM 6620 H GLU G 16 4.314 49.909 -27.839 1.00 0.00 H
-ATOM 6621 HA GLU G 16 3.249 48.811 -30.352 1.00 0.00 H
-ATOM 6622 1HB GLU G 16 2.940 50.963 -31.434 1.00 0.00 H
-ATOM 6623 2HB GLU G 16 1.885 50.851 -30.036 1.00 0.00 H
-ATOM 6624 1HG GLU G 16 3.439 52.288 -28.756 1.00 0.00 H
-ATOM 6625 2HG GLU G 16 4.476 52.407 -30.176 1.00 0.00 H
-ATOM 6626 N ASP G 17 5.445 49.487 -31.546 1.00 61.46 N
-ATOM 6627 CA ASP G 17 6.827 49.581 -32.008 1.00 60.15 C
-ATOM 6628 C ASP G 17 7.380 51.002 -31.956 1.00 57.93 C
-ATOM 6629 O ASP G 17 6.703 51.943 -32.372 1.00 56.35 O
-ATOM 6630 CB ASP G 17 6.946 49.058 -33.439 1.00 61.18 C
-ATOM 6631 CG ASP G 17 6.772 47.550 -33.553 1.00 64.12 C
-ATOM 6632 OD1 ASP G 17 6.811 46.879 -32.538 1.00 73.27 O
-ATOM 6633 OD2 ASP G 17 6.598 47.078 -34.649 1.00 63.28 O
-ATOM 6634 H ASP G 17 4.706 49.252 -32.195 1.00 0.00 H
-ATOM 6635 HA ASP G 17 7.436 48.968 -31.362 1.00 0.00 H
-ATOM 6636 1HB ASP G 17 6.209 49.552 -34.074 1.00 0.00 H
-ATOM 6637 2HB ASP G 17 7.935 49.318 -33.825 1.00 0.00 H
-ATOM 6638 N GLY G 18 8.646 51.143 -31.560 1.00 57.11 N
-ATOM 6639 CA GLY G 18 9.323 52.434 -31.630 1.00 53.69 C
-ATOM 6640 C GLY G 18 9.159 53.346 -30.411 1.00 55.50 C
-ATOM 6641 O GLY G 18 9.307 54.562 -30.534 1.00 55.59 O
-ATOM 6642 H GLY G 18 9.151 50.353 -31.164 1.00 0.00 H
-ATOM 6643 1HA GLY G 18 10.387 52.248 -31.783 1.00 0.00 H
-ATOM 6644 2HA GLY G 18 8.980 52.962 -32.516 1.00 0.00 H
-ATOM 6645 N VAL G 19 8.833 52.785 -29.251 1.00 52.95 N
-ATOM 6646 CA VAL G 19 8.699 53.631 -28.064 1.00 49.63 C
-ATOM 6647 C VAL G 19 10.054 54.207 -27.736 1.00 48.48 C
-ATOM 6648 O VAL G 19 11.054 53.491 -27.728 1.00 47.74 O
-ATOM 6649 CB VAL G 19 8.130 52.868 -26.860 1.00 57.29 C
-ATOM 6650 CG1 VAL G 19 8.190 53.735 -25.585 1.00 57.55 C
-ATOM 6651 CG2 VAL G 19 6.709 52.510 -27.165 1.00 56.28 C
-ATOM 6652 H VAL G 19 8.746 51.774 -29.192 1.00 0.00 H
-ATOM 6653 HA VAL G 19 8.018 54.452 -28.291 1.00 0.00 H
-ATOM 6654 HB VAL G 19 8.700 51.992 -26.696 1.00 0.00 H
-ATOM 6655 1HG1 VAL G 19 7.792 53.180 -24.745 1.00 0.00 H
-ATOM 6656 2HG1 VAL G 19 9.224 54.001 -25.370 1.00 0.00 H
-ATOM 6657 3HG1 VAL G 19 7.602 54.645 -25.731 1.00 0.00 H
-ATOM 6658 1HG2 VAL G 19 6.287 51.975 -26.349 1.00 0.00 H
-ATOM 6659 2HG2 VAL G 19 6.134 53.413 -27.330 1.00 0.00 H
-ATOM 6660 3HG2 VAL G 19 6.674 51.897 -28.056 1.00 0.00 H
-ATOM 6661 N ASN G 20 10.095 55.509 -27.513 1.00 50.04 N
-ATOM 6662 CA ASN G 20 11.343 56.201 -27.263 1.00 51.75 C
-ATOM 6663 C ASN G 20 11.479 56.627 -25.808 1.00 52.54 C
-ATOM 6664 O ASN G 20 10.705 57.456 -25.315 1.00 54.73 O
-ATOM 6665 CB ASN G 20 11.478 57.387 -28.201 1.00 56.13 C
-ATOM 6666 CG ASN G 20 12.828 58.032 -28.142 1.00 60.88 C
-ATOM 6667 OD1 ASN G 20 13.671 57.667 -27.325 1.00 60.83 O
-ATOM 6668 ND2 ASN G 20 13.046 58.995 -29.006 1.00 64.39 N
-ATOM 6669 H ASN G 20 9.228 56.036 -27.515 1.00 0.00 H
-ATOM 6670 HA ASN G 20 12.165 55.513 -27.464 1.00 0.00 H
-ATOM 6671 1HB ASN G 20 11.287 57.062 -29.223 1.00 0.00 H
-ATOM 6672 2HB ASN G 20 10.731 58.131 -27.954 1.00 0.00 H
-ATOM 6673 1HD2 ASN G 20 13.925 59.471 -29.024 1.00 0.00 H
-ATOM 6674 2HD2 ASN G 20 12.328 59.256 -29.649 1.00 0.00 H
-ATOM 6675 N VAL G 21 12.416 56.005 -25.097 1.00 52.87 N
-ATOM 6676 CA VAL G 21 12.654 56.347 -23.703 1.00 51.46 C
-ATOM 6677 C VAL G 21 13.918 57.207 -23.648 1.00 51.54 C
-ATOM 6678 O VAL G 21 14.962 56.816 -24.174 1.00 52.69 O
-ATOM 6679 CB VAL G 21 12.820 55.092 -22.841 1.00 42.46 C
-ATOM 6680 CG1 VAL G 21 13.075 55.520 -21.404 1.00 41.31 C
-ATOM 6681 CG2 VAL G 21 11.572 54.219 -22.973 1.00 36.32 C
-ATOM 6682 H VAL G 21 12.999 55.300 -25.547 1.00 0.00 H
-ATOM 6683 HA VAL G 21 11.813 56.924 -23.322 1.00 0.00 H
-ATOM 6684 HB VAL G 21 13.691 54.531 -23.178 1.00 0.00 H
-ATOM 6685 1HG1 VAL G 21 13.211 54.649 -20.777 1.00 0.00 H
-ATOM 6686 2HG1 VAL G 21 13.974 56.136 -21.361 1.00 0.00 H
-ATOM 6687 3HG1 VAL G 21 12.225 56.096 -21.048 1.00 0.00 H
-ATOM 6688 1HG2 VAL G 21 11.686 53.323 -22.366 1.00 0.00 H
-ATOM 6689 2HG2 VAL G 21 10.706 54.779 -22.640 1.00 0.00 H
-ATOM 6690 3HG2 VAL G 21 11.440 53.931 -24.019 1.00 0.00 H
-ATOM 6691 N ILE G 22 13.813 58.399 -23.065 1.00 50.90 N
-ATOM 6692 CA ILE G 22 14.912 59.362 -23.087 1.00 50.89 C
-ATOM 6693 C ILE G 22 15.444 59.715 -21.700 1.00 50.07 C
-ATOM 6694 O ILE G 22 14.683 60.068 -20.797 1.00 49.60 O
-ATOM 6695 CB ILE G 22 14.451 60.670 -23.763 1.00 47.44 C
-ATOM 6696 CG1 ILE G 22 13.888 60.382 -25.156 1.00 48.04 C
-ATOM 6697 CG2 ILE G 22 15.605 61.643 -23.860 1.00 59.38 C
-ATOM 6698 CD1 ILE G 22 12.368 60.218 -25.153 1.00 47.85 C
-ATOM 6699 H ILE G 22 12.932 58.656 -22.638 1.00 0.00 H
-ATOM 6700 HA ILE G 22 15.730 58.939 -23.663 1.00 0.00 H
-ATOM 6701 HB ILE G 22 13.668 61.108 -23.183 1.00 0.00 H
-ATOM 6702 1HG1 ILE G 22 14.147 61.201 -25.824 1.00 0.00 H
-ATOM 6703 2HG1 ILE G 22 14.338 59.467 -25.540 1.00 0.00 H
-ATOM 6704 1HG2 ILE G 22 15.265 62.563 -24.332 1.00 0.00 H
-ATOM 6705 2HG2 ILE G 22 15.987 61.871 -22.866 1.00 0.00 H
-ATOM 6706 3HG2 ILE G 22 16.397 61.191 -24.463 1.00 0.00 H
-ATOM 6707 1HD1 ILE G 22 12.016 60.014 -26.159 1.00 0.00 H
-ATOM 6708 2HD1 ILE G 22 12.095 59.395 -24.505 1.00 0.00 H
-ATOM 6709 3HD1 ILE G 22 11.903 61.130 -24.786 1.00 0.00 H
-ATOM 6710 N GLY G 23 16.761 59.604 -21.523 1.00 49.82 N
-ATOM 6711 CA GLY G 23 17.375 59.991 -20.256 1.00 52.35 C
-ATOM 6712 C GLY G 23 17.793 61.458 -20.319 1.00 55.10 C
-ATOM 6713 O GLY G 23 18.479 61.880 -21.259 1.00 54.70 O
-ATOM 6714 H GLY G 23 17.345 59.301 -22.298 1.00 0.00 H
-ATOM 6715 1HA GLY G 23 16.669 59.844 -19.438 1.00 0.00 H
-ATOM 6716 2HA GLY G 23 18.244 59.365 -20.056 1.00 0.00 H
-ATOM 6717 N LEU G 24 17.408 62.214 -19.290 1.00 56.58 N
-ATOM 6718 CA LEU G 24 17.701 63.643 -19.174 1.00 57.87 C
-ATOM 6719 C LEU G 24 18.790 63.889 -18.136 1.00 59.43 C
-ATOM 6720 O LEU G 24 18.730 63.367 -17.007 1.00 59.41 O
-ATOM 6721 CB LEU G 24 16.441 64.409 -18.776 1.00 55.64 C
-ATOM 6722 CG LEU G 24 15.366 64.642 -19.876 1.00 53.47 C
-ATOM 6723 CD1 LEU G 24 14.626 63.328 -20.175 1.00 62.87 C
-ATOM 6724 CD2 LEU G 24 14.379 65.709 -19.397 1.00 55.07 C
-ATOM 6725 H LEU G 24 16.840 61.788 -18.566 1.00 0.00 H
-ATOM 6726 HA LEU G 24 18.047 64.011 -20.133 1.00 0.00 H
-ATOM 6727 1HB LEU G 24 15.982 63.842 -18.008 1.00 0.00 H
-ATOM 6728 2HB LEU G 24 16.734 65.378 -18.371 1.00 0.00 H
-ATOM 6729 HG LEU G 24 15.852 64.976 -20.795 1.00 0.00 H
-ATOM 6730 1HD1 LEU G 24 13.882 63.497 -20.950 1.00 0.00 H
-ATOM 6731 2HD1 LEU G 24 15.322 62.584 -20.516 1.00 0.00 H
-ATOM 6732 3HD1 LEU G 24 14.132 62.969 -19.272 1.00 0.00 H
-ATOM 6733 1HD2 LEU G 24 13.625 65.882 -20.168 1.00 0.00 H
-ATOM 6734 2HD2 LEU G 24 13.890 65.372 -18.488 1.00 0.00 H
-ATOM 6735 3HD2 LEU G 24 14.913 66.638 -19.202 1.00 0.00 H
-ATOM 6736 N THR G 25 19.773 64.705 -18.525 1.00 60.64 N
-ATOM 6737 CA THR G 25 20.975 64.933 -17.729 1.00 60.46 C
-ATOM 6738 C THR G 25 20.758 65.545 -16.357 1.00 60.21 C
-ATOM 6739 O THR G 25 19.884 66.386 -16.157 1.00 61.34 O
-ATOM 6740 CB THR G 25 21.964 65.857 -18.480 1.00 65.65 C
-ATOM 6741 OG1 THR G 25 21.324 67.119 -18.798 1.00 61.38 O
-ATOM 6742 CG2 THR G 25 22.457 65.190 -19.753 1.00 60.35 C
-ATOM 6743 H THR G 25 19.710 65.124 -19.447 1.00 0.00 H
-ATOM 6744 HA THR G 25 21.459 63.975 -17.600 1.00 0.00 H
-ATOM 6745 HB THR G 25 22.827 66.055 -17.840 1.00 0.00 H
-ATOM 6746 HG1 THR G 25 21.612 67.830 -18.171 1.00 0.00 H
-ATOM 6747 1HG2 THR G 25 23.157 65.852 -20.256 1.00 0.00 H
-ATOM 6748 2HG2 THR G 25 22.957 64.259 -19.499 1.00 0.00 H
-ATOM 6749 3HG2 THR G 25 21.626 64.977 -20.412 1.00 0.00 H
-ATOM 6750 N ARG G 26 21.616 65.117 -15.430 1.00 60.41 N
-ATOM 6751 CA ARG G 26 21.681 65.647 -14.076 1.00 60.27 C
-ATOM 6752 C ARG G 26 22.668 66.808 -14.024 1.00 59.98 C
-ATOM 6753 O ARG G 26 23.789 66.696 -14.519 1.00 60.00 O
-ATOM 6754 CB ARG G 26 22.123 64.572 -13.086 1.00 51.99 C
-ATOM 6755 CG ARG G 26 22.089 65.005 -11.615 1.00 51.73 C
-ATOM 6756 CD ARG G 26 22.546 63.929 -10.677 1.00 54.06 C
-ATOM 6757 NE ARG G 26 21.721 62.734 -10.753 1.00 54.75 N
-ATOM 6758 CZ ARG G 26 20.535 62.577 -10.151 1.00 52.91 C
-ATOM 6759 NH1 ARG G 26 20.024 63.546 -9.432 1.00 59.37 N
-ATOM 6760 NH2 ARG G 26 19.910 61.435 -10.304 1.00 46.27 N
-ATOM 6761 H ARG G 26 22.247 64.366 -15.694 1.00 0.00 H
-ATOM 6762 HA ARG G 26 20.696 66.016 -13.793 1.00 0.00 H
-ATOM 6763 1HB ARG G 26 21.499 63.686 -13.194 1.00 0.00 H
-ATOM 6764 2HB ARG G 26 23.148 64.272 -13.314 1.00 0.00 H
-ATOM 6765 1HG ARG G 26 22.749 65.861 -11.479 1.00 0.00 H
-ATOM 6766 2HG ARG G 26 21.073 65.286 -11.342 1.00 0.00 H
-ATOM 6767 1HD ARG G 26 23.567 63.651 -10.916 1.00 0.00 H
-ATOM 6768 2HD ARG G 26 22.508 64.301 -9.656 1.00 0.00 H
-ATOM 6769 HE ARG G 26 22.065 61.927 -11.286 1.00 0.00 H
-ATOM 6770 1HH1 ARG G 26 20.533 64.407 -9.330 1.00 0.00 H
-ATOM 6771 2HH1 ARG G 26 19.131 63.422 -8.975 1.00 0.00 H
-ATOM 6772 1HH2 ARG G 26 20.371 60.713 -10.863 1.00 0.00 H
-ATOM 6773 2HH2 ARG G 26 18.993 61.267 -9.889 1.00 0.00 H
-ATOM 6774 N GLY G 27 22.259 67.918 -13.422 1.00 59.23 N
-ATOM 6775 CA GLY G 27 23.133 69.078 -13.302 1.00 59.14 C
-ATOM 6776 C GLY G 27 22.437 70.348 -13.762 1.00 61.13 C
-ATOM 6777 O GLY G 27 21.246 70.335 -14.078 1.00 56.15 O
-ATOM 6778 H GLY G 27 21.323 67.963 -13.044 1.00 0.00 H
-ATOM 6779 1HA GLY G 27 23.448 69.188 -12.265 1.00 0.00 H
-ATOM 6780 2HA GLY G 27 24.036 68.923 -13.893 1.00 0.00 H
-ATOM 6781 N ALA G 28 23.166 71.456 -13.777 1.00 62.56 N
-ATOM 6782 CA ALA G 28 22.605 72.746 -14.177 1.00 62.52 C
-ATOM 6783 C ALA G 28 22.064 72.717 -15.608 1.00 61.42 C
-ATOM 6784 O ALA G 28 21.064 73.350 -15.920 1.00 60.27 O
-ATOM 6785 CB ALA G 28 23.645 73.835 -14.032 1.00 58.79 C
-ATOM 6786 H ALA G 28 24.141 71.407 -13.508 1.00 0.00 H
-ATOM 6787 HA ALA G 28 21.761 72.962 -13.508 1.00 0.00 H
-ATOM 6788 1HB ALA G 28 23.206 74.794 -14.302 1.00 0.00 H
-ATOM 6789 2HB ALA G 28 23.999 73.873 -13.006 1.00 0.00 H
-ATOM 6790 3HB ALA G 28 24.484 73.622 -14.698 1.00 0.00 H
-ATOM 6791 N ASP G 29 22.762 71.994 -16.486 1.00 60.96 N
-ATOM 6792 CA ASP G 29 22.350 71.909 -17.883 1.00 61.78 C
-ATOM 6793 C ASP G 29 21.471 70.682 -18.122 1.00 60.91 C
-ATOM 6794 O ASP G 29 21.918 69.550 -17.932 1.00 63.23 O
-ATOM 6795 CB ASP G 29 23.577 71.843 -18.800 1.00 62.84 C
-ATOM 6796 CG ASP G 29 24.381 73.150 -18.835 1.00 77.50 C
-ATOM 6797 OD1 ASP G 29 23.795 74.200 -18.747 1.00 70.31 O
-ATOM 6798 OD2 ASP G 29 25.581 73.073 -18.934 1.00 84.72 O
-ATOM 6799 H ASP G 29 23.575 71.491 -16.174 1.00 0.00 H
-ATOM 6800 HA ASP G 29 21.775 72.800 -18.133 1.00 0.00 H
-ATOM 6801 1HB ASP G 29 24.235 71.034 -18.479 1.00 0.00 H
-ATOM 6802 2HB ASP G 29 23.247 71.611 -19.815 1.00 0.00 H
-ATOM 6803 N THR G 30 20.228 70.919 -18.550 1.00 59.89 N
-ATOM 6804 CA THR G 30 19.308 69.815 -18.802 1.00 59.85 C
-ATOM 6805 C THR G 30 19.162 69.582 -20.303 1.00 60.46 C
-ATOM 6806 O THR G 30 18.740 70.461 -21.050 1.00 60.76 O
-ATOM 6807 CB THR G 30 17.917 70.058 -18.189 1.00 53.02 C
-ATOM 6808 OG1 THR G 30 18.028 70.201 -16.762 1.00 53.53 O
-ATOM 6809 CG2 THR G 30 17.002 68.866 -18.505 1.00 50.17 C
-ATOM 6810 H THR G 30 19.921 71.871 -18.685 1.00 0.00 H
-ATOM 6811 HA THR G 30 19.710 68.911 -18.351 1.00 0.00 H
-ATOM 6812 HB THR G 30 17.490 70.965 -18.603 1.00 0.00 H
-ATOM 6813 HG1 THR G 30 18.540 70.983 -16.550 1.00 0.00 H
-ATOM 6814 1HG2 THR G 30 16.018 69.033 -18.072 1.00 0.00 H
-ATOM 6815 2HG2 THR G 30 16.908 68.754 -19.586 1.00 0.00 H
-ATOM 6816 3HG2 THR G 30 17.434 67.956 -18.084 1.00 0.00 H
-ATOM 6817 N ARG G 31 19.514 68.375 -20.723 1.00 60.86 N
-ATOM 6818 CA ARG G 31 19.489 67.960 -22.118 1.00 59.55 C
-ATOM 6819 C ARG G 31 19.410 66.439 -22.162 1.00 58.36 C
-ATOM 6820 O ARG G 31 19.496 65.803 -21.117 1.00 57.72 O
-ATOM 6821 CB ARG G 31 20.735 68.489 -22.817 1.00 57.87 C
-ATOM 6822 CG ARG G 31 22.034 67.969 -22.230 1.00 45.00 C
-ATOM 6823 CD ARG G 31 23.218 68.641 -22.813 1.00 45.00 C
-ATOM 6824 NE ARG G 31 24.461 68.137 -22.241 1.00 45.00 N
-ATOM 6825 CZ ARG G 31 25.664 68.727 -22.381 1.00 45.00 C
-ATOM 6826 NH1 ARG G 31 25.769 69.847 -23.060 1.00 45.00 N
-ATOM 6827 NH2 ARG G 31 26.738 68.184 -21.830 1.00 45.00 N
-ATOM 6828 H ARG G 31 19.900 67.737 -20.037 1.00 0.00 H
-ATOM 6829 HA ARG G 31 18.608 68.378 -22.601 1.00 0.00 H
-ATOM 6830 1HB ARG G 31 20.712 68.209 -23.866 1.00 0.00 H
-ATOM 6831 2HB ARG G 31 20.745 69.582 -22.763 1.00 0.00 H
-ATOM 6832 1HG ARG G 31 22.047 68.156 -21.154 1.00 0.00 H
-ATOM 6833 2HG ARG G 31 22.109 66.898 -22.418 1.00 0.00 H
-ATOM 6834 1HD ARG G 31 23.241 68.467 -23.890 1.00 0.00 H
-ATOM 6835 2HD ARG G 31 23.160 69.711 -22.615 1.00 0.00 H
-ATOM 6836 HE ARG G 31 24.415 67.276 -21.709 1.00 0.00 H
-ATOM 6837 1HH1 ARG G 31 24.946 70.265 -23.475 1.00 0.00 H
-ATOM 6838 2HH1 ARG G 31 26.668 70.294 -23.160 1.00 0.00 H
-ATOM 6839 1HH2 ARG G 31 26.659 67.325 -21.306 1.00 0.00 H
-ATOM 6840 2HH2 ARG G 31 27.637 68.632 -21.934 1.00 0.00 H
-ATOM 6841 N PHE G 32 19.186 65.833 -23.317 1.00 55.75 N
-ATOM 6842 CA PHE G 32 19.179 64.373 -23.267 1.00 57.90 C
-ATOM 6843 C PHE G 32 20.601 63.880 -23.449 1.00 58.50 C
-ATOM 6844 O PHE G 32 21.421 64.573 -24.054 1.00 60.52 O
-ATOM 6845 CB PHE G 32 18.276 63.748 -24.327 1.00 57.48 C
-ATOM 6846 CG PHE G 32 18.761 63.815 -25.744 1.00 58.70 C
-ATOM 6847 CD1 PHE G 32 18.440 64.865 -26.598 1.00 53.58 C
-ATOM 6848 CD2 PHE G 32 19.531 62.772 -26.238 1.00 55.34 C
-ATOM 6849 CE1 PHE G 32 18.895 64.861 -27.914 1.00 53.78 C
-ATOM 6850 CE2 PHE G 32 19.980 62.763 -27.534 1.00 60.76 C
-ATOM 6851 CZ PHE G 32 19.666 63.805 -28.378 1.00 57.26 C
-ATOM 6852 H PHE G 32 19.074 66.334 -24.189 1.00 0.00 H
-ATOM 6853 HA PHE G 32 18.826 64.052 -22.292 1.00 0.00 H
-ATOM 6854 1HB PHE G 32 18.158 62.699 -24.079 1.00 0.00 H
-ATOM 6855 2HB PHE G 32 17.290 64.206 -24.280 1.00 0.00 H
-ATOM 6856 HD1 PHE G 32 17.827 65.691 -26.233 1.00 0.00 H
-ATOM 6857 HD2 PHE G 32 19.774 61.944 -25.578 1.00 0.00 H
-ATOM 6858 HE1 PHE G 32 18.645 65.684 -28.584 1.00 0.00 H
-ATOM 6859 HE2 PHE G 32 20.585 61.929 -27.893 1.00 0.00 H
-ATOM 6860 HZ PHE G 32 20.023 63.798 -29.407 1.00 0.00 H
-ATOM 6861 N HIS G 33 20.884 62.674 -22.978 1.00 54.22 N
-ATOM 6862 CA HIS G 33 22.208 62.102 -23.228 1.00 51.13 C
-ATOM 6863 C HIS G 33 22.100 60.695 -23.788 1.00 48.08 C
-ATOM 6864 O HIS G 33 23.093 60.101 -24.207 1.00 47.17 O
-ATOM 6865 CB HIS G 33 23.036 62.075 -21.940 1.00 49.06 C
-ATOM 6866 CG HIS G 33 22.495 61.150 -20.885 1.00 50.32 C
-ATOM 6867 ND1 HIS G 33 22.772 59.803 -20.893 1.00 44.71 N
-ATOM 6868 CD2 HIS G 33 21.679 61.358 -19.819 1.00 44.50 C
-ATOM 6869 CE1 HIS G 33 22.173 59.224 -19.875 1.00 50.45 C
-ATOM 6870 NE2 HIS G 33 21.502 60.138 -19.211 1.00 48.54 N
-ATOM 6871 H HIS G 33 20.177 62.175 -22.445 1.00 0.00 H
-ATOM 6872 HA HIS G 33 22.738 62.706 -23.964 1.00 0.00 H
-ATOM 6873 1HB HIS G 33 24.053 61.751 -22.176 1.00 0.00 H
-ATOM 6874 2HB HIS G 33 23.103 63.071 -21.531 1.00 0.00 H
-ATOM 6875 HD2 HIS G 33 21.244 62.304 -19.506 1.00 0.00 H
-ATOM 6876 HE1 HIS G 33 22.219 58.163 -19.629 1.00 0.00 H
-ATOM 6877 HE2 HIS G 33 20.947 59.944 -18.389 1.00 0.00 H
-ATOM 6878 N HIS G 34 20.889 60.170 -23.798 1.00 46.28 N
-ATOM 6879 CA HIS G 34 20.642 58.814 -24.263 1.00 44.51 C
-ATOM 6880 C HIS G 34 19.197 58.592 -24.628 1.00 44.88 C
-ATOM 6881 O HIS G 34 18.279 59.046 -23.939 1.00 44.73 O
-ATOM 6882 CB HIS G 34 21.040 57.749 -23.224 1.00 43.39 C
-ATOM 6883 CG HIS G 34 20.874 56.318 -23.744 1.00 39.63 C
-ATOM 6884 ND1 HIS G 34 21.733 55.759 -24.664 1.00 36.03 N
-ATOM 6885 CD2 HIS G 34 19.941 55.361 -23.467 1.00 41.63 C
-ATOM 6886 CE1 HIS G 34 21.338 54.518 -24.939 1.00 37.56 C
-ATOM 6887 NE2 HIS G 34 20.255 54.252 -24.229 1.00 43.47 N
-ATOM 6888 H HIS G 34 20.119 60.723 -23.454 1.00 0.00 H
-ATOM 6889 HA HIS G 34 21.231 58.634 -25.162 1.00 0.00 H
-ATOM 6890 1HB HIS G 34 22.086 57.884 -22.939 1.00 0.00 H
-ATOM 6891 2HB HIS G 34 20.437 57.864 -22.324 1.00 0.00 H
-ATOM 6892 HD2 HIS G 34 19.099 55.457 -22.782 1.00 0.00 H
-ATOM 6893 HE1 HIS G 34 21.827 53.836 -25.636 1.00 0.00 H
-ATOM 6894 HE2 HIS G 34 19.729 53.357 -24.258 1.00 0.00 H
-ATOM 6895 N SER G 35 18.993 57.833 -25.685 1.00 45.20 N
-ATOM 6896 CA SER G 35 17.652 57.425 -26.042 1.00 47.13 C
-ATOM 6897 C SER G 35 17.651 55.932 -26.309 1.00 49.76 C
-ATOM 6898 O SER G 35 18.602 55.396 -26.885 1.00 47.60 O
-ATOM 6899 CB SER G 35 17.183 58.199 -27.255 1.00 43.89 C
-ATOM 6900 OG SER G 35 17.998 57.930 -28.364 1.00 42.03 O
-ATOM 6901 H SER G 35 19.782 57.507 -26.228 1.00 0.00 H
-ATOM 6902 HA SER G 35 16.982 57.628 -25.209 1.00 0.00 H
-ATOM 6903 1HB SER G 35 16.160 57.919 -27.479 1.00 0.00 H
-ATOM 6904 2HB SER G 35 17.190 59.267 -27.037 1.00 0.00 H
-ATOM 6905 HG SER G 35 17.936 56.983 -28.515 1.00 0.00 H
-ATOM 6906 N GLU G 36 16.562 55.278 -25.936 1.00 50.54 N
-ATOM 6907 CA GLU G 36 16.440 53.844 -26.108 1.00 50.55 C
-ATOM 6908 C GLU G 36 15.136 53.506 -26.810 1.00 52.12 C
-ATOM 6909 O GLU G 36 14.061 53.938 -26.388 1.00 51.47 O
-ATOM 6910 CB GLU G 36 16.495 53.167 -24.725 1.00 50.42 C
-ATOM 6911 CG GLU G 36 16.549 51.639 -24.707 1.00 42.61 C
-ATOM 6912 CD GLU G 36 17.870 51.096 -25.168 1.00 45.81 C
-ATOM 6913 OE1 GLU G 36 18.896 51.599 -24.740 1.00 48.61 O
-ATOM 6914 OE2 GLU G 36 17.861 50.147 -25.931 1.00 37.97 O
-ATOM 6915 H GLU G 36 15.826 55.792 -25.460 1.00 0.00 H
-ATOM 6916 HA GLU G 36 17.266 53.489 -26.725 1.00 0.00 H
-ATOM 6917 1HB GLU G 36 17.366 53.533 -24.184 1.00 0.00 H
-ATOM 6918 2HB GLU G 36 15.618 53.463 -24.154 1.00 0.00 H
-ATOM 6919 1HG GLU G 36 16.375 51.287 -23.694 1.00 0.00 H
-ATOM 6920 2HG GLU G 36 15.755 51.245 -25.341 1.00 0.00 H
-ATOM 6921 N LYS G 37 15.234 52.761 -27.903 1.00 51.16 N
-ATOM 6922 CA LYS G 37 14.040 52.381 -28.636 1.00 51.08 C
-ATOM 6923 C LYS G 37 13.542 51.013 -28.233 1.00 52.33 C
-ATOM 6924 O LYS G 37 14.305 50.042 -28.212 1.00 52.66 O
-ATOM 6925 CB LYS G 37 14.279 52.414 -30.143 1.00 48.71 C
-ATOM 6926 CG LYS G 37 14.577 53.786 -30.704 1.00 42.29 C
-ATOM 6927 CD LYS G 37 13.320 54.652 -30.697 1.00 45.36 C
-ATOM 6928 CE LYS G 37 13.558 55.989 -31.384 1.00 52.15 C
-ATOM 6929 NZ LYS G 37 13.870 55.819 -32.842 1.00 59.66 N
-ATOM 6930 H LYS G 37 16.142 52.441 -28.210 1.00 0.00 H
-ATOM 6931 HA LYS G 37 13.261 53.102 -28.409 1.00 0.00 H
-ATOM 6932 1HB LYS G 37 15.111 51.759 -30.397 1.00 0.00 H
-ATOM 6933 2HB LYS G 37 13.389 52.028 -30.651 1.00 0.00 H
-ATOM 6934 1HG LYS G 37 15.339 54.265 -30.085 1.00 0.00 H
-ATOM 6935 2HG LYS G 37 14.955 53.702 -31.723 1.00 0.00 H
-ATOM 6936 1HD LYS G 37 12.510 54.124 -31.209 1.00 0.00 H
-ATOM 6937 2HD LYS G 37 13.004 54.832 -29.665 1.00 0.00 H
-ATOM 6938 1HE LYS G 37 12.664 56.601 -31.285 1.00 0.00 H
-ATOM 6939 2HE LYS G 37 14.394 56.500 -30.903 1.00 0.00 H
-ATOM 6940 1HZ LYS G 37 14.018 56.726 -33.264 1.00 0.00 H
-ATOM 6941 2HZ LYS G 37 14.707 55.258 -32.950 1.00 0.00 H
-ATOM 6942 3HZ LYS G 37 13.096 55.357 -33.300 1.00 0.00 H
-ATOM 6943 N LEU G 38 12.257 50.933 -27.930 1.00 54.47 N
-ATOM 6944 CA LEU G 38 11.654 49.660 -27.598 1.00 56.10 C
-ATOM 6945 C LEU G 38 10.695 49.248 -28.712 1.00 57.30 C
-ATOM 6946 O LEU G 38 9.906 50.067 -29.210 1.00 57.22 O
-ATOM 6947 CB LEU G 38 10.873 49.779 -26.290 1.00 53.21 C
-ATOM 6948 CG LEU G 38 11.606 50.323 -25.058 1.00 52.68 C
-ATOM 6949 CD1 LEU G 38 10.603 50.395 -23.881 1.00 46.80 C
-ATOM 6950 CD2 LEU G 38 12.781 49.453 -24.732 1.00 51.28 C
-ATOM 6951 H LEU G 38 11.694 51.782 -27.934 1.00 0.00 H
-ATOM 6952 HA LEU G 38 12.431 48.899 -27.503 1.00 0.00 H
-ATOM 6953 1HB LEU G 38 10.083 50.440 -26.475 1.00 0.00 H
-ATOM 6954 2HB LEU G 38 10.459 48.805 -26.037 1.00 0.00 H
-ATOM 6955 HG LEU G 38 11.961 51.336 -25.267 1.00 0.00 H
-ATOM 6956 1HD1 LEU G 38 11.096 50.801 -22.997 1.00 0.00 H
-ATOM 6957 2HD1 LEU G 38 9.770 51.043 -24.158 1.00 0.00 H
-ATOM 6958 3HD1 LEU G 38 10.224 49.394 -23.656 1.00 0.00 H
-ATOM 6959 1HD2 LEU G 38 13.299 49.861 -23.875 1.00 0.00 H
-ATOM 6960 2HD2 LEU G 38 12.443 48.438 -24.514 1.00 0.00 H
-ATOM 6961 3HD2 LEU G 38 13.452 49.442 -25.587 1.00 0.00 H
-ATOM 6962 N ASP G 39 10.698 47.975 -29.059 1.00 57.92 N
-ATOM 6963 CA ASP G 39 9.701 47.475 -29.995 1.00 59.02 C
-ATOM 6964 C ASP G 39 8.541 46.943 -29.180 1.00 60.73 C
-ATOM 6965 O ASP G 39 8.705 46.727 -27.977 1.00 61.36 O
-ATOM 6966 CB ASP G 39 10.279 46.429 -30.935 1.00 64.08 C
-ATOM 6967 CG ASP G 39 11.275 47.050 -31.924 1.00 62.89 C
-ATOM 6968 OD1 ASP G 39 11.177 48.235 -32.171 1.00 61.31 O
-ATOM 6969 OD2 ASP G 39 12.114 46.343 -32.421 1.00 54.41 O
-ATOM 6970 H ASP G 39 11.393 47.342 -28.656 1.00 0.00 H
-ATOM 6971 HA ASP G 39 9.348 48.300 -30.602 1.00 0.00 H
-ATOM 6972 1HB ASP G 39 10.773 45.646 -30.354 1.00 0.00 H
-ATOM 6973 2HB ASP G 39 9.466 45.966 -31.503 1.00 0.00 H
-ATOM 6974 N LYS G 40 7.379 46.750 -29.790 1.00 60.09 N
-ATOM 6975 CA LYS G 40 6.244 46.279 -29.017 1.00 58.06 C
-ATOM 6976 C LYS G 40 6.621 45.049 -28.224 1.00 54.94 C
-ATOM 6977 O LYS G 40 7.154 44.084 -28.775 1.00 52.58 O
-ATOM 6978 CB LYS G 40 5.066 45.948 -29.926 1.00 63.59 C
-ATOM 6979 CG LYS G 40 3.820 45.506 -29.201 1.00 67.66 C
-ATOM 6980 CD LYS G 40 2.695 45.283 -30.174 1.00 61.52 C
-ATOM 6981 CE LYS G 40 1.419 44.885 -29.469 1.00 64.33 C
-ATOM 6982 NZ LYS G 40 0.303 44.681 -30.432 1.00 76.63 N
-ATOM 6983 H LYS G 40 7.263 46.927 -30.792 1.00 0.00 H
-ATOM 6984 HA LYS G 40 5.945 47.062 -28.318 1.00 0.00 H
-ATOM 6985 1HB LYS G 40 4.818 46.814 -30.531 1.00 0.00 H
-ATOM 6986 2HB LYS G 40 5.355 45.152 -30.609 1.00 0.00 H
-ATOM 6987 1HG LYS G 40 4.021 44.581 -28.656 1.00 0.00 H
-ATOM 6988 2HG LYS G 40 3.527 46.268 -28.486 1.00 0.00 H
-ATOM 6989 1HD LYS G 40 2.522 46.204 -30.732 1.00 0.00 H
-ATOM 6990 2HD LYS G 40 2.978 44.496 -30.873 1.00 0.00 H
-ATOM 6991 1HE LYS G 40 1.588 43.956 -28.919 1.00 0.00 H
-ATOM 6992 2HE LYS G 40 1.141 45.671 -28.764 1.00 0.00 H
-ATOM 6993 1HZ LYS G 40 -0.533 44.418 -29.927 1.00 0.00 H
-ATOM 6994 2HZ LYS G 40 0.136 45.542 -30.939 1.00 0.00 H
-ATOM 6995 3HZ LYS G 40 0.550 43.948 -31.084 1.00 0.00 H
-ATOM 6996 N GLY G 41 6.336 45.077 -26.929 1.00 52.50 N
-ATOM 6997 CA GLY G 41 6.635 43.944 -26.072 1.00 50.47 C
-ATOM 6998 C GLY G 41 7.957 44.034 -25.307 1.00 49.46 C
-ATOM 6999 O GLY G 41 8.177 43.256 -24.377 1.00 48.78 O
-ATOM 7000 H GLY G 41 5.900 45.901 -26.519 1.00 0.00 H
-ATOM 7001 1HA GLY G 41 5.813 43.803 -25.372 1.00 0.00 H
-ATOM 7002 2HA GLY G 41 6.665 43.057 -26.698 1.00 0.00 H
-ATOM 7003 N GLU G 42 8.853 44.948 -25.675 1.00 49.14 N
-ATOM 7004 CA GLU G 42 10.108 45.028 -24.923 1.00 50.08 C
-ATOM 7005 C GLU G 42 9.909 45.783 -23.613 1.00 50.20 C
-ATOM 7006 O GLU G 42 9.181 46.782 -23.549 1.00 50.83 O
-ATOM 7007 CB GLU G 42 11.259 45.642 -25.753 1.00 45.99 C
-ATOM 7008 CG GLU G 42 11.794 44.730 -26.918 1.00 52.33 C
-ATOM 7009 CD GLU G 42 13.024 45.322 -27.695 1.00 46.52 C
-ATOM 7010 OE1 GLU G 42 12.902 46.414 -28.200 1.00 53.15 O
-ATOM 7011 OE2 GLU G 42 14.066 44.671 -27.770 1.00 52.77 O
-ATOM 7012 H GLU G 42 8.670 45.569 -26.462 1.00 0.00 H
-ATOM 7013 HA GLU G 42 10.416 44.013 -24.664 1.00 0.00 H
-ATOM 7014 1HB GLU G 42 10.919 46.570 -26.202 1.00 0.00 H
-ATOM 7015 2HB GLU G 42 12.094 45.883 -25.092 1.00 0.00 H
-ATOM 7016 1HG GLU G 42 12.057 43.747 -26.502 1.00 0.00 H
-ATOM 7017 2HG GLU G 42 10.975 44.579 -27.618 1.00 0.00 H
-ATOM 7018 N VAL G 43 10.565 45.290 -22.558 1.00 48.22 N
-ATOM 7019 CA VAL G 43 10.463 45.918 -21.241 1.00 46.36 C
-ATOM 7020 C VAL G 43 11.797 46.470 -20.774 1.00 45.74 C
-ATOM 7021 O VAL G 43 12.809 45.769 -20.768 1.00 48.55 O
-ATOM 7022 CB VAL G 43 9.917 44.919 -20.183 1.00 43.43 C
-ATOM 7023 CG1 VAL G 43 9.887 45.580 -18.798 1.00 36.62 C
-ATOM 7024 CG2 VAL G 43 8.503 44.482 -20.565 1.00 37.18 C
-ATOM 7025 H VAL G 43 11.154 44.463 -22.680 1.00 0.00 H
-ATOM 7026 HA VAL G 43 9.761 46.745 -21.311 1.00 0.00 H
-ATOM 7027 HB VAL G 43 10.571 44.051 -20.135 1.00 0.00 H
-ATOM 7028 1HG1 VAL G 43 9.507 44.874 -18.059 1.00 0.00 H
-ATOM 7029 2HG1 VAL G 43 10.894 45.885 -18.519 1.00 0.00 H
-ATOM 7030 3HG1 VAL G 43 9.237 46.456 -18.832 1.00 0.00 H
-ATOM 7031 1HG2 VAL G 43 8.116 43.780 -19.825 1.00 0.00 H
-ATOM 7032 2HG2 VAL G 43 7.873 45.347 -20.597 1.00 0.00 H
-ATOM 7033 3HG2 VAL G 43 8.517 44.009 -21.544 1.00 0.00 H
-ATOM 7034 N LEU G 44 11.799 47.741 -20.400 1.00 43.79 N
-ATOM 7035 CA LEU G 44 12.998 48.397 -19.907 1.00 45.29 C
-ATOM 7036 C LEU G 44 12.840 48.801 -18.456 1.00 45.75 C
-ATOM 7037 O LEU G 44 11.906 49.517 -18.095 1.00 46.43 O
-ATOM 7038 CB LEU G 44 13.309 49.635 -20.752 1.00 43.11 C
-ATOM 7039 CG LEU G 44 14.511 50.486 -20.304 1.00 45.39 C
-ATOM 7040 CD1 LEU G 44 15.812 49.673 -20.453 1.00 39.16 C
-ATOM 7041 CD2 LEU G 44 14.543 51.760 -21.145 1.00 41.81 C
-ATOM 7042 H LEU G 44 10.931 48.267 -20.454 1.00 0.00 H
-ATOM 7043 HA LEU G 44 13.834 47.704 -19.977 1.00 0.00 H
-ATOM 7044 1HB LEU G 44 13.514 49.300 -21.755 1.00 0.00 H
-ATOM 7045 2HB LEU G 44 12.427 50.276 -20.773 1.00 0.00 H
-ATOM 7046 HG LEU G 44 14.400 50.750 -19.249 1.00 0.00 H
-ATOM 7047 1HD1 LEU G 44 16.656 50.277 -20.129 1.00 0.00 H
-ATOM 7048 2HD1 LEU G 44 15.755 48.774 -19.838 1.00 0.00 H
-ATOM 7049 3HD1 LEU G 44 15.949 49.393 -21.496 1.00 0.00 H
-ATOM 7050 1HD2 LEU G 44 15.382 52.385 -20.838 1.00 0.00 H
-ATOM 7051 2HD2 LEU G 44 14.650 51.502 -22.196 1.00 0.00 H
-ATOM 7052 3HD2 LEU G 44 13.613 52.305 -21.003 1.00 0.00 H
-ATOM 7053 N ILE G 45 13.740 48.329 -17.614 1.00 44.80 N
-ATOM 7054 CA ILE G 45 13.699 48.680 -16.212 1.00 41.71 C
-ATOM 7055 C ILE G 45 14.919 49.542 -15.943 1.00 39.54 C
-ATOM 7056 O ILE G 45 16.047 49.098 -16.158 1.00 38.14 O
-ATOM 7057 CB ILE G 45 13.717 47.435 -15.332 1.00 44.31 C
-ATOM 7058 CG1 ILE G 45 12.544 46.534 -15.719 1.00 43.25 C
-ATOM 7059 CG2 ILE G 45 13.562 47.893 -13.907 1.00 33.38 C
-ATOM 7060 CD1 ILE G 45 12.548 45.190 -15.086 1.00 44.42 C
-ATOM 7061 H ILE G 45 14.473 47.716 -17.952 1.00 0.00 H
-ATOM 7062 HA ILE G 45 12.804 49.256 -16.002 1.00 0.00 H
-ATOM 7063 HB ILE G 45 14.646 46.881 -15.466 1.00 0.00 H
-ATOM 7064 1HG1 ILE G 45 11.639 47.030 -15.455 1.00 0.00 H
-ATOM 7065 2HG1 ILE G 45 12.558 46.393 -16.798 1.00 0.00 H
-ATOM 7066 1HG2 ILE G 45 13.551 47.049 -13.232 1.00 0.00 H
-ATOM 7067 2HG2 ILE G 45 14.380 48.559 -13.650 1.00 0.00 H
-ATOM 7068 3HG2 ILE G 45 12.635 48.434 -13.828 1.00 0.00 H
-ATOM 7069 1HD1 ILE G 45 11.681 44.643 -15.427 1.00 0.00 H
-ATOM 7070 2HD1 ILE G 45 13.457 44.650 -15.364 1.00 0.00 H
-ATOM 7071 3HD1 ILE G 45 12.505 45.304 -14.017 1.00 0.00 H
-ATOM 7072 N ALA G 46 14.726 50.779 -15.506 1.00 39.67 N
-ATOM 7073 CA ALA G 46 15.904 51.635 -15.415 1.00 42.15 C
-ATOM 7074 C ALA G 46 15.922 52.554 -14.222 1.00 43.12 C
-ATOM 7075 O ALA G 46 14.911 53.155 -13.851 1.00 43.03 O
-ATOM 7076 CB ALA G 46 15.998 52.476 -16.678 1.00 40.85 C
-ATOM 7077 H ALA G 46 13.786 51.109 -15.293 1.00 0.00 H
-ATOM 7078 HA ALA G 46 16.780 50.996 -15.335 1.00 0.00 H
-ATOM 7079 1HB ALA G 46 16.899 53.090 -16.635 1.00 0.00 H
-ATOM 7080 2HB ALA G 46 16.041 51.825 -17.548 1.00 0.00 H
-ATOM 7081 3HB ALA G 46 15.122 53.120 -16.747 1.00 0.00 H
-ATOM 7082 N GLN G 47 17.116 52.671 -13.642 1.00 43.83 N
-ATOM 7083 CA GLN G 47 17.373 53.520 -12.492 1.00 44.16 C
-ATOM 7084 C GLN G 47 17.711 54.941 -12.846 1.00 43.77 C
-ATOM 7085 O GLN G 47 18.235 55.231 -13.922 1.00 47.50 O
-ATOM 7086 CB GLN G 47 18.529 52.977 -11.649 1.00 38.14 C
-ATOM 7087 CG GLN G 47 18.268 51.680 -10.952 1.00 40.71 C
-ATOM 7088 CD GLN G 47 19.441 51.253 -10.127 1.00 37.22 C
-ATOM 7089 OE1 GLN G 47 20.565 51.116 -10.630 1.00 43.53 O
-ATOM 7090 NE2 GLN G 47 19.200 51.046 -8.837 1.00 37.16 N
-ATOM 7091 H GLN G 47 17.899 52.128 -14.009 1.00 0.00 H
-ATOM 7092 HA GLN G 47 16.487 53.540 -11.874 1.00 0.00 H
-ATOM 7093 1HB GLN G 47 19.401 52.842 -12.288 1.00 0.00 H
-ATOM 7094 2HB GLN G 47 18.793 53.717 -10.890 1.00 0.00 H
-ATOM 7095 1HG GLN G 47 17.438 51.825 -10.268 1.00 0.00 H
-ATOM 7096 2HG GLN G 47 18.039 50.905 -11.685 1.00 0.00 H
-ATOM 7097 1HE2 GLN G 47 19.936 50.758 -8.228 1.00 0.00 H
-ATOM 7098 2HE2 GLN G 47 18.262 51.206 -8.467 1.00 0.00 H
-ATOM 7099 N PHE G 48 17.484 55.812 -11.878 1.00 44.59 N
-ATOM 7100 CA PHE G 48 17.977 57.176 -11.962 1.00 44.85 C
-ATOM 7101 C PHE G 48 19.443 57.092 -11.549 1.00 45.26 C
-ATOM 7102 O PHE G 48 19.799 56.250 -10.723 1.00 44.66 O
-ATOM 7103 CB PHE G 48 17.173 58.085 -11.058 1.00 50.64 C
-ATOM 7104 CG PHE G 48 15.774 58.279 -11.552 1.00 52.84 C
-ATOM 7105 CD1 PHE G 48 15.507 59.138 -12.602 1.00 51.71 C
-ATOM 7106 CD2 PHE G 48 14.719 57.575 -10.976 1.00 44.79 C
-ATOM 7107 CE1 PHE G 48 14.218 59.288 -13.061 1.00 54.37 C
-ATOM 7108 CE2 PHE G 48 13.434 57.729 -11.443 1.00 63.15 C
-ATOM 7109 CZ PHE G 48 13.193 58.583 -12.488 1.00 60.76 C
-ATOM 7110 H PHE G 48 16.980 55.496 -11.048 1.00 0.00 H
-ATOM 7111 HA PHE G 48 17.914 57.536 -12.991 1.00 0.00 H
-ATOM 7112 1HB PHE G 48 17.138 57.681 -10.047 1.00 0.00 H
-ATOM 7113 2HB PHE G 48 17.660 59.050 -11.023 1.00 0.00 H
-ATOM 7114 HD1 PHE G 48 16.330 59.691 -13.066 1.00 0.00 H
-ATOM 7115 HD2 PHE G 48 14.924 56.891 -10.153 1.00 0.00 H
-ATOM 7116 HE1 PHE G 48 14.012 59.952 -13.879 1.00 0.00 H
-ATOM 7117 HE2 PHE G 48 12.614 57.171 -10.990 1.00 0.00 H
-ATOM 7118 HZ PHE G 48 12.201 58.694 -12.867 1.00 0.00 H
-ATOM 7119 N THR G 49 20.308 57.884 -12.172 1.00 44.14 N
-ATOM 7120 CA THR G 49 21.743 57.733 -11.923 1.00 42.15 C
-ATOM 7121 C THR G 49 22.465 59.034 -11.660 1.00 42.70 C
-ATOM 7122 O THR G 49 21.879 60.113 -11.632 1.00 45.30 O
-ATOM 7123 CB THR G 49 22.472 57.075 -13.111 1.00 44.61 C
-ATOM 7124 OG1 THR G 49 22.545 58.008 -14.205 1.00 54.28 O
-ATOM 7125 CG2 THR G 49 21.738 55.811 -13.572 1.00 32.75 C
-ATOM 7126 H THR G 49 19.960 58.604 -12.799 1.00 0.00 H
-ATOM 7127 HA THR G 49 21.874 57.102 -11.044 1.00 0.00 H
-ATOM 7128 HB THR G 49 23.482 56.798 -12.812 1.00 0.00 H
-ATOM 7129 HG1 THR G 49 22.753 58.882 -13.855 1.00 0.00 H
-ATOM 7130 1HG2 THR G 49 22.275 55.368 -14.408 1.00 0.00 H
-ATOM 7131 2HG2 THR G 49 21.684 55.093 -12.752 1.00 0.00 H
-ATOM 7132 3HG2 THR G 49 20.729 56.068 -13.892 1.00 0.00 H
-ATOM 7133 N GLU G 50 23.778 58.918 -11.532 1.00 42.03 N
-ATOM 7134 CA GLU G 50 24.678 60.052 -11.409 1.00 47.33 C
-ATOM 7135 C GLU G 50 24.532 60.998 -12.608 1.00 50.45 C
-ATOM 7136 O GLU G 50 24.818 62.189 -12.492 1.00 51.25 O
-ATOM 7137 CB GLU G 50 26.126 59.561 -11.292 1.00 55.95 C
-ATOM 7138 CG GLU G 50 27.162 60.659 -11.090 1.00 60.46 C
-ATOM 7139 CD GLU G 50 28.567 60.120 -10.880 1.00 71.86 C
-ATOM 7140 OE1 GLU G 50 28.735 58.922 -10.875 1.00 79.12 O
-ATOM 7141 OE2 GLU G 50 29.468 60.913 -10.726 1.00 74.19 O
-ATOM 7142 H GLU G 50 24.182 57.993 -11.534 1.00 0.00 H
-ATOM 7143 HA GLU G 50 24.420 60.604 -10.506 1.00 0.00 H
-ATOM 7144 1HB GLU G 50 26.209 58.875 -10.449 1.00 0.00 H
-ATOM 7145 2HB GLU G 50 26.397 59.008 -12.190 1.00 0.00 H
-ATOM 7146 1HG GLU G 50 27.161 61.302 -11.973 1.00 0.00 H
-ATOM 7147 2HG GLU G 50 26.876 61.265 -10.231 1.00 0.00 H
-ATOM 7148 N HIS G 51 24.146 60.458 -13.776 1.00 48.18 N
-ATOM 7149 CA HIS G 51 24.028 61.268 -14.979 1.00 48.20 C
-ATOM 7150 C HIS G 51 22.571 61.479 -15.422 1.00 51.44 C
-ATOM 7151 O HIS G 51 22.295 62.452 -16.118 1.00 50.87 O
-ATOM 7152 CB HIS G 51 24.842 60.631 -16.115 1.00 31.12 C
-ATOM 7153 CG HIS G 51 26.319 60.559 -15.804 1.00 49.46 C
-ATOM 7154 ND1 HIS G 51 26.868 59.557 -15.033 1.00 48.61 N
-ATOM 7155 CD2 HIS G 51 27.349 61.363 -16.161 1.00 47.60 C
-ATOM 7156 CE1 HIS G 51 28.171 59.757 -14.914 1.00 48.57 C
-ATOM 7157 NE2 HIS G 51 28.488 60.842 -15.594 1.00 47.25 N
-ATOM 7158 H HIS G 51 23.890 59.480 -13.829 1.00 0.00 H
-ATOM 7159 HA HIS G 51 24.449 62.255 -14.786 1.00 0.00 H
-ATOM 7160 1HB HIS G 51 24.475 59.621 -16.314 1.00 0.00 H
-ATOM 7161 2HB HIS G 51 24.711 61.213 -17.029 1.00 0.00 H
-ATOM 7162 HD2 HIS G 51 27.286 62.258 -16.779 1.00 0.00 H
-ATOM 7163 HE1 HIS G 51 28.865 59.129 -14.350 1.00 0.00 H
-ATOM 7164 HE2 HIS G 51 29.417 61.234 -15.680 1.00 0.00 H
-ATOM 7165 N THR G 52 21.637 60.603 -14.994 1.00 51.90 N
-ATOM 7166 CA THR G 52 20.218 60.746 -15.385 1.00 53.05 C
-ATOM 7167 C THR G 52 19.338 61.196 -14.214 1.00 53.75 C
-ATOM 7168 O THR G 52 19.187 60.473 -13.226 1.00 51.71 O
-ATOM 7169 CB THR G 52 19.612 59.419 -15.909 1.00 47.22 C
-ATOM 7170 OG1 THR G 52 20.331 58.966 -17.059 1.00 44.89 O
-ATOM 7171 CG2 THR G 52 18.126 59.631 -16.283 1.00 44.00 C
-ATOM 7172 H THR G 52 21.921 59.809 -14.437 1.00 0.00 H
-ATOM 7173 HA THR G 52 20.147 61.493 -16.171 1.00 0.00 H
-ATOM 7174 HB THR G 52 19.676 58.653 -15.133 1.00 0.00 H
-ATOM 7175 HG1 THR G 52 21.177 58.606 -16.775 1.00 0.00 H
-ATOM 7176 1HG2 THR G 52 17.699 58.700 -16.653 1.00 0.00 H
-ATOM 7177 2HG2 THR G 52 17.565 59.959 -15.408 1.00 0.00 H
-ATOM 7178 3HG2 THR G 52 18.054 60.394 -17.060 1.00 0.00 H
-ATOM 7179 N SER G 53 18.712 62.370 -14.354 1.00 54.96 N
-ATOM 7180 CA SER G 53 17.850 62.905 -13.294 1.00 54.92 C
-ATOM 7181 C SER G 53 16.378 62.788 -13.652 1.00 53.92 C
-ATOM 7182 O SER G 53 15.500 62.906 -12.792 1.00 53.55 O
-ATOM 7183 CB SER G 53 18.170 64.352 -13.023 1.00 57.97 C
-ATOM 7184 OG SER G 53 17.890 65.150 -14.135 1.00 53.93 O
-ATOM 7185 H SER G 53 18.851 62.900 -15.211 1.00 0.00 H
-ATOM 7186 HA SER G 53 18.022 62.333 -12.381 1.00 0.00 H
-ATOM 7187 1HB SER G 53 17.589 64.693 -12.171 1.00 0.00 H
-ATOM 7188 2HB SER G 53 19.210 64.435 -12.763 1.00 0.00 H
-ATOM 7189 HG SER G 53 18.270 64.693 -14.902 1.00 0.00 H
-ATOM 7190 N ALA G 54 16.107 62.560 -14.931 1.00 52.00 N
-ATOM 7191 CA ALA G 54 14.721 62.435 -15.359 1.00 51.39 C
-ATOM 7192 C ALA G 54 14.613 61.503 -16.553 1.00 50.29 C
-ATOM 7193 O ALA G 54 15.539 61.378 -17.354 1.00 51.44 O
-ATOM 7194 CB ALA G 54 14.129 63.803 -15.670 1.00 45.87 C
-ATOM 7195 H ALA G 54 16.868 62.506 -15.603 1.00 0.00 H
-ATOM 7196 HA ALA G 54 14.158 61.999 -14.544 1.00 0.00 H
-ATOM 7197 1HB ALA G 54 13.087 63.679 -15.953 1.00 0.00 H
-ATOM 7198 2HB ALA G 54 14.195 64.430 -14.783 1.00 0.00 H
-ATOM 7199 3HB ALA G 54 14.650 64.278 -16.460 1.00 0.00 H
-ATOM 7200 N ILE G 55 13.454 60.863 -16.667 1.00 50.72 N
-ATOM 7201 CA ILE G 55 13.160 59.970 -17.777 1.00 54.11 C
-ATOM 7202 C ILE G 55 11.900 60.397 -18.529 1.00 55.97 C
-ATOM 7203 O ILE G 55 10.836 60.577 -17.936 1.00 56.54 O
-ATOM 7204 CB ILE G 55 13.006 58.511 -17.276 1.00 57.35 C
-ATOM 7205 CG1 ILE G 55 14.343 58.028 -16.616 1.00 63.27 C
-ATOM 7206 CG2 ILE G 55 12.600 57.595 -18.433 1.00 56.72 C
-ATOM 7207 CD1 ILE G 55 14.243 56.688 -15.892 1.00 55.10 C
-ATOM 7208 H ILE G 55 12.745 61.023 -15.961 1.00 0.00 H
-ATOM 7209 HA ILE G 55 13.994 60.001 -18.471 1.00 0.00 H
-ATOM 7210 HB ILE G 55 12.235 58.475 -16.507 1.00 0.00 H
-ATOM 7211 1HG1 ILE G 55 15.104 57.947 -17.394 1.00 0.00 H
-ATOM 7212 2HG1 ILE G 55 14.668 58.766 -15.896 1.00 0.00 H
-ATOM 7213 1HG2 ILE G 55 12.485 56.576 -18.069 1.00 0.00 H
-ATOM 7214 2HG2 ILE G 55 11.656 57.933 -18.860 1.00 0.00 H
-ATOM 7215 3HG2 ILE G 55 13.373 57.623 -19.202 1.00 0.00 H
-ATOM 7216 1HD1 ILE G 55 15.215 56.429 -15.463 1.00 0.00 H
-ATOM 7217 2HD1 ILE G 55 13.503 56.756 -15.092 1.00 0.00 H
-ATOM 7218 3HD1 ILE G 55 13.943 55.914 -16.597 1.00 0.00 H
-ATOM 7219 N LYS G 56 12.023 60.564 -19.839 1.00 57.78 N
-ATOM 7220 CA LYS G 56 10.870 60.917 -20.661 1.00 56.77 C
-ATOM 7221 C LYS G 56 10.445 59.752 -21.535 1.00 57.25 C
-ATOM 7222 O LYS G 56 11.284 59.079 -22.127 1.00 58.41 O
-ATOM 7223 CB LYS G 56 11.126 62.144 -21.538 1.00 63.59 C
-ATOM 7224 CG LYS G 56 9.922 62.465 -22.428 1.00 65.55 C
-ATOM 7225 CD LYS G 56 10.095 63.670 -23.333 1.00 50.46 C
-ATOM 7226 CE LYS G 56 9.895 64.966 -22.593 1.00 53.76 C
-ATOM 7227 NZ LYS G 56 9.637 66.091 -23.550 1.00 62.36 N
-ATOM 7228 H LYS G 56 12.933 60.424 -20.271 1.00 0.00 H
-ATOM 7229 HA LYS G 56 10.037 61.154 -20.005 1.00 0.00 H
-ATOM 7230 1HB LYS G 56 11.326 63.010 -20.909 1.00 0.00 H
-ATOM 7231 2HB LYS G 56 11.985 61.985 -22.158 1.00 0.00 H
-ATOM 7232 1HG LYS G 56 9.725 61.614 -23.080 1.00 0.00 H
-ATOM 7233 2HG LYS G 56 9.045 62.618 -21.796 1.00 0.00 H
-ATOM 7234 1HD LYS G 56 11.090 63.664 -23.778 1.00 0.00 H
-ATOM 7235 2HD LYS G 56 9.358 63.617 -24.138 1.00 0.00 H
-ATOM 7236 1HE LYS G 56 9.053 64.856 -21.929 1.00 0.00 H
-ATOM 7237 2HE LYS G 56 10.781 65.199 -22.002 1.00 0.00 H
-ATOM 7238 1HZ LYS G 56 9.471 66.972 -23.055 1.00 0.00 H
-ATOM 7239 2HZ LYS G 56 10.420 66.205 -24.169 1.00 0.00 H
-ATOM 7240 3HZ LYS G 56 8.789 65.861 -24.090 1.00 0.00 H
-ATOM 7241 N VAL G 57 9.141 59.492 -21.606 1.00 55.87 N
-ATOM 7242 CA VAL G 57 8.669 58.424 -22.472 1.00 57.02 C
-ATOM 7243 C VAL G 57 7.704 58.944 -23.542 1.00 59.46 C
-ATOM 7244 O VAL G 57 6.708 59.619 -23.246 1.00 60.85 O
-ATOM 7245 CB VAL G 57 7.994 57.321 -21.645 1.00 45.71 C
-ATOM 7246 CG1 VAL G 57 7.518 56.196 -22.575 1.00 40.33 C
-ATOM 7247 CG2 VAL G 57 8.972 56.815 -20.610 1.00 53.49 C
-ATOM 7248 H VAL G 57 8.486 60.045 -21.061 1.00 0.00 H
-ATOM 7249 HA VAL G 57 9.528 57.986 -22.977 1.00 0.00 H
-ATOM 7250 HB VAL G 57 7.114 57.724 -21.147 1.00 0.00 H
-ATOM 7251 1HG1 VAL G 57 7.036 55.416 -21.995 1.00 0.00 H
-ATOM 7252 2HG1 VAL G 57 6.806 56.592 -23.304 1.00 0.00 H
-ATOM 7253 3HG1 VAL G 57 8.374 55.775 -23.102 1.00 0.00 H
-ATOM 7254 1HG2 VAL G 57 8.503 56.032 -20.020 1.00 0.00 H
-ATOM 7255 2HG2 VAL G 57 9.843 56.425 -21.121 1.00 0.00 H
-ATOM 7256 3HG2 VAL G 57 9.271 57.630 -19.954 1.00 0.00 H
-ATOM 7257 N ARG G 58 8.032 58.625 -24.797 1.00 60.02 N
-ATOM 7258 CA ARG G 58 7.258 58.998 -25.981 1.00 60.26 C
-ATOM 7259 C ARG G 58 6.839 57.755 -26.774 1.00 60.73 C
-ATOM 7260 O ARG G 58 7.677 56.928 -27.143 1.00 61.49 O
-ATOM 7261 CB ARG G 58 8.098 59.906 -26.865 1.00 72.15 C
-ATOM 7262 CG ARG G 58 7.471 60.319 -28.178 1.00 73.70 C
-ATOM 7263 CD ARG G 58 8.420 61.136 -28.984 1.00 75.55 C
-ATOM 7264 NE ARG G 58 8.647 62.437 -28.393 1.00 77.27 N
-ATOM 7265 CZ ARG G 58 9.650 63.271 -28.719 1.00 74.15 C
-ATOM 7266 NH1 ARG G 58 10.530 62.941 -29.637 1.00 68.72 N
-ATOM 7267 NH2 ARG G 58 9.735 64.427 -28.100 1.00 72.91 N
-ATOM 7268 H ARG G 58 8.889 58.097 -24.945 1.00 0.00 H
-ATOM 7269 HA ARG G 58 6.360 59.531 -25.663 1.00 0.00 H
-ATOM 7270 1HB ARG G 58 8.326 60.828 -26.313 1.00 0.00 H
-ATOM 7271 2HB ARG G 58 9.046 59.424 -27.085 1.00 0.00 H
-ATOM 7272 1HG ARG G 58 7.185 59.435 -28.755 1.00 0.00 H
-ATOM 7273 2HG ARG G 58 6.588 60.925 -27.973 1.00 0.00 H
-ATOM 7274 1HD ARG G 58 9.381 60.618 -29.038 1.00 0.00 H
-ATOM 7275 2HD ARG G 58 8.026 61.277 -29.989 1.00 0.00 H
-ATOM 7276 HE ARG G 58 7.996 62.766 -27.669 1.00 0.00 H
-ATOM 7277 1HH1 ARG G 58 10.457 62.054 -30.108 1.00 0.00 H
-ATOM 7278 2HH1 ARG G 58 11.277 63.578 -29.868 1.00 0.00 H
-ATOM 7279 1HH2 ARG G 58 9.026 64.646 -27.390 1.00 0.00 H
-ATOM 7280 2HH2 ARG G 58 10.470 65.075 -28.318 1.00 0.00 H
-ATOM 7281 N GLY G 59 5.553 57.619 -27.078 1.00 59.23 N
-ATOM 7282 CA GLY G 59 5.074 56.427 -27.768 1.00 58.53 C
-ATOM 7283 C GLY G 59 4.303 55.615 -26.750 1.00 61.34 C
-ATOM 7284 O GLY G 59 4.639 55.622 -25.568 1.00 61.49 O
-ATOM 7285 H GLY G 59 4.847 58.303 -26.797 1.00 0.00 H
-ATOM 7286 1HA GLY G 59 4.423 56.702 -28.599 1.00 0.00 H
-ATOM 7287 2HA GLY G 59 5.907 55.851 -28.164 1.00 0.00 H
-ATOM 7288 N LYS G 60 3.260 54.933 -27.197 1.00 61.47 N
-ATOM 7289 CA LYS G 60 2.401 54.250 -26.244 1.00 64.17 C
-ATOM 7290 C LYS G 60 3.162 53.194 -25.454 1.00 64.48 C
-ATOM 7291 O LYS G 60 3.779 52.294 -26.030 1.00 63.04 O
-ATOM 7292 CB LYS G 60 1.194 53.646 -26.966 1.00 66.59 C
-ATOM 7293 CG LYS G 60 0.112 53.122 -26.055 1.00 73.32 C
-ATOM 7294 CD LYS G 60 -1.053 52.560 -26.850 1.00 77.40 C
-ATOM 7295 CE LYS G 60 -2.154 52.036 -25.936 1.00 83.03 C
-ATOM 7296 NZ LYS G 60 -3.317 51.515 -26.714 1.00 87.30 N
-ATOM 7297 H LYS G 60 3.050 54.912 -28.190 1.00 0.00 H
-ATOM 7298 HA LYS G 60 2.042 54.982 -25.541 1.00 0.00 H
-ATOM 7299 1HB LYS G 60 0.755 54.399 -27.622 1.00 0.00 H
-ATOM 7300 2HB LYS G 60 1.514 52.817 -27.588 1.00 0.00 H
-ATOM 7301 1HG LYS G 60 0.514 52.372 -25.423 1.00 0.00 H
-ATOM 7302 2HG LYS G 60 -0.248 53.942 -25.422 1.00 0.00 H
-ATOM 7303 1HD LYS G 60 -1.460 53.336 -27.503 1.00 0.00 H
-ATOM 7304 2HD LYS G 60 -0.691 51.739 -27.468 1.00 0.00 H
-ATOM 7305 1HE LYS G 60 -1.751 51.230 -25.322 1.00 0.00 H
-ATOM 7306 2HE LYS G 60 -2.495 52.843 -25.283 1.00 0.00 H
-ATOM 7307 1HZ LYS G 60 -4.029 51.171 -26.078 1.00 0.00 H
-ATOM 7308 2HZ LYS G 60 -3.703 52.261 -27.280 1.00 0.00 H
-ATOM 7309 3HZ LYS G 60 -3.005 50.759 -27.314 1.00 0.00 H
-ATOM 7310 N ALA G 61 3.089 53.303 -24.128 1.00 63.29 N
-ATOM 7311 CA ALA G 61 3.802 52.372 -23.255 1.00 64.03 C
-ATOM 7312 C ALA G 61 3.192 52.313 -21.858 1.00 62.28 C
-ATOM 7313 O ALA G 61 2.686 53.312 -21.331 1.00 60.14 O
-ATOM 7314 CB ALA G 61 5.268 52.757 -23.153 1.00 64.59 C
-ATOM 7315 H ALA G 61 2.532 54.064 -23.747 1.00 0.00 H
-ATOM 7316 HA ALA G 61 3.744 51.391 -23.699 1.00 0.00 H
-ATOM 7317 1HB ALA G 61 5.793 52.034 -22.536 1.00 0.00 H
-ATOM 7318 2HB ALA G 61 5.687 52.761 -24.145 1.00 0.00 H
-ATOM 7319 3HB ALA G 61 5.365 53.739 -22.716 1.00 0.00 H
-ATOM 7320 N TYR G 62 3.290 51.143 -21.234 1.00 62.35 N
-ATOM 7321 CA TYR G 62 2.796 50.962 -19.872 1.00 60.44 C
-ATOM 7322 C TYR G 62 3.939 51.263 -18.917 1.00 58.06 C
-ATOM 7323 O TYR G 62 5.016 50.674 -19.049 1.00 57.14 O
-ATOM 7324 CB TYR G 62 2.295 49.532 -19.662 1.00 63.76 C
-ATOM 7325 CG TYR G 62 1.602 49.290 -18.339 1.00 68.36 C
-ATOM 7326 CD1 TYR G 62 0.324 49.785 -18.149 1.00 70.13 C
-ATOM 7327 CD2 TYR G 62 2.217 48.569 -17.328 1.00 70.16 C
-ATOM 7328 CE1 TYR G 62 -0.344 49.564 -16.968 1.00 72.30 C
-ATOM 7329 CE2 TYR G 62 1.544 48.341 -16.141 1.00 73.30 C
-ATOM 7330 CZ TYR G 62 0.265 48.836 -15.964 1.00 74.56 C
-ATOM 7331 OH TYR G 62 -0.420 48.596 -14.798 1.00 75.88 O
-ATOM 7332 H TYR G 62 3.738 50.371 -21.722 1.00 0.00 H
-ATOM 7333 HA TYR G 62 1.993 51.670 -19.677 1.00 0.00 H
-ATOM 7334 1HB TYR G 62 1.606 49.270 -20.457 1.00 0.00 H
-ATOM 7335 2HB TYR G 62 3.130 48.848 -19.729 1.00 0.00 H
-ATOM 7336 HD1 TYR G 62 -0.161 50.344 -18.944 1.00 0.00 H
-ATOM 7337 HD2 TYR G 62 3.217 48.179 -17.471 1.00 0.00 H
-ATOM 7338 HE1 TYR G 62 -1.353 49.953 -16.833 1.00 0.00 H
-ATOM 7339 HE2 TYR G 62 2.017 47.768 -15.351 1.00 0.00 H
-ATOM 7340 HH TYR G 62 0.062 47.964 -14.266 1.00 0.00 H
-ATOM 7341 N ILE G 63 3.743 52.185 -17.984 1.00 55.00 N
-ATOM 7342 CA ILE G 63 4.831 52.549 -17.096 1.00 54.43 C
-ATOM 7343 C ILE G 63 4.488 52.277 -15.621 1.00 53.75 C
-ATOM 7344 O ILE G 63 3.419 52.661 -15.136 1.00 52.33 O
-ATOM 7345 CB ILE G 63 5.181 54.029 -17.278 1.00 45.68 C
-ATOM 7346 CG1 ILE G 63 5.526 54.336 -18.735 1.00 53.86 C
-ATOM 7347 CG2 ILE G 63 6.370 54.390 -16.406 1.00 44.60 C
-ATOM 7348 CD1 ILE G 63 5.586 55.817 -19.025 1.00 37.52 C
-ATOM 7349 H ILE G 63 2.856 52.681 -17.895 1.00 0.00 H
-ATOM 7350 HA ILE G 63 5.696 51.958 -17.365 1.00 0.00 H
-ATOM 7351 HB ILE G 63 4.343 54.614 -17.014 1.00 0.00 H
-ATOM 7352 1HG1 ILE G 63 6.476 53.893 -18.970 1.00 0.00 H
-ATOM 7353 2HG1 ILE G 63 4.772 53.903 -19.386 1.00 0.00 H
-ATOM 7354 1HG2 ILE G 63 6.596 55.434 -16.544 1.00 0.00 H
-ATOM 7355 2HG2 ILE G 63 6.134 54.201 -15.367 1.00 0.00 H
-ATOM 7356 3HG2 ILE G 63 7.230 53.786 -16.696 1.00 0.00 H
-ATOM 7357 1HD1 ILE G 63 5.828 55.969 -20.067 1.00 0.00 H
-ATOM 7358 2HD1 ILE G 63 4.616 56.269 -18.812 1.00 0.00 H
-ATOM 7359 3HD1 ILE G 63 6.349 56.286 -18.405 1.00 0.00 H
-ATOM 7360 N GLN G 64 5.392 51.597 -14.911 1.00 53.33 N
-ATOM 7361 CA GLN G 64 5.188 51.318 -13.486 1.00 50.73 C
-ATOM 7362 C GLN G 64 6.241 52.078 -12.685 1.00 50.61 C
-ATOM 7363 O GLN G 64 7.441 51.940 -12.935 1.00 52.00 O
-ATOM 7364 CB GLN G 64 5.323 49.811 -13.180 1.00 37.72 C
-ATOM 7365 CG GLN G 64 4.381 48.905 -13.966 1.00 37.28 C
-ATOM 7366 CD GLN G 64 4.657 47.393 -13.784 1.00 43.00 C
-ATOM 7367 OE1 GLN G 64 5.767 46.915 -14.030 1.00 48.84 O
-ATOM 7368 NE2 GLN G 64 3.629 46.654 -13.374 1.00 43.85 N
-ATOM 7369 H GLN G 64 6.240 51.291 -15.375 1.00 0.00 H
-ATOM 7370 HA GLN G 64 4.211 51.676 -13.181 1.00 0.00 H
-ATOM 7371 1HB GLN G 64 6.324 49.485 -13.288 1.00 0.00 H
-ATOM 7372 2HB GLN G 64 5.071 49.662 -12.124 1.00 0.00 H
-ATOM 7373 1HG GLN G 64 3.365 49.095 -13.641 1.00 0.00 H
-ATOM 7374 2HG GLN G 64 4.482 49.142 -15.025 1.00 0.00 H
-ATOM 7375 1HE2 GLN G 64 3.715 45.643 -13.268 1.00 0.00 H
-ATOM 7376 2HE2 GLN G 64 2.751 47.080 -13.178 1.00 0.00 H
-ATOM 7377 N THR G 65 5.798 52.899 -11.738 1.00 51.21 N
-ATOM 7378 CA THR G 65 6.738 53.674 -10.927 1.00 53.30 C
-ATOM 7379 C THR G 65 6.419 53.464 -9.455 1.00 55.87 C
-ATOM 7380 O THR G 65 5.462 52.795 -9.089 1.00 53.60 O
-ATOM 7381 CB THR G 65 6.673 55.188 -11.196 1.00 58.52 C
-ATOM 7382 OG1 THR G 65 5.476 55.724 -10.614 1.00 52.22 O
-ATOM 7383 CG2 THR G 65 6.653 55.465 -12.684 1.00 52.81 C
-ATOM 7384 H THR G 65 4.798 52.996 -11.563 1.00 0.00 H
-ATOM 7385 HA THR G 65 7.751 53.317 -11.114 1.00 0.00 H
-ATOM 7386 HB THR G 65 7.541 55.674 -10.756 1.00 0.00 H
-ATOM 7387 HG1 THR G 65 5.392 55.383 -9.721 1.00 0.00 H
-ATOM 7388 1HG2 THR G 65 6.607 56.536 -12.853 1.00 0.00 H
-ATOM 7389 2HG2 THR G 65 7.557 55.062 -13.143 1.00 0.00 H
-ATOM 7390 3HG2 THR G 65 5.780 54.994 -13.126 1.00 0.00 H
-ATOM 7391 N ARG G 66 7.197 54.129 -8.613 1.00 56.32 N
-ATOM 7392 CA ARG G 66 7.002 54.062 -7.167 1.00 57.07 C
-ATOM 7393 C ARG G 66 5.626 54.578 -6.745 1.00 56.77 C
-ATOM 7394 O ARG G 66 5.160 54.250 -5.643 1.00 56.40 O
-ATOM 7395 CB ARG G 66 8.066 54.869 -6.430 1.00 68.24 C
-ATOM 7396 CG ARG G 66 8.122 54.568 -4.944 1.00 78.86 C
-ATOM 7397 CD ARG G 66 9.221 55.293 -4.231 1.00 86.38 C
-ATOM 7398 NE ARG G 66 8.928 56.703 -3.989 1.00 92.02 N
-ATOM 7399 CZ ARG G 66 9.850 57.619 -3.589 1.00 93.68 C
-ATOM 7400 NH1 ARG G 66 9.494 58.844 -3.321 1.00 95.71 N
-ATOM 7401 NH2 ARG G 66 11.114 57.291 -3.460 1.00 89.36 N
-ATOM 7402 H ARG G 66 7.963 54.662 -8.982 1.00 0.00 H
-ATOM 7403 HA ARG G 66 7.088 53.021 -6.862 1.00 0.00 H
-ATOM 7404 1HB ARG G 66 9.051 54.673 -6.849 1.00 0.00 H
-ATOM 7405 2HB ARG G 66 7.856 55.935 -6.532 1.00 0.00 H
-ATOM 7406 1HG ARG G 66 7.176 54.863 -4.488 1.00 0.00 H
-ATOM 7407 2HG ARG G 66 8.275 53.497 -4.802 1.00 0.00 H
-ATOM 7408 1HD ARG G 66 9.401 54.815 -3.268 1.00 0.00 H
-ATOM 7409 2HD ARG G 66 10.125 55.234 -4.830 1.00 0.00 H
-ATOM 7410 HE ARG G 66 7.967 57.001 -4.073 1.00 0.00 H
-ATOM 7411 1HH1 ARG G 66 8.534 59.119 -3.420 1.00 0.00 H
-ATOM 7412 2HH1 ARG G 66 10.203 59.522 -2.995 1.00 0.00 H
-ATOM 7413 1HH2 ARG G 66 11.440 56.361 -3.721 1.00 0.00 H
-ATOM 7414 2HH2 ARG G 66 11.787 57.983 -3.168 1.00 0.00 H
-ATOM 7415 N HIS G 67 5.002 55.431 -7.549 1.00 55.66 N
-ATOM 7416 CA HIS G 67 3.754 56.067 -7.156 1.00 53.42 C
-ATOM 7417 C HIS G 67 2.517 55.388 -7.743 1.00 53.09 C
-ATOM 7418 O HIS G 67 1.409 55.914 -7.634 1.00 54.67 O
-ATOM 7419 CB HIS G 67 3.732 57.528 -7.601 1.00 51.85 C
-ATOM 7420 CG HIS G 67 4.858 58.332 -7.082 1.00 47.99 C
-ATOM 7421 ND1 HIS G 67 5.317 58.232 -5.789 1.00 45.99 N
-ATOM 7422 CD2 HIS G 67 5.601 59.289 -7.668 1.00 45.78 C
-ATOM 7423 CE1 HIS G 67 6.310 59.082 -5.619 1.00 43.08 C
-ATOM 7424 NE2 HIS G 67 6.492 59.740 -6.744 1.00 52.28 N
-ATOM 7425 H HIS G 67 5.373 55.641 -8.483 1.00 0.00 H
-ATOM 7426 HA HIS G 67 3.664 56.034 -6.064 1.00 0.00 H
-ATOM 7427 1HB HIS G 67 3.762 57.564 -8.697 1.00 0.00 H
-ATOM 7428 2HB HIS G 67 2.805 57.997 -7.283 1.00 0.00 H
-ATOM 7429 HD2 HIS G 67 5.499 59.648 -8.683 1.00 0.00 H
-ATOM 7430 HE1 HIS G 67 6.868 59.228 -4.704 1.00 0.00 H
-ATOM 7431 HE2 HIS G 67 7.177 60.481 -6.911 1.00 0.00 H
-ATOM 7432 N GLY G 68 2.699 54.232 -8.385 1.00 51.80 N
-ATOM 7433 CA GLY G 68 1.572 53.570 -9.037 1.00 52.41 C
-ATOM 7434 C GLY G 68 1.874 53.432 -10.516 1.00 55.54 C
-ATOM 7435 O GLY G 68 3.035 53.300 -10.905 1.00 54.60 O
-ATOM 7436 H GLY G 68 3.623 53.813 -8.444 1.00 0.00 H
-ATOM 7437 1HA GLY G 68 1.416 52.590 -8.592 1.00 0.00 H
-ATOM 7438 2HA GLY G 68 0.662 54.150 -8.892 1.00 0.00 H
-ATOM 7439 N VAL G 69 0.843 53.405 -11.345 1.00 57.40 N
-ATOM 7440 CA VAL G 69 1.098 53.225 -12.764 1.00 59.85 C
-ATOM 7441 C VAL G 69 0.552 54.382 -13.571 1.00 62.05 C
-ATOM 7442 O VAL G 69 -0.353 55.096 -13.125 1.00 62.44 O
-ATOM 7443 CB VAL G 69 0.489 51.911 -13.274 1.00 61.39 C
-ATOM 7444 CG1 VAL G 69 1.108 50.755 -12.524 1.00 60.88 C
-ATOM 7445 CG2 VAL G 69 -1.016 51.934 -13.105 1.00 66.86 C
-ATOM 7446 H VAL G 69 -0.102 53.513 -11.000 1.00 0.00 H
-ATOM 7447 HA VAL G 69 2.174 53.183 -12.928 1.00 0.00 H
-ATOM 7448 HB VAL G 69 0.739 51.791 -14.332 1.00 0.00 H
-ATOM 7449 1HG1 VAL G 69 0.706 49.822 -12.895 1.00 0.00 H
-ATOM 7450 2HG1 VAL G 69 2.176 50.775 -12.672 1.00 0.00 H
-ATOM 7451 3HG1 VAL G 69 0.887 50.844 -11.465 1.00 0.00 H
-ATOM 7452 1HG2 VAL G 69 -1.436 51.000 -13.482 1.00 0.00 H
-ATOM 7453 2HG2 VAL G 69 -1.269 52.047 -12.051 1.00 0.00 H
-ATOM 7454 3HG2 VAL G 69 -1.430 52.772 -13.670 1.00 0.00 H
-ATOM 7455 N ILE G 70 1.136 54.578 -14.737 1.00 62.61 N
-ATOM 7456 CA ILE G 70 0.737 55.629 -15.650 1.00 62.73 C
-ATOM 7457 C ILE G 70 0.918 55.108 -17.070 1.00 61.14 C
-ATOM 7458 O ILE G 70 1.856 54.358 -17.342 1.00 58.48 O
-ATOM 7459 CB ILE G 70 1.602 56.896 -15.398 1.00 63.46 C
-ATOM 7460 CG1 ILE G 70 1.074 58.117 -16.160 1.00 70.83 C
-ATOM 7461 CG2 ILE G 70 3.014 56.622 -15.807 1.00 46.62 C
-ATOM 7462 CD1 ILE G 70 -0.199 58.676 -15.576 1.00 67.92 C
-ATOM 7463 H ILE G 70 1.892 53.949 -15.004 1.00 0.00 H
-ATOM 7464 HA ILE G 70 -0.315 55.866 -15.494 1.00 0.00 H
-ATOM 7465 HB ILE G 70 1.582 57.140 -14.334 1.00 0.00 H
-ATOM 7466 1HG1 ILE G 70 1.833 58.897 -16.140 1.00 0.00 H
-ATOM 7467 2HG1 ILE G 70 0.894 57.846 -17.193 1.00 0.00 H
-ATOM 7468 1HG2 ILE G 70 3.636 57.483 -15.623 1.00 0.00 H
-ATOM 7469 2HG2 ILE G 70 3.392 55.770 -15.236 1.00 0.00 H
-ATOM 7470 3HG2 ILE G 70 3.021 56.394 -16.870 1.00 0.00 H
-ATOM 7471 1HD1 ILE G 70 -0.519 59.539 -16.155 1.00 0.00 H
-ATOM 7472 2HD1 ILE G 70 -0.976 57.911 -15.602 1.00 0.00 H
-ATOM 7473 3HD1 ILE G 70 -0.022 58.978 -14.544 1.00 0.00 H
-ATOM 7474 N GLU G 71 0.036 55.482 -17.979 1.00 61.76 N
-ATOM 7475 CA GLU G 71 0.254 55.083 -19.358 1.00 61.98 C
-ATOM 7476 C GLU G 71 0.635 56.283 -20.192 1.00 62.92 C
-ATOM 7477 O GLU G 71 0.035 57.355 -20.060 1.00 62.69 O
-ATOM 7478 CB GLU G 71 -0.983 54.410 -19.952 1.00 57.10 C
-ATOM 7479 CG GLU G 71 -1.331 53.093 -19.303 1.00 62.22 C
-ATOM 7480 CD GLU G 71 -2.487 52.374 -19.957 1.00 73.41 C
-ATOM 7481 OE1 GLU G 71 -3.062 52.908 -20.873 1.00 81.37 O
-ATOM 7482 OE2 GLU G 71 -2.787 51.281 -19.536 1.00 78.73 O
-ATOM 7483 H GLU G 71 -0.750 56.062 -17.721 1.00 0.00 H
-ATOM 7484 HA GLU G 71 1.081 54.373 -19.399 1.00 0.00 H
-ATOM 7485 1HB GLU G 71 -1.840 55.074 -19.857 1.00 0.00 H
-ATOM 7486 2HB GLU G 71 -0.820 54.230 -21.017 1.00 0.00 H
-ATOM 7487 1HG GLU G 71 -0.449 52.467 -19.349 1.00 0.00 H
-ATOM 7488 2HG GLU G 71 -1.564 53.268 -18.254 1.00 0.00 H
-ATOM 7489 N SER G 72 1.604 56.084 -21.074 1.00 63.74 N
-ATOM 7490 CA SER G 72 2.060 57.111 -21.999 1.00 64.47 C
-ATOM 7491 C SER G 72 1.422 56.874 -23.349 1.00 64.92 C
-ATOM 7492 O SER G 72 0.986 55.751 -23.626 1.00 63.77 O
-ATOM 7493 CB SER G 72 3.569 57.075 -22.069 1.00 56.37 C
-ATOM 7494 OG SER G 72 4.007 55.820 -22.468 1.00 57.24 O
-ATOM 7495 H SER G 72 2.041 55.163 -21.118 1.00 0.00 H
-ATOM 7496 HA SER G 72 1.740 58.089 -21.640 1.00 0.00 H
-ATOM 7497 1HB SER G 72 3.922 57.833 -22.774 1.00 0.00 H
-ATOM 7498 2HB SER G 72 3.985 57.308 -21.103 1.00 0.00 H
-ATOM 7499 HG SER G 72 3.626 55.195 -21.831 1.00 0.00 H
-ATOM 7500 N GLU G 73 1.372 57.914 -24.182 1.00 68.06 N
-ATOM 7501 CA GLU G 73 0.758 57.802 -25.500 1.00 71.21 C
-ATOM 7502 C GLU G 73 1.624 58.431 -26.601 1.00 71.64 C
-ATOM 7503 O GLU G 73 2.821 58.682 -26.413 1.00 71.98 O
-ATOM 7504 OXT GLU G 73 1.149 58.550 -27.732 1.00 0.00 O
-ATOM 7505 CB GLU G 73 -0.632 58.459 -25.466 1.00 73.65 C
-ATOM 7506 CG GLU G 73 -1.571 57.883 -24.398 1.00 74.37 C
-ATOM 7507 CD GLU G 73 -2.927 58.543 -24.355 1.00 87.55 C
-ATOM 7508 OE1 GLU G 73 -3.452 58.700 -23.265 1.00 93.37 O
-ATOM 7509 OE2 GLU G 73 -3.432 58.895 -25.388 1.00 91.64 O
-ATOM 7510 H GLU G 73 1.757 58.809 -23.881 1.00 0.00 H
-ATOM 7511 HA GLU G 73 0.631 56.750 -25.741 1.00 0.00 H
-ATOM 7512 1HB GLU G 73 -0.540 59.516 -25.293 1.00 0.00 H
-ATOM 7513 2HB GLU G 73 -1.114 58.335 -26.435 1.00 0.00 H
-ATOM 7514 1HG GLU G 73 -1.692 56.815 -24.575 1.00 0.00 H
-ATOM 7515 2HG GLU G 73 -1.108 58.010 -23.423 1.00 0.00 H
-TER
-ATOM 7517 N SER I 7 14.494 64.861 1.806 1.00 81.24 N
-ATOM 7518 CA SER I 7 13.816 66.052 2.291 1.00 80.20 C
-ATOM 7519 C SER I 7 12.378 66.104 1.820 1.00 79.65 C
-ATOM 7520 O SER I 7 12.094 66.022 0.625 1.00 80.14 O
-ATOM 7521 CB SER I 7 14.508 67.325 1.845 1.00 76.44 C
-ATOM 7522 OG SER I 7 13.722 68.434 2.195 1.00 83.32 O
-ATOM 7523 1H SER I 7 15.182 64.566 2.479 1.00 0.00 H
-ATOM 7524 2H SER I 7 13.806 64.130 1.685 1.00 0.00 H
-ATOM 7525 3H SER I 7 14.940 65.055 0.924 1.00 0.00 H
-ATOM 7526 HA SER I 7 13.812 66.025 3.384 1.00 0.00 H
-ATOM 7527 1HB SER I 7 15.469 67.413 2.332 1.00 0.00 H
-ATOM 7528 2HB SER I 7 14.664 67.307 0.769 1.00 0.00 H
-ATOM 7529 HG SER I 7 14.159 69.245 1.838 1.00 0.00 H
-ATOM 7530 N ASP I 8 11.469 66.249 2.768 1.00 77.42 N
-ATOM 7531 CA ASP I 8 10.053 66.352 2.456 1.00 75.38 C
-ATOM 7532 C ASP I 8 9.719 67.573 1.612 1.00 73.63 C
-ATOM 7533 O ASP I 8 10.423 68.592 1.645 1.00 72.68 O
-ATOM 7534 CB ASP I 8 9.186 66.321 3.725 1.00 76.79 C
-ATOM 7535 CG ASP I 8 9.031 64.886 4.299 1.00 76.50 C
-ATOM 7536 OD1 ASP I 8 9.463 63.963 3.650 1.00 68.52 O
-ATOM 7537 OD2 ASP I 8 8.459 64.724 5.339 1.00 73.95 O
-ATOM 7538 H ASP I 8 11.766 66.310 3.732 1.00 0.00 H
-ATOM 7539 HA ASP I 8 9.784 65.473 1.870 1.00 0.00 H
-ATOM 7540 1HB ASP I 8 9.643 66.955 4.487 1.00 0.00 H
-ATOM 7541 2HB ASP I 8 8.202 66.735 3.505 1.00 0.00 H
-ATOM 7542 N PHE I 9 8.636 67.437 0.861 1.00 71.39 N
-ATOM 7543 CA PHE I 9 8.114 68.473 -0.011 1.00 70.71 C
-ATOM 7544 C PHE I 9 6.619 68.551 0.120 1.00 70.33 C
-ATOM 7545 O PHE I 9 5.995 67.653 0.686 1.00 67.72 O
-ATOM 7546 CB PHE I 9 8.438 68.190 -1.486 1.00 71.53 C
-ATOM 7547 CG PHE I 9 7.797 66.970 -2.057 1.00 74.87 C
-ATOM 7548 CD1 PHE I 9 6.555 67.052 -2.657 1.00 73.13 C
-ATOM 7549 CD2 PHE I 9 8.438 65.748 -2.037 1.00 77.33 C
-ATOM 7550 CE1 PHE I 9 5.961 65.950 -3.219 1.00 78.45 C
-ATOM 7551 CE2 PHE I 9 7.842 64.644 -2.600 1.00 83.10 C
-ATOM 7552 CZ PHE I 9 6.601 64.753 -3.192 1.00 82.37 C
-ATOM 7553 H PHE I 9 8.150 66.554 0.896 1.00 0.00 H
-ATOM 7554 HA PHE I 9 8.529 69.431 0.293 1.00 0.00 H
-ATOM 7555 1HB PHE I 9 8.116 69.022 -2.091 1.00 0.00 H
-ATOM 7556 2HB PHE I 9 9.488 68.095 -1.607 1.00 0.00 H
-ATOM 7557 HD1 PHE I 9 6.047 68.011 -2.680 1.00 0.00 H
-ATOM 7558 HD2 PHE I 9 9.427 65.660 -1.574 1.00 0.00 H
-ATOM 7559 HE1 PHE I 9 4.984 66.033 -3.684 1.00 0.00 H
-ATOM 7560 HE2 PHE I 9 8.353 63.680 -2.579 1.00 0.00 H
-ATOM 7561 HZ PHE I 9 6.142 63.890 -3.633 1.00 0.00 H
-ATOM 7562 N VAL I 10 6.052 69.631 -0.398 1.00 70.85 N
-ATOM 7563 CA VAL I 10 4.610 69.810 -0.384 1.00 71.48 C
-ATOM 7564 C VAL I 10 4.110 70.060 -1.803 1.00 71.94 C
-ATOM 7565 O VAL I 10 4.851 70.572 -2.645 1.00 72.11 O
-ATOM 7566 CB VAL I 10 4.266 71.013 0.518 1.00 67.15 C
-ATOM 7567 CG1 VAL I 10 4.790 70.757 1.938 1.00 70.24 C
-ATOM 7568 CG2 VAL I 10 4.878 72.280 -0.068 1.00 53.40 C
-ATOM 7569 H VAL I 10 6.657 70.339 -0.808 1.00 0.00 H
-ATOM 7570 HA VAL I 10 4.136 68.907 0.007 1.00 0.00 H
-ATOM 7571 HB VAL I 10 3.178 71.123 0.577 1.00 0.00 H
-ATOM 7572 1HG1 VAL I 10 4.553 71.596 2.564 1.00 0.00 H
-ATOM 7573 2HG1 VAL I 10 4.336 69.852 2.342 1.00 0.00 H
-ATOM 7574 3HG1 VAL I 10 5.869 70.639 1.910 1.00 0.00 H
-ATOM 7575 1HG2 VAL I 10 4.631 73.131 0.568 1.00 0.00 H
-ATOM 7576 2HG2 VAL I 10 5.964 72.171 -0.122 1.00 0.00 H
-ATOM 7577 3HG2 VAL I 10 4.478 72.446 -1.069 1.00 0.00 H
-ATOM 7578 N VAL I 11 2.847 69.719 -2.065 1.00 72.83 N
-ATOM 7579 CA VAL I 11 2.250 69.979 -3.380 1.00 73.44 C
-ATOM 7580 C VAL I 11 1.154 71.011 -3.243 1.00 75.71 C
-ATOM 7581 O VAL I 11 0.213 70.813 -2.483 1.00 76.10 O
-ATOM 7582 CB VAL I 11 1.617 68.711 -3.975 1.00 75.17 C
-ATOM 7583 CG1 VAL I 11 0.998 69.028 -5.324 1.00 68.14 C
-ATOM 7584 CG2 VAL I 11 2.637 67.611 -4.075 1.00 82.23 C
-ATOM 7585 H VAL I 11 2.289 69.281 -1.334 1.00 0.00 H
-ATOM 7586 HA VAL I 11 3.012 70.358 -4.056 1.00 0.00 H
-ATOM 7587 HB VAL I 11 0.826 68.400 -3.346 1.00 0.00 H
-ATOM 7588 1HG1 VAL I 11 0.531 68.127 -5.715 1.00 0.00 H
-ATOM 7589 2HG1 VAL I 11 0.243 69.805 -5.201 1.00 0.00 H
-ATOM 7590 3HG1 VAL I 11 1.749 69.373 -6.014 1.00 0.00 H
-ATOM 7591 1HG2 VAL I 11 2.160 66.717 -4.478 1.00 0.00 H
-ATOM 7592 2HG2 VAL I 11 3.429 67.912 -4.723 1.00 0.00 H
-ATOM 7593 3HG2 VAL I 11 3.035 67.396 -3.094 1.00 0.00 H
-ATOM 7594 N ILE I 12 1.279 72.121 -3.961 1.00 76.75 N
-ATOM 7595 CA ILE I 12 0.308 73.197 -3.842 1.00 75.49 C
-ATOM 7596 C ILE I 12 -0.362 73.553 -5.173 1.00 75.41 C
-ATOM 7597 O ILE I 12 0.309 73.863 -6.157 1.00 73.89 O
-ATOM 7598 CB ILE I 12 1.009 74.441 -3.270 1.00 67.43 C
-ATOM 7599 CG1 ILE I 12 1.610 74.097 -1.881 1.00 65.93 C
-ATOM 7600 CG2 ILE I 12 -0.005 75.591 -3.147 1.00 72.28 C
-ATOM 7601 CD1 ILE I 12 2.553 75.105 -1.369 1.00 64.45 C
-ATOM 7602 H ILE I 12 2.081 72.238 -4.569 1.00 0.00 H
-ATOM 7603 HA ILE I 12 -0.467 72.889 -3.149 1.00 0.00 H
-ATOM 7604 HB ILE I 12 1.830 74.737 -3.925 1.00 0.00 H
-ATOM 7605 1HG1 ILE I 12 0.801 74.005 -1.180 1.00 0.00 H
-ATOM 7606 2HG1 ILE I 12 2.141 73.155 -1.931 1.00 0.00 H
-ATOM 7607 1HG2 ILE I 12 0.480 76.467 -2.739 1.00 0.00 H
-ATOM 7608 2HG2 ILE I 12 -0.411 75.828 -4.132 1.00 0.00 H
-ATOM 7609 3HG2 ILE I 12 -0.815 75.290 -2.491 1.00 0.00 H
-ATOM 7610 1HD1 ILE I 12 2.917 74.804 -0.385 1.00 0.00 H
-ATOM 7611 2HD1 ILE I 12 3.391 75.202 -2.054 1.00 0.00 H
-ATOM 7612 3HD1 ILE I 12 2.039 76.034 -1.297 1.00 0.00 H
-ATOM 7613 N LYS I 13 -1.696 73.526 -5.189 1.00 75.75 N
-ATOM 7614 CA LYS I 13 -2.464 73.890 -6.381 1.00 77.79 C
-ATOM 7615 C LYS I 13 -3.259 75.166 -6.207 1.00 79.60 C
-ATOM 7616 O LYS I 13 -4.032 75.326 -5.258 1.00 79.43 O
-ATOM 7617 CB LYS I 13 -3.413 72.786 -6.795 1.00 68.69 C
-ATOM 7618 CG LYS I 13 -4.268 73.133 -8.004 1.00 66.14 C
-ATOM 7619 CD LYS I 13 -5.188 71.992 -8.391 1.00 61.85 C
-ATOM 7620 CE LYS I 13 -6.142 72.424 -9.497 1.00 67.75 C
-ATOM 7621 NZ LYS I 13 -7.090 71.347 -9.863 1.00 61.78 N
-ATOM 7622 H LYS I 13 -2.189 73.234 -4.350 1.00 0.00 H
-ATOM 7623 HA LYS I 13 -1.766 74.056 -7.199 1.00 0.00 H
-ATOM 7624 1HB LYS I 13 -2.828 71.940 -7.070 1.00 0.00 H
-ATOM 7625 2HB LYS I 13 -4.049 72.507 -5.971 1.00 0.00 H
-ATOM 7626 1HG LYS I 13 -4.879 74.012 -7.786 1.00 0.00 H
-ATOM 7627 2HG LYS I 13 -3.618 73.372 -8.851 1.00 0.00 H
-ATOM 7628 1HD LYS I 13 -4.588 71.150 -8.754 1.00 0.00 H
-ATOM 7629 2HD LYS I 13 -5.763 71.664 -7.525 1.00 0.00 H
-ATOM 7630 1HE LYS I 13 -6.706 73.293 -9.158 1.00 0.00 H
-ATOM 7631 2HE LYS I 13 -5.563 72.699 -10.384 1.00 0.00 H
-ATOM 7632 1HZ LYS I 13 -7.715 71.668 -10.600 1.00 0.00 H
-ATOM 7633 2HZ LYS I 13 -6.552 70.541 -10.195 1.00 0.00 H
-ATOM 7634 3HZ LYS I 13 -7.635 71.087 -9.055 1.00 0.00 H
-ATOM 7635 N ALA I 14 -3.083 76.089 -7.141 1.00 81.05 N
-ATOM 7636 CA ALA I 14 -3.804 77.348 -7.051 1.00 80.94 C
-ATOM 7637 C ALA I 14 -5.279 77.165 -7.371 1.00 80.88 C
-ATOM 7638 O ALA I 14 -5.641 76.732 -8.470 1.00 80.12 O
-ATOM 7639 CB ALA I 14 -3.205 78.350 -8.010 1.00 74.62 C
-ATOM 7640 H ALA I 14 -2.439 75.917 -7.915 1.00 0.00 H
-ATOM 7641 HA ALA I 14 -3.718 77.706 -6.030 1.00 0.00 H
-ATOM 7642 1HB ALA I 14 -3.729 79.302 -7.934 1.00 0.00 H
-ATOM 7643 2HB ALA I 14 -2.167 78.490 -7.772 1.00 0.00 H
-ATOM 7644 3HB ALA I 14 -3.301 77.963 -9.014 1.00 0.00 H
-ATOM 7645 N LEU I 15 -6.153 77.552 -6.441 1.00 82.10 N
-ATOM 7646 CA LEU I 15 -7.580 77.427 -6.710 1.00 82.80 C
-ATOM 7647 C LEU I 15 -8.136 78.733 -7.274 1.00 82.69 C
-ATOM 7648 O LEU I 15 -9.290 78.796 -7.716 1.00 82.35 O
-ATOM 7649 CB LEU I 15 -8.324 76.988 -5.445 1.00 86.72 C
-ATOM 7650 CG LEU I 15 -7.928 75.587 -4.915 1.00 95.01 C
-ATOM 7651 CD1 LEU I 15 -8.672 75.309 -3.599 1.00 91.98 C
-ATOM 7652 CD2 LEU I 15 -8.232 74.548 -5.969 1.00 94.15 C
-ATOM 7653 H LEU I 15 -5.849 77.920 -5.539 1.00 0.00 H
-ATOM 7654 HA LEU I 15 -7.721 76.651 -7.459 1.00 0.00 H
-ATOM 7655 1HB LEU I 15 -8.121 77.706 -4.667 1.00 0.00 H
-ATOM 7656 2HB LEU I 15 -9.392 76.987 -5.644 1.00 0.00 H
-ATOM 7657 HG LEU I 15 -6.879 75.558 -4.725 1.00 0.00 H
-ATOM 7658 1HD1 LEU I 15 -8.388 74.328 -3.215 1.00 0.00 H
-ATOM 7659 2HD1 LEU I 15 -8.413 76.069 -2.861 1.00 0.00 H
-ATOM 7660 3HD1 LEU I 15 -9.746 75.329 -3.774 1.00 0.00 H
-ATOM 7661 1HD2 LEU I 15 -7.940 73.563 -5.606 1.00 0.00 H
-ATOM 7662 2HD2 LEU I 15 -9.299 74.554 -6.190 1.00 0.00 H
-ATOM 7663 3HD2 LEU I 15 -7.670 74.781 -6.875 1.00 0.00 H
-ATOM 7664 N GLU I 16 -7.279 79.754 -7.311 1.00 81.62 N
-ATOM 7665 CA GLU I 16 -7.607 81.077 -7.844 1.00 83.68 C
-ATOM 7666 C GLU I 16 -6.351 81.786 -8.339 1.00 85.25 C
-ATOM 7667 O GLU I 16 -5.239 81.421 -7.973 1.00 85.78 O
-ATOM 7668 CB GLU I 16 -8.320 81.937 -6.792 1.00 84.77 C
-ATOM 7669 CG GLU I 16 -7.509 82.251 -5.538 1.00 92.47 C
-ATOM 7670 CD GLU I 16 -8.316 83.037 -4.518 1.00 96.66 C
-ATOM 7671 OE1 GLU I 16 -9.432 83.391 -4.818 1.00 97.27 O
-ATOM 7672 OE2 GLU I 16 -7.837 83.236 -3.420 1.00 98.07 O
-ATOM 7673 H GLU I 16 -6.355 79.599 -6.937 1.00 0.00 H
-ATOM 7674 HA GLU I 16 -8.276 80.955 -8.692 1.00 0.00 H
-ATOM 7675 1HB GLU I 16 -8.591 82.894 -7.243 1.00 0.00 H
-ATOM 7676 2HB GLU I 16 -9.243 81.450 -6.480 1.00 0.00 H
-ATOM 7677 1HG GLU I 16 -7.156 81.323 -5.092 1.00 0.00 H
-ATOM 7678 2HG GLU I 16 -6.636 82.835 -5.829 1.00 0.00 H
-ATOM 7679 N ASP I 17 -6.514 82.790 -9.190 1.00 84.43 N
-ATOM 7680 CA ASP I 17 -5.351 83.585 -9.576 1.00 84.41 C
-ATOM 7681 C ASP I 17 -4.795 84.319 -8.354 1.00 84.63 C
-ATOM 7682 O ASP I 17 -5.564 84.925 -7.612 1.00 84.91 O
-ATOM 7683 CB ASP I 17 -5.736 84.633 -10.631 1.00 90.85 C
-ATOM 7684 CG ASP I 17 -6.071 84.084 -12.028 1.00 96.00 C
-ATOM 7685 OD1 ASP I 17 -5.774 82.943 -12.317 1.00 95.56 O
-ATOM 7686 OD2 ASP I 17 -6.646 84.823 -12.791 1.00 98.11 O
-ATOM 7687 H ASP I 17 -7.438 83.039 -9.512 1.00 0.00 H
-ATOM 7688 HA ASP I 17 -4.583 82.926 -9.964 1.00 0.00 H
-ATOM 7689 1HB ASP I 17 -6.582 85.217 -10.270 1.00 0.00 H
-ATOM 7690 2HB ASP I 17 -4.896 85.323 -10.742 1.00 0.00 H
-ATOM 7691 N GLY I 18 -3.469 84.369 -8.199 1.00 84.51 N
-ATOM 7692 CA GLY I 18 -2.892 85.161 -7.107 1.00 84.11 C
-ATOM 7693 C GLY I 18 -2.467 84.348 -5.884 1.00 83.93 C
-ATOM 7694 O GLY I 18 -2.278 84.899 -4.796 1.00 84.12 O
-ATOM 7695 H GLY I 18 -2.855 83.821 -8.801 1.00 0.00 H
-ATOM 7696 1HA GLY I 18 -2.024 85.690 -7.491 1.00 0.00 H
-ATOM 7697 2HA GLY I 18 -3.605 85.924 -6.801 1.00 0.00 H
-ATOM 7698 N VAL I 19 -2.343 83.045 -6.055 1.00 82.94 N
-ATOM 7699 CA VAL I 19 -1.902 82.170 -4.976 1.00 82.30 C
-ATOM 7700 C VAL I 19 -0.410 82.355 -4.775 1.00 82.10 C
-ATOM 7701 O VAL I 19 0.335 82.467 -5.743 1.00 81.00 O
-ATOM 7702 CB VAL I 19 -2.315 80.729 -5.266 1.00 87.23 C
-ATOM 7703 CG1 VAL I 19 -1.691 79.754 -4.272 1.00 88.20 C
-ATOM 7704 CG2 VAL I 19 -3.820 80.683 -5.136 1.00 88.21 C
-ATOM 7705 H VAL I 19 -2.493 82.656 -6.984 1.00 0.00 H
-ATOM 7706 HA VAL I 19 -2.413 82.467 -4.061 1.00 0.00 H
-ATOM 7707 HB VAL I 19 -2.022 80.462 -6.267 1.00 0.00 H
-ATOM 7708 1HG1 VAL I 19 -2.026 78.744 -4.494 1.00 0.00 H
-ATOM 7709 2HG1 VAL I 19 -0.605 79.798 -4.350 1.00 0.00 H
-ATOM 7710 3HG1 VAL I 19 -1.998 80.023 -3.262 1.00 0.00 H
-ATOM 7711 1HG2 VAL I 19 -4.183 79.707 -5.343 1.00 0.00 H
-ATOM 7712 2HG2 VAL I 19 -4.095 80.957 -4.123 1.00 0.00 H
-ATOM 7713 3HG2 VAL I 19 -4.265 81.383 -5.825 1.00 0.00 H
-ATOM 7714 N ASN I 20 0.024 82.469 -3.532 1.00 81.56 N
-ATOM 7715 CA ASN I 20 1.430 82.777 -3.292 1.00 81.99 C
-ATOM 7716 C ASN I 20 2.115 81.863 -2.302 1.00 81.61 C
-ATOM 7717 O ASN I 20 1.740 81.797 -1.130 1.00 81.52 O
-ATOM 7718 CB ASN I 20 1.602 84.221 -2.871 1.00 88.83 C
-ATOM 7719 CG ASN I 20 3.034 84.613 -2.780 1.00 97.31 C
-ATOM 7720 OD1 ASN I 20 3.923 83.767 -2.803 1.00 99.53 O
-ATOM 7721 ND2 ASN I 20 3.285 85.886 -2.677 1.00 97.85 N
-ATOM 7722 H ASN I 20 -0.630 82.340 -2.764 1.00 0.00 H
-ATOM 7723 HA ASN I 20 1.959 82.654 -4.230 1.00 0.00 H
-ATOM 7724 1HB ASN I 20 1.099 84.873 -3.587 1.00 0.00 H
-ATOM 7725 2HB ASN I 20 1.148 84.373 -1.907 1.00 0.00 H
-ATOM 7726 1HD2 ASN I 20 4.229 86.187 -2.646 1.00 0.00 H
-ATOM 7727 2HD2 ASN I 20 2.550 86.554 -2.672 1.00 0.00 H
-ATOM 7728 N VAL I 21 3.084 81.106 -2.800 1.00 80.49 N
-ATOM 7729 CA VAL I 21 3.828 80.188 -1.960 1.00 79.52 C
-ATOM 7730 C VAL I 21 5.133 80.876 -1.568 1.00 78.52 C
-ATOM 7731 O VAL I 21 5.929 81.282 -2.420 1.00 78.96 O
-ATOM 7732 CB VAL I 21 4.067 78.875 -2.700 1.00 73.90 C
-ATOM 7733 CG1 VAL I 21 4.854 77.940 -1.832 1.00 70.56 C
-ATOM 7734 CG2 VAL I 21 2.716 78.287 -3.061 1.00 68.12 C
-ATOM 7735 H VAL I 21 3.341 81.223 -3.780 1.00 0.00 H
-ATOM 7736 HA VAL I 21 3.257 79.977 -1.057 1.00 0.00 H
-ATOM 7737 HB VAL I 21 4.647 79.064 -3.601 1.00 0.00 H
-ATOM 7738 1HG1 VAL I 21 5.026 77.004 -2.353 1.00 0.00 H
-ATOM 7739 2HG1 VAL I 21 5.814 78.393 -1.575 1.00 0.00 H
-ATOM 7740 3HG1 VAL I 21 4.284 77.753 -0.930 1.00 0.00 H
-ATOM 7741 1HG2 VAL I 21 2.845 77.349 -3.594 1.00 0.00 H
-ATOM 7742 2HG2 VAL I 21 2.154 78.118 -2.154 1.00 0.00 H
-ATOM 7743 3HG2 VAL I 21 2.175 78.984 -3.688 1.00 0.00 H
-ATOM 7744 N ILE I 22 5.309 81.069 -0.271 1.00 77.27 N
-ATOM 7745 CA ILE I 22 6.391 81.888 0.237 1.00 76.13 C
-ATOM 7746 C ILE I 22 7.435 81.094 1.009 1.00 74.49 C
-ATOM 7747 O ILE I 22 7.116 80.336 1.925 1.00 73.12 O
-ATOM 7748 CB ILE I 22 5.788 82.988 1.128 1.00 74.62 C
-ATOM 7749 CG1 ILE I 22 4.805 83.817 0.303 1.00 74.36 C
-ATOM 7750 CG2 ILE I 22 6.880 83.873 1.689 1.00 68.00 C
-ATOM 7751 CD1 ILE I 22 3.953 84.749 1.114 1.00 79.59 C
-ATOM 7752 H ILE I 22 4.638 80.688 0.378 1.00 0.00 H
-ATOM 7753 HA ILE I 22 6.877 82.362 -0.606 1.00 0.00 H
-ATOM 7754 HB ILE I 22 5.234 82.538 1.918 1.00 0.00 H
-ATOM 7755 1HG1 ILE I 22 5.364 84.394 -0.431 1.00 0.00 H
-ATOM 7756 2HG1 ILE I 22 4.132 83.142 -0.224 1.00 0.00 H
-ATOM 7757 1HG2 ILE I 22 6.439 84.651 2.309 1.00 0.00 H
-ATOM 7758 2HG2 ILE I 22 7.566 83.280 2.287 1.00 0.00 H
-ATOM 7759 3HG2 ILE I 22 7.421 84.328 0.857 1.00 0.00 H
-ATOM 7760 1HD1 ILE I 22 3.279 85.287 0.449 1.00 0.00 H
-ATOM 7761 2HD1 ILE I 22 3.369 84.172 1.835 1.00 0.00 H
-ATOM 7762 3HD1 ILE I 22 4.589 85.456 1.643 1.00 0.00 H
-ATOM 7763 N GLY I 23 8.697 81.257 0.616 1.00 74.37 N
-ATOM 7764 CA GLY I 23 9.792 80.578 1.305 1.00 74.15 C
-ATOM 7765 C GLY I 23 10.334 81.455 2.428 1.00 74.59 C
-ATOM 7766 O GLY I 23 10.711 82.611 2.189 1.00 75.26 O
-ATOM 7767 H GLY I 23 8.890 81.900 -0.147 1.00 0.00 H
-ATOM 7768 1HA GLY I 23 9.444 79.628 1.712 1.00 0.00 H
-ATOM 7769 2HA GLY I 23 10.588 80.357 0.594 1.00 0.00 H
-ATOM 7770 N LEU I 24 10.413 80.875 3.637 1.00 75.01 N
-ATOM 7771 CA LEU I 24 10.908 81.542 4.851 1.00 76.44 C
-ATOM 7772 C LEU I 24 12.309 81.055 5.214 1.00 77.14 C
-ATOM 7773 O LEU I 24 12.547 79.835 5.298 1.00 77.51 O
-ATOM 7774 CB LEU I 24 9.968 81.265 6.019 1.00 76.39 C
-ATOM 7775 CG LEU I 24 8.627 82.039 6.039 1.00 80.06 C
-ATOM 7776 CD1 LEU I 24 7.702 81.538 4.930 1.00 74.99 C
-ATOM 7777 CD2 LEU I 24 7.967 81.840 7.376 1.00 77.73 C
-ATOM 7778 H LEU I 24 10.058 79.926 3.737 1.00 0.00 H
-ATOM 7779 HA LEU I 24 10.951 82.607 4.676 1.00 0.00 H
-ATOM 7780 1HB LEU I 24 9.741 80.221 5.996 1.00 0.00 H
-ATOM 7781 2HB LEU I 24 10.497 81.485 6.945 1.00 0.00 H
-ATOM 7782 HG LEU I 24 8.818 83.101 5.877 1.00 0.00 H
-ATOM 7783 1HD1 LEU I 24 6.771 82.094 4.962 1.00 0.00 H
-ATOM 7784 2HD1 LEU I 24 8.161 81.683 3.976 1.00 0.00 H
-ATOM 7785 3HD1 LEU I 24 7.495 80.477 5.072 1.00 0.00 H
-ATOM 7786 1HD2 LEU I 24 7.031 82.388 7.393 1.00 0.00 H
-ATOM 7787 2HD2 LEU I 24 7.766 80.791 7.532 1.00 0.00 H
-ATOM 7788 3HD2 LEU I 24 8.620 82.210 8.167 1.00 0.00 H
-ATOM 7789 N THR I 25 13.222 82.006 5.459 1.00 77.31 N
-ATOM 7790 CA THR I 25 14.635 81.683 5.640 1.00 77.38 C
-ATOM 7791 C THR I 25 14.951 80.795 6.824 1.00 78.12 C
-ATOM 7792 O THR I 25 14.373 80.927 7.903 1.00 79.29 O
-ATOM 7793 CB THR I 25 15.511 82.963 5.778 1.00 80.81 C
-ATOM 7794 OG1 THR I 25 15.075 83.765 6.890 1.00 86.28 O
-ATOM 7795 CG2 THR I 25 15.439 83.787 4.527 1.00 79.58 C
-ATOM 7796 H THR I 25 12.934 82.979 5.430 1.00 0.00 H
-ATOM 7797 HA THR I 25 14.959 81.172 4.743 1.00 0.00 H
-ATOM 7798 HB THR I 25 16.550 82.673 5.939 1.00 0.00 H
-ATOM 7799 HG1 THR I 25 15.687 83.657 7.672 1.00 0.00 H
-ATOM 7800 1HG2 THR I 25 16.066 84.669 4.636 1.00 0.00 H
-ATOM 7801 2HG2 THR I 25 15.793 83.188 3.695 1.00 0.00 H
-ATOM 7802 3HG2 THR I 25 14.417 84.092 4.346 1.00 0.00 H
-ATOM 7803 N ARG I 26 15.919 79.913 6.603 1.00 79.01 N
-ATOM 7804 CA ARG I 26 16.444 79.030 7.633 1.00 79.81 C
-ATOM 7805 C ARG I 26 17.519 79.728 8.452 1.00 79.81 C
-ATOM 7806 O ARG I 26 18.413 80.368 7.897 1.00 79.92 O
-ATOM 7807 CB ARG I 26 17.022 77.757 7.024 1.00 78.10 C
-ATOM 7808 CG ARG I 26 17.469 76.700 8.055 1.00 78.38 C
-ATOM 7809 CD ARG I 26 18.037 75.477 7.415 1.00 79.15 C
-ATOM 7810 NE ARG I 26 17.083 74.807 6.537 1.00 66.28 N
-ATOM 7811 CZ ARG I 26 16.136 73.942 6.938 1.00 68.22 C
-ATOM 7812 NH1 ARG I 26 16.011 73.636 8.203 1.00 67.31 N
-ATOM 7813 NH2 ARG I 26 15.338 73.406 6.046 1.00 66.49 N
-ATOM 7814 H ARG I 26 16.286 79.851 5.657 1.00 0.00 H
-ATOM 7815 HA ARG I 26 15.630 78.762 8.302 1.00 0.00 H
-ATOM 7816 1HB ARG I 26 16.279 77.295 6.373 1.00 0.00 H
-ATOM 7817 2HB ARG I 26 17.884 78.006 6.403 1.00 0.00 H
-ATOM 7818 1HG ARG I 26 18.252 77.122 8.684 1.00 0.00 H
-ATOM 7819 2HG ARG I 26 16.626 76.409 8.679 1.00 0.00 H
-ATOM 7820 1HD ARG I 26 18.910 75.746 6.831 1.00 0.00 H
-ATOM 7821 2HD ARG I 26 18.331 74.773 8.192 1.00 0.00 H
-ATOM 7822 HE ARG I 26 17.132 75.003 5.533 1.00 0.00 H
-ATOM 7823 1HH1 ARG I 26 16.634 74.043 8.877 1.00 0.00 H
-ATOM 7824 2HH1 ARG I 26 15.296 72.980 8.492 1.00 0.00 H
-ATOM 7825 1HH2 ARG I 26 15.469 73.652 5.058 1.00 0.00 H
-ATOM 7826 2HH2 ARG I 26 14.598 72.757 6.325 1.00 0.00 H
-ATOM 7827 N GLY I 27 17.444 79.594 9.772 1.00 79.84 N
-ATOM 7828 CA GLY I 27 18.442 80.192 10.649 1.00 79.26 C
-ATOM 7829 C GLY I 27 17.791 81.074 11.699 1.00 79.35 C
-ATOM 7830 O GLY I 27 16.570 81.200 11.748 1.00 78.07 O
-ATOM 7831 H GLY I 27 16.679 79.072 10.176 1.00 0.00 H
-ATOM 7832 1HA GLY I 27 19.020 79.408 11.133 1.00 0.00 H
-ATOM 7833 2HA GLY I 27 19.140 80.785 10.058 1.00 0.00 H
-ATOM 7834 N ALA I 28 18.615 81.682 12.550 1.00 80.35 N
-ATOM 7835 CA ALA I 28 18.105 82.533 13.623 1.00 82.12 C
-ATOM 7836 C ALA I 28 17.287 83.699 13.059 1.00 82.31 C
-ATOM 7837 O ALA I 28 16.287 84.108 13.651 1.00 82.05 O
-ATOM 7838 CB ALA I 28 19.262 83.070 14.450 1.00 77.61 C
-ATOM 7839 H ALA I 28 19.608 81.540 12.457 1.00 0.00 H
-ATOM 7840 HA ALA I 28 17.453 81.933 14.257 1.00 0.00 H
-ATOM 7841 1HB ALA I 28 18.871 83.688 15.257 1.00 0.00 H
-ATOM 7842 2HB ALA I 28 19.828 82.242 14.868 1.00 0.00 H
-ATOM 7843 3HB ALA I 28 19.914 83.673 13.814 1.00 0.00 H
-ATOM 7844 N ASP I 29 17.715 84.238 11.920 1.00 81.72 N
-ATOM 7845 CA ASP I 29 17.002 85.345 11.301 1.00 83.46 C
-ATOM 7846 C ASP I 29 15.993 84.819 10.280 1.00 83.70 C
-ATOM 7847 O ASP I 29 16.376 84.297 9.222 1.00 84.40 O
-ATOM 7848 CB ASP I 29 17.985 86.313 10.640 1.00 90.43 C
-ATOM 7849 CG ASP I 29 18.858 87.059 11.664 1.00 92.69 C
-ATOM 7850 OD1 ASP I 29 18.317 87.624 12.583 1.00 90.41 O
-ATOM 7851 OD2 ASP I 29 20.054 87.041 11.516 1.00 94.01 O
-ATOM 7852 H ASP I 29 18.539 83.861 11.474 1.00 0.00 H
-ATOM 7853 HA ASP I 29 16.456 85.885 12.075 1.00 0.00 H
-ATOM 7854 1HB ASP I 29 18.636 85.766 9.957 1.00 0.00 H
-ATOM 7855 2HB ASP I 29 17.432 87.047 10.051 1.00 0.00 H
-ATOM 7856 N THR I 30 14.707 84.973 10.590 1.00 83.60 N
-ATOM 7857 CA THR I 30 13.677 84.439 9.714 1.00 84.01 C
-ATOM 7858 C THR I 30 12.857 85.534 9.036 1.00 85.20 C
-ATOM 7859 O THR I 30 12.257 86.388 9.692 1.00 87.17 O
-ATOM 7860 CB THR I 30 12.725 83.489 10.461 1.00 79.77 C
-ATOM 7861 OG1 THR I 30 13.460 82.376 10.991 1.00 73.25 O
-ATOM 7862 CG2 THR I 30 11.663 82.971 9.488 1.00 73.11 C
-ATOM 7863 H THR I 30 14.451 85.422 11.459 1.00 0.00 H
-ATOM 7864 HA THR I 30 14.149 83.844 8.957 1.00 0.00 H
-ATOM 7865 HB THR I 30 12.255 84.014 11.273 1.00 0.00 H
-ATOM 7866 HG1 THR I 30 14.119 82.684 11.625 1.00 0.00 H
-ATOM 7867 1HG2 THR I 30 10.989 82.297 10.010 1.00 0.00 H
-ATOM 7868 2HG2 THR I 30 11.097 83.811 9.091 1.00 0.00 H
-ATOM 7869 3HG2 THR I 30 12.153 82.437 8.666 1.00 0.00 H
-ATOM 7870 N ARG I 31 12.811 85.475 7.712 1.00 85.73 N
-ATOM 7871 CA ARG I 31 12.031 86.403 6.896 1.00 85.75 C
-ATOM 7872 C ARG I 31 11.733 85.715 5.581 1.00 85.30 C
-ATOM 7873 O ARG I 31 12.276 84.649 5.314 1.00 84.49 O
-ATOM 7874 CB ARG I 31 12.757 87.711 6.609 1.00 45.00 C
-ATOM 7875 CG ARG I 31 13.848 87.637 5.541 1.00 45.00 C
-ATOM 7876 CD ARG I 31 15.223 87.463 6.050 1.00 45.00 C
-ATOM 7877 NE ARG I 31 16.180 87.829 4.995 1.00 45.00 N
-ATOM 7878 CZ ARG I 31 17.514 87.653 5.033 1.00 45.00 C
-ATOM 7879 NH1 ARG I 31 18.083 87.116 6.079 1.00 45.00 N
-ATOM 7880 NH2 ARG I 31 18.253 88.031 4.001 1.00 45.00 N
-ATOM 7881 H ARG I 31 13.382 84.767 7.257 1.00 0.00 H
-ATOM 7882 HA ARG I 31 11.092 86.625 7.402 1.00 0.00 H
-ATOM 7883 1HB ARG I 31 12.030 88.448 6.268 1.00 0.00 H
-ATOM 7884 2HB ARG I 31 13.204 88.095 7.524 1.00 0.00 H
-ATOM 7885 1HG ARG I 31 13.651 86.770 4.922 1.00 0.00 H
-ATOM 7886 2HG ARG I 31 13.821 88.532 4.925 1.00 0.00 H
-ATOM 7887 1HD ARG I 31 15.386 88.109 6.910 1.00 0.00 H
-ATOM 7888 2HD ARG I 31 15.393 86.422 6.332 1.00 0.00 H
-ATOM 7889 HE ARG I 31 15.794 88.250 4.161 1.00 0.00 H
-ATOM 7890 1HH1 ARG I 31 17.519 86.829 6.865 1.00 0.00 H
-ATOM 7891 2HH1 ARG I 31 19.083 86.990 6.098 1.00 0.00 H
-ATOM 7892 1HH2 ARG I 31 17.813 88.449 3.191 1.00 0.00 H
-ATOM 7893 2HH2 ARG I 31 19.255 87.903 4.023 1.00 0.00 H
-ATOM 7894 N PHE I 32 10.851 86.255 4.757 1.00 85.35 N
-ATOM 7895 CA PHE I 32 10.682 85.556 3.494 1.00 86.02 C
-ATOM 7896 C PHE I 32 11.882 85.843 2.607 1.00 86.05 C
-ATOM 7897 O PHE I 32 12.492 86.909 2.717 1.00 85.73 O
-ATOM 7898 CB PHE I 32 9.404 85.954 2.773 1.00 87.44 C
-ATOM 7899 CG PHE I 32 9.412 87.297 2.129 1.00 97.58 C
-ATOM 7900 CD1 PHE I 32 8.985 88.431 2.800 1.00 98.44 C
-ATOM 7901 CD2 PHE I 32 9.827 87.419 0.809 1.00 97.40 C
-ATOM 7902 CE1 PHE I 32 8.987 89.659 2.163 1.00 98.25 C
-ATOM 7903 CE2 PHE I 32 9.829 88.638 0.173 1.00 96.34 C
-ATOM 7904 CZ PHE I 32 9.408 89.764 0.852 1.00 98.78 C
-ATOM 7905 H PHE I 32 10.360 87.112 4.966 1.00 0.00 H
-ATOM 7906 HA PHE I 32 10.637 84.494 3.685 1.00 0.00 H
-ATOM 7907 1HB PHE I 32 9.236 85.225 1.994 1.00 0.00 H
-ATOM 7908 2HB PHE I 32 8.566 85.904 3.462 1.00 0.00 H
-ATOM 7909 HD1 PHE I 32 8.642 88.359 3.837 1.00 0.00 H
-ATOM 7910 HD2 PHE I 32 10.153 86.530 0.275 1.00 0.00 H
-ATOM 7911 HE1 PHE I 32 8.647 90.547 2.707 1.00 0.00 H
-ATOM 7912 HE2 PHE I 32 10.159 88.713 -0.862 1.00 0.00 H
-ATOM 7913 HZ PHE I 32 9.406 90.732 0.354 1.00 0.00 H
-ATOM 7914 N HIS I 33 12.198 84.930 1.702 1.00 84.29 N
-ATOM 7915 CA HIS I 33 13.256 85.198 0.739 1.00 81.02 C
-ATOM 7916 C HIS I 33 12.732 85.013 -0.667 1.00 78.60 C
-ATOM 7917 O HIS I 33 13.335 85.481 -1.632 1.00 78.03 O
-ATOM 7918 CB HIS I 33 14.456 84.283 0.971 1.00 81.95 C
-ATOM 7919 CG HIS I 33 14.189 82.827 0.733 1.00 83.18 C
-ATOM 7920 ND1 HIS I 33 14.223 82.278 -0.527 1.00 80.96 N
-ATOM 7921 CD2 HIS I 33 13.870 81.812 1.574 1.00 83.70 C
-ATOM 7922 CE1 HIS I 33 13.947 80.995 -0.454 1.00 83.03 C
-ATOM 7923 NE2 HIS I 33 13.730 80.685 0.807 1.00 86.76 N
-ATOM 7924 H HIS I 33 11.691 84.054 1.692 1.00 0.00 H
-ATOM 7925 HA HIS I 33 13.591 86.230 0.835 1.00 0.00 H
-ATOM 7926 1HB HIS I 33 15.261 84.583 0.299 1.00 0.00 H
-ATOM 7927 2HB HIS I 33 14.813 84.415 1.969 1.00 0.00 H
-ATOM 7928 HD2 HIS I 33 13.746 81.874 2.650 1.00 0.00 H
-ATOM 7929 HE1 HIS I 33 13.907 80.306 -1.299 1.00 0.00 H
-ATOM 7930 HE2 HIS I 33 13.497 79.759 1.139 1.00 0.00 H
-ATOM 7931 N HIS I 34 11.572 84.376 -0.783 1.00 77.53 N
-ATOM 7932 CA HIS I 34 11.010 84.149 -2.106 1.00 78.43 C
-ATOM 7933 C HIS I 34 9.506 84.061 -2.110 1.00 80.11 C
-ATOM 7934 O HIS I 34 8.889 83.400 -1.278 1.00 81.10 O
-ATOM 7935 CB HIS I 34 11.580 82.895 -2.771 1.00 83.94 C
-ATOM 7936 CG HIS I 34 11.067 82.709 -4.183 1.00 82.24 C
-ATOM 7937 ND1 HIS I 34 11.450 83.532 -5.221 1.00 82.21 N
-ATOM 7938 CD2 HIS I 34 10.212 81.799 -4.719 1.00 82.65 C
-ATOM 7939 CE1 HIS I 34 10.848 83.141 -6.338 1.00 81.26 C
-ATOM 7940 NE2 HIS I 34 10.094 82.092 -6.061 1.00 81.92 N
-ATOM 7941 H HIS I 34 11.127 84.001 0.053 1.00 0.00 H
-ATOM 7942 HA HIS I 34 11.274 84.992 -2.744 1.00 0.00 H
-ATOM 7943 1HB HIS I 34 12.670 82.968 -2.814 1.00 0.00 H
-ATOM 7944 2HB HIS I 34 11.331 82.015 -2.179 1.00 0.00 H
-ATOM 7945 HD2 HIS I 34 9.712 80.990 -4.193 1.00 0.00 H
-ATOM 7946 HE1 HIS I 34 10.962 83.607 -7.316 1.00 0.00 H
-ATOM 7947 HE2 HIS I 34 9.507 81.574 -6.737 1.00 0.00 H
-ATOM 7948 N SER I 35 8.926 84.731 -3.093 1.00 79.71 N
-ATOM 7949 CA SER I 35 7.490 84.786 -3.314 1.00 80.84 C
-ATOM 7950 C SER I 35 7.123 84.202 -4.674 1.00 80.83 C
-ATOM 7951 O SER I 35 7.382 84.826 -5.706 1.00 81.90 O
-ATOM 7952 CB SER I 35 7.073 86.243 -3.260 1.00 87.78 C
-ATOM 7953 OG SER I 35 5.734 86.419 -3.582 1.00 95.90 O
-ATOM 7954 H SER I 35 9.526 85.233 -3.736 1.00 0.00 H
-ATOM 7955 HA SER I 35 6.983 84.210 -2.533 1.00 0.00 H
-ATOM 7956 1HB SER I 35 7.273 86.648 -2.267 1.00 0.00 H
-ATOM 7957 2HB SER I 35 7.683 86.799 -3.970 1.00 0.00 H
-ATOM 7958 HG SER I 35 5.543 85.747 -4.250 1.00 0.00 H
-ATOM 7959 N GLU I 36 6.524 83.011 -4.687 1.00 80.56 N
-ATOM 7960 CA GLU I 36 6.179 82.373 -5.954 1.00 81.21 C
-ATOM 7961 C GLU I 36 4.695 82.551 -6.230 1.00 81.55 C
-ATOM 7962 O GLU I 36 3.851 82.021 -5.507 1.00 82.87 O
-ATOM 7963 CB GLU I 36 6.537 80.884 -5.952 1.00 71.28 C
-ATOM 7964 CG GLU I 36 6.298 80.176 -7.290 1.00 69.13 C
-ATOM 7965 CD GLU I 36 7.244 80.615 -8.384 1.00 76.47 C
-ATOM 7966 OE1 GLU I 36 8.406 80.838 -8.102 1.00 73.12 O
-ATOM 7967 OE2 GLU I 36 6.808 80.719 -9.518 1.00 77.29 O
-ATOM 7968 H GLU I 36 6.318 82.524 -3.816 1.00 0.00 H
-ATOM 7969 HA GLU I 36 6.735 82.863 -6.752 1.00 0.00 H
-ATOM 7970 1HB GLU I 36 7.579 80.753 -5.685 1.00 0.00 H
-ATOM 7971 2HB GLU I 36 5.941 80.372 -5.197 1.00 0.00 H
-ATOM 7972 1HG GLU I 36 6.431 79.116 -7.159 1.00 0.00 H
-ATOM 7973 2HG GLU I 36 5.268 80.357 -7.597 1.00 0.00 H
-ATOM 7974 N LYS I 37 4.376 83.319 -7.262 1.00 80.99 N
-ATOM 7975 CA LYS I 37 2.988 83.602 -7.608 1.00 81.78 C
-ATOM 7976 C LYS I 37 2.432 82.581 -8.592 1.00 81.80 C
-ATOM 7977 O LYS I 37 3.037 82.321 -9.637 1.00 82.05 O
-ATOM 7978 CB LYS I 37 2.860 85.009 -8.193 1.00 83.44 C
-ATOM 7979 CG LYS I 37 1.428 85.422 -8.532 1.00 74.93 C
-ATOM 7980 CD LYS I 37 1.369 86.845 -9.096 1.00 73.03 C
-ATOM 7981 CE LYS I 37 -0.049 87.233 -9.497 1.00 45.00 C
-ATOM 7982 NZ LYS I 37 -0.105 88.597 -10.093 1.00 45.00 N
-ATOM 7983 H LYS I 37 5.120 83.720 -7.817 1.00 0.00 H
-ATOM 7984 HA LYS I 37 2.387 83.550 -6.698 1.00 0.00 H
-ATOM 7985 1HB LYS I 37 3.253 85.733 -7.478 1.00 0.00 H
-ATOM 7986 2HB LYS I 37 3.460 85.086 -9.100 1.00 0.00 H
-ATOM 7987 1HG LYS I 37 1.022 84.729 -9.271 1.00 0.00 H
-ATOM 7988 2HG LYS I 37 0.814 85.362 -7.632 1.00 0.00 H
-ATOM 7989 1HD LYS I 37 1.734 87.553 -8.349 1.00 0.00 H
-ATOM 7990 2HD LYS I 37 2.010 86.911 -9.976 1.00 0.00 H
-ATOM 7991 1HE LYS I 37 -0.427 86.510 -10.225 1.00 0.00 H
-ATOM 7992 2HE LYS I 37 -0.685 87.211 -8.618 1.00 0.00 H
-ATOM 7993 1HZ LYS I 37 -1.060 88.814 -10.344 1.00 0.00 H
-ATOM 7994 2HZ LYS I 37 0.232 89.279 -9.423 1.00 0.00 H
-ATOM 7995 3HZ LYS I 37 0.476 88.625 -10.922 1.00 0.00 H
-ATOM 7996 N LEU I 38 1.287 81.993 -8.247 1.00 83.81 N
-ATOM 7997 CA LEU I 38 0.638 81.011 -9.096 1.00 84.34 C
-ATOM 7998 C LEU I 38 -0.689 81.572 -9.634 1.00 84.81 C
-ATOM 7999 O LEU I 38 -1.429 82.277 -8.923 1.00 84.98 O
-ATOM 8000 CB LEU I 38 0.338 79.716 -8.304 1.00 45.00 C
-ATOM 8001 CG LEU I 38 1.538 78.840 -7.757 1.00 45.00 C
-ATOM 8002 CD1 LEU I 38 2.528 78.574 -8.861 1.00 45.00 C
-ATOM 8003 CD2 LEU I 38 2.199 79.533 -6.574 1.00 45.00 C
-ATOM 8004 H LEU I 38 0.856 82.242 -7.368 1.00 0.00 H
-ATOM 8005 HA LEU I 38 1.288 80.781 -9.939 1.00 0.00 H
-ATOM 8006 1HB LEU I 38 -0.256 79.984 -7.455 1.00 0.00 H
-ATOM 8007 2HB LEU I 38 -0.258 79.073 -8.946 1.00 0.00 H
-ATOM 8008 HG LEU I 38 1.147 77.877 -7.424 1.00 0.00 H
-ATOM 8009 1HD1 LEU I 38 3.339 77.958 -8.492 1.00 0.00 H
-ATOM 8010 2HD1 LEU I 38 2.027 78.063 -9.678 1.00 0.00 H
-ATOM 8011 3HD1 LEU I 38 2.931 79.523 -9.217 1.00 0.00 H
-ATOM 8012 1HD2 LEU I 38 3.012 78.916 -6.187 1.00 0.00 H
-ATOM 8013 2HD2 LEU I 38 2.595 80.474 -6.888 1.00 0.00 H
-ATOM 8014 3HD2 LEU I 38 1.464 79.698 -5.790 1.00 0.00 H
-ATOM 8015 N ASP I 39 -1.016 81.203 -10.867 1.00 84.30 N
-ATOM 8016 CA ASP I 39 -2.298 81.533 -11.478 1.00 85.21 C
-ATOM 8017 C ASP I 39 -3.252 80.352 -11.334 1.00 85.34 C
-ATOM 8018 O ASP I 39 -2.816 79.249 -10.994 1.00 85.72 O
-ATOM 8019 CB ASP I 39 -2.153 81.926 -12.953 1.00 93.95 C
-ATOM 8020 CG ASP I 39 -1.427 83.293 -13.197 1.00 96.64 C
-ATOM 8021 OD1 ASP I 39 -1.416 84.132 -12.312 1.00 98.87 O
-ATOM 8022 OD2 ASP I 39 -0.910 83.474 -14.275 1.00100.09 O
-ATOM 8023 H ASP I 39 -0.341 80.648 -11.401 1.00 0.00 H
-ATOM 8024 HA ASP I 39 -2.723 82.384 -10.951 1.00 0.00 H
-ATOM 8025 1HB ASP I 39 -1.601 81.141 -13.475 1.00 0.00 H
-ATOM 8026 2HB ASP I 39 -3.148 81.978 -13.405 1.00 0.00 H
-ATOM 8027 N LYS I 40 -4.538 80.568 -11.593 1.00 85.18 N
-ATOM 8028 CA LYS I 40 -5.524 79.499 -11.483 1.00 85.08 C
-ATOM 8029 C LYS I 40 -5.047 78.236 -12.180 1.00 86.09 C
-ATOM 8030 O LYS I 40 -4.740 78.258 -13.373 1.00 84.94 O
-ATOM 8031 CB LYS I 40 -6.826 79.945 -12.173 1.00 48.00 C
-ATOM 8032 CG LYS I 40 -7.998 78.936 -12.191 1.00 45.00 C
-ATOM 8033 CD LYS I 40 -8.736 78.881 -10.882 1.00 45.00 C
-ATOM 8034 CE LYS I 40 -9.942 77.941 -10.948 1.00 45.00 C
-ATOM 8035 NZ LYS I 40 -10.833 78.110 -9.760 1.00 45.00 N
-ATOM 8036 H LYS I 40 -4.861 81.501 -11.861 1.00 0.00 H
-ATOM 8037 HA LYS I 40 -5.697 79.279 -10.428 1.00 0.00 H
-ATOM 8038 1HB LYS I 40 -7.188 80.850 -11.682 1.00 0.00 H
-ATOM 8039 2HB LYS I 40 -6.607 80.217 -13.206 1.00 0.00 H
-ATOM 8040 1HG LYS I 40 -8.699 79.220 -12.976 1.00 0.00 H
-ATOM 8041 2HG LYS I 40 -7.617 77.941 -12.417 1.00 0.00 H
-ATOM 8042 1HD LYS I 40 -8.054 78.517 -10.115 1.00 0.00 H
-ATOM 8043 2HD LYS I 40 -9.076 79.874 -10.605 1.00 0.00 H
-ATOM 8044 1HE LYS I 40 -10.514 78.132 -11.856 1.00 0.00 H
-ATOM 8045 2HE LYS I 40 -9.578 76.912 -10.968 1.00 0.00 H
-ATOM 8046 1HZ LYS I 40 -11.611 77.471 -9.813 1.00 0.00 H
-ATOM 8047 2HZ LYS I 40 -10.303 77.945 -8.900 1.00 0.00 H
-ATOM 8048 3HZ LYS I 40 -11.177 79.057 -9.739 1.00 0.00 H
-ATOM 8049 N GLY I 41 -5.022 77.122 -11.451 1.00 86.07 N
-ATOM 8050 CA GLY I 41 -4.663 75.839 -12.036 1.00 86.60 C
-ATOM 8051 C GLY I 41 -3.180 75.463 -11.992 1.00 86.28 C
-ATOM 8052 O GLY I 41 -2.829 74.317 -12.287 1.00 86.58 O
-ATOM 8053 H GLY I 41 -5.256 77.150 -10.458 1.00 0.00 H
-ATOM 8054 1HA GLY I 41 -5.242 75.061 -11.541 1.00 0.00 H
-ATOM 8055 2HA GLY I 41 -4.982 75.848 -13.074 1.00 0.00 H
-ATOM 8056 N GLU I 42 -2.291 76.382 -11.635 1.00 85.94 N
-ATOM 8057 CA GLU I 42 -0.884 75.983 -11.627 1.00 85.86 C
-ATOM 8058 C GLU I 42 -0.569 75.129 -10.404 1.00 86.20 C
-ATOM 8059 O GLU I 42 -1.132 75.330 -9.320 1.00 85.91 O
-ATOM 8060 CB GLU I 42 0.067 77.192 -11.705 1.00 88.73 C
-ATOM 8061 CG GLU I 42 0.031 77.948 -13.044 1.00 93.71 C
-ATOM 8062 CD GLU I 42 1.060 79.074 -13.157 1.00 93.89 C
-ATOM 8063 OE1 GLU I 42 1.011 79.988 -12.374 1.00 96.49 O
-ATOM 8064 OE2 GLU I 42 1.894 79.008 -14.035 1.00 96.44 O
-ATOM 8065 H GLU I 42 -2.578 77.331 -11.400 1.00 0.00 H
-ATOM 8066 HA GLU I 42 -0.698 75.371 -12.512 1.00 0.00 H
-ATOM 8067 1HB GLU I 42 -0.178 77.898 -10.919 1.00 0.00 H
-ATOM 8068 2HB GLU I 42 1.091 76.853 -11.547 1.00 0.00 H
-ATOM 8069 1HG GLU I 42 0.206 77.231 -13.848 1.00 0.00 H
-ATOM 8070 2HG GLU I 42 -0.971 78.361 -13.179 1.00 0.00 H
-ATOM 8071 N VAL I 43 0.343 74.167 -10.581 1.00 85.08 N
-ATOM 8072 CA VAL I 43 0.762 73.313 -9.469 1.00 82.35 C
-ATOM 8073 C VAL I 43 2.244 73.476 -9.165 1.00 81.11 C
-ATOM 8074 O VAL I 43 3.088 73.422 -10.058 1.00 82.59 O
-ATOM 8075 CB VAL I 43 0.437 71.818 -9.754 1.00 86.06 C
-ATOM 8076 CG1 VAL I 43 0.961 70.924 -8.615 1.00 93.03 C
-ATOM 8077 CG2 VAL I 43 -1.081 71.638 -9.866 1.00 81.83 C
-ATOM 8078 H VAL I 43 0.759 74.037 -11.505 1.00 0.00 H
-ATOM 8079 HA VAL I 43 0.203 73.606 -8.585 1.00 0.00 H
-ATOM 8080 HB VAL I 43 0.919 71.514 -10.681 1.00 0.00 H
-ATOM 8081 1HG1 VAL I 43 0.725 69.882 -8.828 1.00 0.00 H
-ATOM 8082 2HG1 VAL I 43 2.041 71.036 -8.524 1.00 0.00 H
-ATOM 8083 3HG1 VAL I 43 0.485 71.221 -7.677 1.00 0.00 H
-ATOM 8084 1HG2 VAL I 43 -1.321 70.593 -10.067 1.00 0.00 H
-ATOM 8085 2HG2 VAL I 43 -1.533 71.936 -8.935 1.00 0.00 H
-ATOM 8086 3HG2 VAL I 43 -1.467 72.261 -10.670 1.00 0.00 H
-ATOM 8087 N LEU I 44 2.554 73.710 -7.895 1.00 79.07 N
-ATOM 8088 CA LEU I 44 3.933 73.871 -7.457 1.00 76.65 C
-ATOM 8089 C LEU I 44 4.301 72.800 -6.448 1.00 76.09 C
-ATOM 8090 O LEU I 44 3.624 72.623 -5.437 1.00 76.63 O
-ATOM 8091 CB LEU I 44 4.141 75.248 -6.817 1.00 63.77 C
-ATOM 8092 CG LEU I 44 5.561 75.534 -6.272 1.00 62.07 C
-ATOM 8093 CD1 LEU I 44 6.564 75.600 -7.438 1.00 59.04 C
-ATOM 8094 CD2 LEU I 44 5.527 76.826 -5.490 1.00 62.92 C
-ATOM 8095 H LEU I 44 1.804 73.765 -7.213 1.00 0.00 H
-ATOM 8096 HA LEU I 44 4.593 73.773 -8.315 1.00 0.00 H
-ATOM 8097 1HB LEU I 44 3.923 75.998 -7.561 1.00 0.00 H
-ATOM 8098 2HB LEU I 44 3.435 75.363 -5.993 1.00 0.00 H
-ATOM 8099 HG LEU I 44 5.875 74.721 -5.614 1.00 0.00 H
-ATOM 8100 1HD1 LEU I 44 7.560 75.794 -7.049 1.00 0.00 H
-ATOM 8101 2HD1 LEU I 44 6.564 74.652 -7.973 1.00 0.00 H
-ATOM 8102 3HD1 LEU I 44 6.280 76.403 -8.118 1.00 0.00 H
-ATOM 8103 1HD2 LEU I 44 6.518 77.045 -5.088 1.00 0.00 H
-ATOM 8104 2HD2 LEU I 44 5.209 77.633 -6.133 1.00 0.00 H
-ATOM 8105 3HD2 LEU I 44 4.824 76.720 -4.680 1.00 0.00 H
-ATOM 8106 N ILE I 45 5.362 72.070 -6.732 1.00 73.11 N
-ATOM 8107 CA ILE I 45 5.811 71.035 -5.828 1.00 68.81 C
-ATOM 8108 C ILE I 45 7.154 71.488 -5.271 1.00 67.41 C
-ATOM 8109 O ILE I 45 8.082 71.734 -6.039 1.00 66.88 O
-ATOM 8110 CB ILE I 45 5.943 69.706 -6.569 1.00 63.00 C
-ATOM 8111 CG1 ILE I 45 4.604 69.382 -7.215 1.00 55.67 C
-ATOM 8112 CG2 ILE I 45 6.296 68.637 -5.571 1.00 68.69 C
-ATOM 8113 CD1 ILE I 45 4.609 68.200 -8.108 1.00 52.58 C
-ATOM 8114 H ILE I 45 5.866 72.232 -7.594 1.00 0.00 H
-ATOM 8115 HA ILE I 45 5.106 70.927 -5.013 1.00 0.00 H
-ATOM 8116 HB ILE I 45 6.700 69.778 -7.347 1.00 0.00 H
-ATOM 8117 1HG1 ILE I 45 3.888 69.231 -6.443 1.00 0.00 H
-ATOM 8118 2HG1 ILE I 45 4.293 70.239 -7.812 1.00 0.00 H
-ATOM 8119 1HG2 ILE I 45 6.376 67.670 -6.063 1.00 0.00 H
-ATOM 8120 2HG2 ILE I 45 7.236 68.882 -5.086 1.00 0.00 H
-ATOM 8121 3HG2 ILE I 45 5.521 68.604 -4.827 1.00 0.00 H
-ATOM 8122 1HD1 ILE I 45 3.612 68.067 -8.514 1.00 0.00 H
-ATOM 8123 2HD1 ILE I 45 5.321 68.351 -8.923 1.00 0.00 H
-ATOM 8124 3HD1 ILE I 45 4.888 67.324 -7.535 1.00 0.00 H
-ATOM 8125 N ALA I 46 7.273 71.639 -3.953 1.00 66.79 N
-ATOM 8126 CA ALA I 46 8.521 72.226 -3.458 1.00 66.73 C
-ATOM 8127 C ALA I 46 9.042 71.614 -2.173 1.00 66.02 C
-ATOM 8128 O ALA I 46 8.290 71.325 -1.241 1.00 65.37 O
-ATOM 8129 CB ALA I 46 8.307 73.715 -3.233 1.00 73.33 C
-ATOM 8130 H ALA I 46 6.500 71.387 -3.340 1.00 0.00 H
-ATOM 8131 HA ALA I 46 9.285 72.080 -4.215 1.00 0.00 H
-ATOM 8132 1HB ALA I 46 9.246 74.164 -2.905 1.00 0.00 H
-ATOM 8133 2HB ALA I 46 7.983 74.183 -4.163 1.00 0.00 H
-ATOM 8134 3HB ALA I 46 7.545 73.860 -2.469 1.00 0.00 H
-ATOM 8135 N GLN I 47 10.369 71.445 -2.144 1.00 66.32 N
-ATOM 8136 CA GLN I 47 11.101 70.870 -1.019 1.00 67.06 C
-ATOM 8137 C GLN I 47 11.541 71.872 0.015 1.00 66.88 C
-ATOM 8138 O GLN I 47 11.764 73.046 -0.284 1.00 67.22 O
-ATOM 8139 CB GLN I 47 12.370 70.161 -1.495 1.00 77.05 C
-ATOM 8140 CG GLN I 47 12.164 68.944 -2.349 1.00 76.63 C
-ATOM 8141 CD GLN I 47 13.462 68.304 -2.718 1.00 80.34 C
-ATOM 8142 OE1 GLN I 47 14.431 68.984 -3.080 1.00 82.11 O
-ATOM 8143 NE2 GLN I 47 13.506 66.980 -2.626 1.00 76.69 N
-ATOM 8144 H GLN I 47 10.911 71.711 -2.967 1.00 0.00 H
-ATOM 8145 HA GLN I 47 10.467 70.147 -0.524 1.00 0.00 H
-ATOM 8146 1HB GLN I 47 12.980 70.871 -2.057 1.00 0.00 H
-ATOM 8147 2HB GLN I 47 12.949 69.856 -0.622 1.00 0.00 H
-ATOM 8148 1HG GLN I 47 11.621 68.216 -1.766 1.00 0.00 H
-ATOM 8149 2HG GLN I 47 11.616 69.206 -3.259 1.00 0.00 H
-ATOM 8150 1HE2 GLN I 47 14.344 66.483 -2.858 1.00 0.00 H
-ATOM 8151 2HE2 GLN I 47 12.689 66.475 -2.330 1.00 0.00 H
-ATOM 8152 N PHE I 48 11.767 71.375 1.222 1.00 67.24 N
-ATOM 8153 CA PHE I 48 12.420 72.189 2.228 1.00 68.11 C
-ATOM 8154 C PHE I 48 13.920 72.041 1.968 1.00 68.84 C
-ATOM 8155 O PHE I 48 14.399 70.948 1.617 1.00 70.67 O
-ATOM 8156 CB PHE I 48 12.018 71.754 3.618 1.00 73.02 C
-ATOM 8157 CG PHE I 48 10.569 72.054 3.908 1.00 76.77 C
-ATOM 8158 CD1 PHE I 48 10.169 73.296 4.362 1.00 76.55 C
-ATOM 8159 CD2 PHE I 48 9.599 71.078 3.713 1.00 78.97 C
-ATOM 8160 CE1 PHE I 48 8.836 73.544 4.600 1.00 74.65 C
-ATOM 8161 CE2 PHE I 48 8.273 71.336 3.952 1.00 78.64 C
-ATOM 8162 CZ PHE I 48 7.897 72.575 4.391 1.00 79.42 C
-ATOM 8163 H PHE I 48 11.497 70.412 1.432 1.00 0.00 H
-ATOM 8164 HA PHE I 48 12.136 73.236 2.097 1.00 0.00 H
-ATOM 8165 1HB PHE I 48 12.184 70.687 3.725 1.00 0.00 H
-ATOM 8166 2HB PHE I 48 12.635 72.275 4.352 1.00 0.00 H
-ATOM 8167 HD1 PHE I 48 10.917 74.079 4.520 1.00 0.00 H
-ATOM 8168 HD2 PHE I 48 9.901 70.102 3.359 1.00 0.00 H
-ATOM 8169 HE1 PHE I 48 8.524 74.504 4.941 1.00 0.00 H
-ATOM 8170 HE2 PHE I 48 7.525 70.561 3.789 1.00 0.00 H
-ATOM 8171 HZ PHE I 48 6.864 72.799 4.567 1.00 0.00 H
-ATOM 8172 N THR I 49 14.655 73.155 2.069 1.00 69.23 N
-ATOM 8173 CA THR I 49 16.063 73.157 1.662 1.00 69.46 C
-ATOM 8174 C THR I 49 16.976 73.782 2.701 1.00 71.39 C
-ATOM 8175 O THR I 49 16.549 74.225 3.765 1.00 71.30 O
-ATOM 8176 CB THR I 49 16.293 73.965 0.366 1.00 60.70 C
-ATOM 8177 OG1 THR I 49 16.202 75.356 0.672 1.00 63.11 O
-ATOM 8178 CG2 THR I 49 15.240 73.621 -0.676 1.00 53.78 C
-ATOM 8179 H THR I 49 14.224 74.001 2.441 1.00 0.00 H
-ATOM 8180 HA THR I 49 16.378 72.123 1.502 1.00 0.00 H
-ATOM 8181 HB THR I 49 17.280 73.751 -0.039 1.00 0.00 H
-ATOM 8182 HG1 THR I 49 16.864 75.536 1.331 1.00 0.00 H
-ATOM 8183 1HG2 THR I 49 15.417 74.214 -1.569 1.00 0.00 H
-ATOM 8184 2HG2 THR I 49 15.286 72.562 -0.926 1.00 0.00 H
-ATOM 8185 3HG2 THR I 49 14.253 73.853 -0.282 1.00 0.00 H
-ATOM 8186 N GLU I 50 18.241 73.896 2.332 1.00 74.51 N
-ATOM 8187 CA GLU I 50 19.261 74.553 3.136 1.00 78.21 C
-ATOM 8188 C GLU I 50 18.884 75.995 3.507 1.00 79.93 C
-ATOM 8189 O GLU I 50 19.341 76.505 4.527 1.00 82.27 O
-ATOM 8190 CB GLU I 50 20.594 74.542 2.384 1.00 84.50 C
-ATOM 8191 CG GLU I 50 21.759 75.145 3.143 1.00 87.26 C
-ATOM 8192 CD GLU I 50 23.077 75.010 2.405 1.00 84.80 C
-ATOM 8193 OE1 GLU I 50 23.082 74.473 1.322 1.00 89.36 O
-ATOM 8194 OE2 GLU I 50 24.076 75.443 2.930 1.00 87.54 O
-ATOM 8195 H GLU I 50 18.520 73.500 1.448 1.00 0.00 H
-ATOM 8196 HA GLU I 50 19.380 73.989 4.062 1.00 0.00 H
-ATOM 8197 1HB GLU I 50 20.859 73.515 2.133 1.00 0.00 H
-ATOM 8198 2HB GLU I 50 20.487 75.090 1.447 1.00 0.00 H
-ATOM 8199 1HG GLU I 50 21.552 76.205 3.304 1.00 0.00 H
-ATOM 8200 2HG GLU I 50 21.836 74.665 4.117 1.00 0.00 H
-ATOM 8201 N HIS I 51 18.113 76.676 2.646 1.00 79.98 N
-ATOM 8202 CA HIS I 51 17.763 78.072 2.895 1.00 82.09 C
-ATOM 8203 C HIS I 51 16.295 78.296 3.285 1.00 81.98 C
-ATOM 8204 O HIS I 51 15.957 79.387 3.737 1.00 81.71 O
-ATOM 8205 CB HIS I 51 18.086 78.918 1.653 1.00 85.88 C
-ATOM 8206 CG HIS I 51 19.548 78.946 1.323 1.00 87.16 C
-ATOM 8207 ND1 HIS I 51 20.168 77.940 0.617 1.00 87.69 N
-ATOM 8208 CD2 HIS I 51 20.508 79.857 1.600 1.00 85.67 C
-ATOM 8209 CE1 HIS I 51 21.453 78.224 0.487 1.00 85.83 C
-ATOM 8210 NE2 HIS I 51 21.684 79.385 1.070 1.00 85.59 N
-ATOM 8211 H HIS I 51 17.735 76.216 1.830 1.00 0.00 H
-ATOM 8212 HA HIS I 51 18.375 78.446 3.715 1.00 0.00 H
-ATOM 8213 1HB HIS I 51 17.545 78.522 0.792 1.00 0.00 H
-ATOM 8214 2HB HIS I 51 17.747 79.944 1.809 1.00 0.00 H
-ATOM 8215 HD2 HIS I 51 20.374 80.791 2.145 1.00 0.00 H
-ATOM 8216 HE1 HIS I 51 22.196 77.602 -0.017 1.00 0.00 H
-ATOM 8217 HE2 HIS I 51 22.579 79.851 1.125 1.00 0.00 H
-ATOM 8218 N THR I 52 15.434 77.276 3.131 1.00 81.48 N
-ATOM 8219 CA THR I 52 13.998 77.405 3.441 1.00 79.42 C
-ATOM 8220 C THR I 52 13.568 76.449 4.553 1.00 78.44 C
-ATOM 8221 O THR I 52 13.574 75.226 4.368 1.00 77.99 O
-ATOM 8222 CB THR I 52 13.100 77.101 2.216 1.00 76.29 C
-ATOM 8223 OG1 THR I 52 13.401 77.998 1.136 1.00 75.85 O
-ATOM 8224 CG2 THR I 52 11.608 77.237 2.606 1.00 77.92 C
-ATOM 8225 H THR I 52 15.781 76.395 2.790 1.00 0.00 H
-ATOM 8226 HA THR I 52 13.805 78.422 3.775 1.00 0.00 H
-ATOM 8227 HB THR I 52 13.282 76.079 1.878 1.00 0.00 H
-ATOM 8228 HG1 THR I 52 14.223 77.721 0.714 1.00 0.00 H
-ATOM 8229 1HG2 THR I 52 10.978 77.016 1.746 1.00 0.00 H
-ATOM 8230 2HG2 THR I 52 11.371 76.539 3.412 1.00 0.00 H
-ATOM 8231 3HG2 THR I 52 11.412 78.253 2.945 1.00 0.00 H
-ATOM 8232 N SER I 53 13.137 77.017 5.683 1.00 76.95 N
-ATOM 8233 CA SER I 53 12.716 76.221 6.839 1.00 74.91 C
-ATOM 8234 C SER I 53 11.205 76.133 6.941 1.00 74.00 C
-ATOM 8235 O SER I 53 10.662 75.272 7.643 1.00 73.18 O
-ATOM 8236 CB SER I 53 13.268 76.797 8.118 1.00 72.53 C
-ATOM 8237 OG SER I 53 12.762 78.077 8.367 1.00 64.07 O
-ATOM 8238 H SER I 53 13.115 78.036 5.732 1.00 0.00 H
-ATOM 8239 HA SER I 53 13.103 75.207 6.720 1.00 0.00 H
-ATOM 8240 1HB SER I 53 13.012 76.140 8.939 1.00 0.00 H
-ATOM 8241 2HB SER I 53 14.340 76.832 8.051 1.00 0.00 H
-ATOM 8242 HG SER I 53 12.822 78.563 7.529 1.00 0.00 H
-ATOM 8243 N ALA I 54 10.522 77.031 6.245 1.00 73.43 N
-ATOM 8244 CA ALA I 54 9.070 77.009 6.290 1.00 72.36 C
-ATOM 8245 C ALA I 54 8.474 77.524 4.991 1.00 71.86 C
-ATOM 8246 O ALA I 54 9.054 78.378 4.310 1.00 71.16 O
-ATOM 8247 CB ALA I 54 8.558 77.808 7.473 1.00 71.31 C
-ATOM 8248 H ALA I 54 11.022 77.743 5.714 1.00 0.00 H
-ATOM 8249 HA ALA I 54 8.753 75.981 6.422 1.00 0.00 H
-ATOM 8250 1HB ALA I 54 7.476 77.741 7.498 1.00 0.00 H
-ATOM 8251 2HB ALA I 54 8.972 77.399 8.391 1.00 0.00 H
-ATOM 8252 3HB ALA I 54 8.853 78.826 7.382 1.00 0.00 H
-ATOM 8253 N ILE I 55 7.288 77.010 4.673 1.00 72.65 N
-ATOM 8254 CA ILE I 55 6.527 77.431 3.509 1.00 74.54 C
-ATOM 8255 C ILE I 55 5.168 77.988 3.899 1.00 76.50 C
-ATOM 8256 O ILE I 55 4.374 77.333 4.573 1.00 77.41 O
-ATOM 8257 CB ILE I 55 6.353 76.275 2.499 1.00 75.78 C
-ATOM 8258 CG1 ILE I 55 7.740 75.817 1.977 1.00 75.84 C
-ATOM 8259 CG2 ILE I 55 5.462 76.717 1.356 1.00 74.50 C
-ATOM 8260 CD1 ILE I 55 7.710 74.534 1.146 1.00 72.88 C
-ATOM 8261 H ILE I 55 6.890 76.309 5.294 1.00 0.00 H
-ATOM 8262 HA ILE I 55 7.080 78.220 3.011 1.00 0.00 H
-ATOM 8263 HB ILE I 55 5.893 75.422 3.002 1.00 0.00 H
-ATOM 8264 1HG1 ILE I 55 8.157 76.619 1.364 1.00 0.00 H
-ATOM 8265 2HG1 ILE I 55 8.398 75.662 2.818 1.00 0.00 H
-ATOM 8266 1HG2 ILE I 55 5.338 75.897 0.649 1.00 0.00 H
-ATOM 8267 2HG2 ILE I 55 4.486 77.016 1.736 1.00 0.00 H
-ATOM 8268 3HG2 ILE I 55 5.931 77.566 0.857 1.00 0.00 H
-ATOM 8269 1HD1 ILE I 55 8.725 74.288 0.819 1.00 0.00 H
-ATOM 8270 2HD1 ILE I 55 7.318 73.715 1.746 1.00 0.00 H
-ATOM 8271 3HD1 ILE I 55 7.075 74.677 0.274 1.00 0.00 H
-ATOM 8272 N LYS I 56 4.909 79.213 3.482 1.00 77.25 N
-ATOM 8273 CA LYS I 56 3.653 79.871 3.804 1.00 77.73 C
-ATOM 8274 C LYS I 56 2.822 79.992 2.541 1.00 78.33 C
-ATOM 8275 O LYS I 56 3.347 80.344 1.490 1.00 78.59 O
-ATOM 8276 CB LYS I 56 3.946 81.216 4.452 1.00 77.12 C
-ATOM 8277 CG LYS I 56 2.772 82.014 4.898 1.00 45.00 C
-ATOM 8278 CD LYS I 56 3.277 83.267 5.564 1.00 45.00 C
-ATOM 8279 CE LYS I 56 2.171 84.098 6.141 1.00 45.00 C
-ATOM 8280 NZ LYS I 56 2.714 85.316 6.798 1.00 45.00 N
-ATOM 8281 H LYS I 56 5.615 79.698 2.930 1.00 0.00 H
-ATOM 8282 HA LYS I 56 3.100 79.259 4.512 1.00 0.00 H
-ATOM 8283 1HB LYS I 56 4.562 81.050 5.330 1.00 0.00 H
-ATOM 8284 2HB LYS I 56 4.515 81.824 3.786 1.00 0.00 H
-ATOM 8285 1HG LYS I 56 2.151 82.284 4.038 1.00 0.00 H
-ATOM 8286 2HG LYS I 56 2.165 81.441 5.606 1.00 0.00 H
-ATOM 8287 1HD LYS I 56 3.954 82.999 6.378 1.00 0.00 H
-ATOM 8288 2HD LYS I 56 3.833 83.861 4.834 1.00 0.00 H
-ATOM 8289 1HE LYS I 56 1.470 84.384 5.353 1.00 0.00 H
-ATOM 8290 2HE LYS I 56 1.635 83.509 6.883 1.00 0.00 H
-ATOM 8291 1HZ LYS I 56 1.944 85.842 7.201 1.00 0.00 H
-ATOM 8292 2HZ LYS I 56 3.387 85.042 7.546 1.00 0.00 H
-ATOM 8293 3HZ LYS I 56 3.199 85.885 6.118 1.00 0.00 H
-ATOM 8294 N VAL I 57 1.545 79.639 2.611 1.00 78.18 N
-ATOM 8295 CA VAL I 57 0.726 79.683 1.411 1.00 79.59 C
-ATOM 8296 C VAL I 57 -0.450 80.650 1.545 1.00 81.15 C
-ATOM 8297 O VAL I 57 -1.282 80.521 2.453 1.00 81.93 O
-ATOM 8298 CB VAL I 57 0.203 78.267 1.099 1.00 80.01 C
-ATOM 8299 CG1 VAL I 57 -0.635 78.282 -0.187 1.00 63.38 C
-ATOM 8300 CG2 VAL I 57 1.380 77.330 1.013 1.00 77.49 C
-ATOM 8301 H VAL I 57 1.150 79.325 3.491 1.00 0.00 H
-ATOM 8302 HA VAL I 57 1.344 80.013 0.579 1.00 0.00 H
-ATOM 8303 HB VAL I 57 -0.454 77.938 1.903 1.00 0.00 H
-ATOM 8304 1HG1 VAL I 57 -1.006 77.279 -0.392 1.00 0.00 H
-ATOM 8305 2HG1 VAL I 57 -1.482 78.965 -0.071 1.00 0.00 H
-ATOM 8306 3HG1 VAL I 57 -0.015 78.618 -1.018 1.00 0.00 H
-ATOM 8307 1HG2 VAL I 57 1.027 76.324 0.806 1.00 0.00 H
-ATOM 8308 2HG2 VAL I 57 2.038 77.670 0.219 1.00 0.00 H
-ATOM 8309 3HG2 VAL I 57 1.923 77.331 1.958 1.00 0.00 H
-ATOM 8310 N ARG I 58 -0.519 81.613 0.611 1.00 81.48 N
-ATOM 8311 CA ARG I 58 -1.596 82.604 0.602 1.00 81.20 C
-ATOM 8312 C ARG I 58 -2.557 82.344 -0.551 1.00 81.64 C
-ATOM 8313 O ARG I 58 -2.144 81.875 -1.611 1.00 81.05 O
-ATOM 8314 CB ARG I 58 -1.124 84.030 0.361 1.00 83.56 C
-ATOM 8315 CG ARG I 58 -0.173 84.647 1.328 1.00 88.04 C
-ATOM 8316 CD ARG I 58 -0.172 86.119 1.104 1.00 90.07 C
-ATOM 8317 NE ARG I 58 0.304 86.508 -0.213 1.00 98.20 N
-ATOM 8318 CZ ARG I 58 -0.552 86.835 -1.222 1.00 98.07 C
-ATOM 8319 NH1 ARG I 58 -1.845 86.729 -1.012 1.00 99.19 N
-ATOM 8320 NH2 ARG I 58 -0.118 87.258 -2.408 1.00 93.25 N
-ATOM 8321 H ARG I 58 0.214 81.665 -0.090 1.00 0.00 H
-ATOM 8322 HA ARG I 58 -2.141 82.550 1.544 1.00 0.00 H
-ATOM 8323 1HB ARG I 58 -0.671 84.087 -0.617 1.00 0.00 H
-ATOM 8324 2HB ARG I 58 -2.000 84.677 0.341 1.00 0.00 H
-ATOM 8325 1HG ARG I 58 -0.464 84.427 2.337 1.00 0.00 H
-ATOM 8326 2HG ARG I 58 0.828 84.250 1.142 1.00 0.00 H
-ATOM 8327 1HD ARG I 58 -1.193 86.490 1.214 1.00 0.00 H
-ATOM 8328 2HD ARG I 58 0.459 86.594 1.857 1.00 0.00 H
-ATOM 8329 HE ARG I 58 1.308 86.592 -0.363 1.00 0.00 H
-ATOM 8330 1HH1 ARG I 58 -2.179 86.398 -0.119 1.00 0.00 H
-ATOM 8331 2HH1 ARG I 58 -2.503 86.958 -1.746 1.00 0.00 H
-ATOM 8332 1HH2 ARG I 58 0.868 87.368 -2.585 1.00 0.00 H
-ATOM 8333 2HH2 ARG I 58 -0.786 87.489 -3.132 1.00 0.00 H
-ATOM 8334 N GLY I 59 -3.818 82.732 -0.379 1.00 81.62 N
-ATOM 8335 CA GLY I 59 -4.803 82.636 -1.455 1.00 81.62 C
-ATOM 8336 C GLY I 59 -5.444 81.268 -1.409 1.00 82.24 C
-ATOM 8337 O GLY I 59 -4.891 80.360 -0.795 1.00 83.94 O
-ATOM 8338 H GLY I 59 -4.112 83.097 0.519 1.00 0.00 H
-ATOM 8339 1HA GLY I 59 -5.563 83.408 -1.339 1.00 0.00 H
-ATOM 8340 2HA GLY I 59 -4.324 82.793 -2.419 1.00 0.00 H
-ATOM 8341 N LYS I 60 -6.598 81.108 -2.036 1.00 82.80 N
-ATOM 8342 CA LYS I 60 -7.246 79.802 -1.986 1.00 85.10 C
-ATOM 8343 C LYS I 60 -6.370 78.778 -2.679 1.00 86.39 C
-ATOM 8344 O LYS I 60 -5.925 78.990 -3.810 1.00 86.47 O
-ATOM 8345 CB LYS I 60 -8.636 79.866 -2.610 1.00 47.18 C
-ATOM 8346 CG LYS I 60 -9.600 80.704 -1.800 1.00 45.00 C
-ATOM 8347 CD LYS I 60 -10.963 80.805 -2.442 1.00 45.00 C
-ATOM 8348 CE LYS I 60 -11.883 81.665 -1.584 1.00 45.00 C
-ATOM 8349 NZ LYS I 60 -13.246 81.816 -2.181 1.00 45.00 N
-ATOM 8350 H LYS I 60 -7.025 81.885 -2.541 1.00 0.00 H
-ATOM 8351 HA LYS I 60 -7.350 79.499 -0.940 1.00 0.00 H
-ATOM 8352 1HB LYS I 60 -8.587 80.265 -3.617 1.00 0.00 H
-ATOM 8353 2HB LYS I 60 -9.046 78.860 -2.676 1.00 0.00 H
-ATOM 8354 1HG LYS I 60 -9.706 80.263 -0.808 1.00 0.00 H
-ATOM 8355 2HG LYS I 60 -9.191 81.709 -1.679 1.00 0.00 H
-ATOM 8356 1HD LYS I 60 -10.851 81.276 -3.426 1.00 0.00 H
-ATOM 8357 2HD LYS I 60 -11.389 79.813 -2.573 1.00 0.00 H
-ATOM 8358 1HE LYS I 60 -11.971 81.209 -0.596 1.00 0.00 H
-ATOM 8359 2HE LYS I 60 -11.432 82.652 -1.476 1.00 0.00 H
-ATOM 8360 1HZ LYS I 60 -13.812 82.398 -1.578 1.00 0.00 H
-ATOM 8361 2HZ LYS I 60 -13.166 82.251 -3.092 1.00 0.00 H
-ATOM 8362 3HZ LYS I 60 -13.678 80.910 -2.277 1.00 0.00 H
-ATOM 8363 N ALA I 61 -6.128 77.670 -2.006 1.00 85.10 N
-ATOM 8364 CA ALA I 61 -5.234 76.662 -2.563 1.00 83.16 C
-ATOM 8365 C ALA I 61 -5.467 75.290 -1.942 1.00 82.07 C
-ATOM 8366 O ALA I 61 -5.890 75.167 -0.787 1.00 80.89 O
-ATOM 8367 CB ALA I 61 -3.786 77.085 -2.359 1.00 78.99 C
-ATOM 8368 H ALA I 61 -6.560 77.560 -1.090 1.00 0.00 H
-ATOM 8369 HA ALA I 61 -5.415 76.600 -3.626 1.00 0.00 H
-ATOM 8370 1HB ALA I 61 -3.124 76.351 -2.814 1.00 0.00 H
-ATOM 8371 2HB ALA I 61 -3.634 78.051 -2.829 1.00 0.00 H
-ATOM 8372 3HB ALA I 61 -3.568 77.166 -1.301 1.00 0.00 H
-ATOM 8373 N TYR I 62 -5.128 74.258 -2.703 1.00 79.90 N
-ATOM 8374 CA TYR I 62 -5.176 72.874 -2.239 1.00 78.44 C
-ATOM 8375 C TYR I 62 -3.767 72.396 -1.961 1.00 76.90 C
-ATOM 8376 O TYR I 62 -2.904 72.462 -2.844 1.00 75.69 O
-ATOM 8377 CB TYR I 62 -5.874 72.003 -3.288 1.00 80.13 C
-ATOM 8378 CG TYR I 62 -5.918 70.501 -3.006 1.00 82.73 C
-ATOM 8379 CD1 TYR I 62 -6.795 69.970 -2.074 1.00 84.02 C
-ATOM 8380 CD2 TYR I 62 -5.094 69.654 -3.724 1.00 83.85 C
-ATOM 8381 CE1 TYR I 62 -6.848 68.608 -1.856 1.00 86.20 C
-ATOM 8382 CE2 TYR I 62 -5.150 68.291 -3.517 1.00 85.40 C
-ATOM 8383 CZ TYR I 62 -6.024 67.767 -2.584 1.00 87.50 C
-ATOM 8384 OH TYR I 62 -6.100 66.407 -2.387 1.00 89.49 O
-ATOM 8385 H TYR I 62 -4.793 74.457 -3.646 1.00 0.00 H
-ATOM 8386 HA TYR I 62 -5.737 72.831 -1.303 1.00 0.00 H
-ATOM 8387 1HB TYR I 62 -6.902 72.348 -3.400 1.00 0.00 H
-ATOM 8388 2HB TYR I 62 -5.391 72.147 -4.240 1.00 0.00 H
-ATOM 8389 HD1 TYR I 62 -7.449 70.618 -1.523 1.00 0.00 H
-ATOM 8390 HD2 TYR I 62 -4.411 70.066 -4.460 1.00 0.00 H
-ATOM 8391 HE1 TYR I 62 -7.549 68.202 -1.125 1.00 0.00 H
-ATOM 8392 HE2 TYR I 62 -4.508 67.633 -4.095 1.00 0.00 H
-ATOM 8393 HH TYR I 62 -5.701 65.952 -3.130 1.00 0.00 H
-ATOM 8394 N ILE I 63 -3.507 71.952 -0.736 1.00 74.43 N
-ATOM 8395 CA ILE I 63 -2.161 71.559 -0.364 1.00 75.27 C
-ATOM 8396 C ILE I 63 -2.060 70.095 0.090 1.00 75.08 C
-ATOM 8397 O ILE I 63 -2.816 69.641 0.958 1.00 75.78 O
-ATOM 8398 CB ILE I 63 -1.615 72.490 0.743 1.00 80.77 C
-ATOM 8399 CG1 ILE I 63 -1.692 73.974 0.306 1.00 79.24 C
-ATOM 8400 CG2 ILE I 63 -0.186 72.110 1.074 1.00 81.47 C
-ATOM 8401 CD1 ILE I 63 -2.915 74.709 0.853 1.00 76.00 C
-ATOM 8402 H ILE I 63 -4.240 71.911 -0.027 1.00 0.00 H
-ATOM 8403 HA ILE I 63 -1.527 71.688 -1.231 1.00 0.00 H
-ATOM 8404 HB ILE I 63 -2.227 72.393 1.614 1.00 0.00 H
-ATOM 8405 1HG1 ILE I 63 -0.799 74.493 0.651 1.00 0.00 H
-ATOM 8406 2HG1 ILE I 63 -1.722 74.021 -0.777 1.00 0.00 H
-ATOM 8407 1HG2 ILE I 63 0.178 72.763 1.849 1.00 0.00 H
-ATOM 8408 2HG2 ILE I 63 -0.154 71.085 1.413 1.00 0.00 H
-ATOM 8409 3HG2 ILE I 63 0.439 72.213 0.192 1.00 0.00 H
-ATOM 8410 1HD1 ILE I 63 -2.910 75.741 0.512 1.00 0.00 H
-ATOM 8411 2HD1 ILE I 63 -3.827 74.218 0.511 1.00 0.00 H
-ATOM 8412 3HD1 ILE I 63 -2.892 74.691 1.939 1.00 0.00 H
-ATOM 8413 N GLN I 64 -1.125 69.343 -0.500 1.00 75.05 N
-ATOM 8414 CA GLN I 64 -0.914 67.946 -0.101 1.00 73.48 C
-ATOM 8415 C GLN I 64 0.424 67.869 0.632 1.00 72.48 C
-ATOM 8416 O GLN I 64 1.437 68.380 0.138 1.00 72.99 O
-ATOM 8417 CB GLN I 64 -0.868 67.014 -1.324 1.00 65.09 C
-ATOM 8418 CG GLN I 64 -2.081 67.099 -2.241 1.00 60.52 C
-ATOM 8419 CD GLN I 64 -1.965 66.241 -3.525 1.00 58.32 C
-ATOM 8420 OE1 GLN I 64 -1.004 66.358 -4.285 1.00 55.54 O
-ATOM 8421 NE2 GLN I 64 -2.973 65.403 -3.764 1.00 54.92 N
-ATOM 8422 H GLN I 64 -0.552 69.756 -1.228 1.00 0.00 H
-ATOM 8423 HA GLN I 64 -1.702 67.636 0.580 1.00 0.00 H
-ATOM 8424 1HB GLN I 64 0.025 67.161 -1.877 1.00 0.00 H
-ATOM 8425 2HB GLN I 64 -0.835 65.982 -0.964 1.00 0.00 H
-ATOM 8426 1HG GLN I 64 -2.964 66.785 -1.704 1.00 0.00 H
-ATOM 8427 2HG GLN I 64 -2.187 68.142 -2.545 1.00 0.00 H
-ATOM 8428 1HE2 GLN I 64 -2.999 64.832 -4.611 1.00 0.00 H
-ATOM 8429 2HE2 GLN I 64 -3.729 65.340 -3.119 1.00 0.00 H
-ATOM 8430 N THR I 65 0.437 67.258 1.816 1.00 71.71 N
-ATOM 8431 CA THR I 65 1.665 67.122 2.587 1.00 71.12 C
-ATOM 8432 C THR I 65 1.776 65.701 3.114 1.00 71.02 C
-ATOM 8433 O THR I 65 0.859 64.891 2.982 1.00 70.55 O
-ATOM 8434 CB THR I 65 1.730 68.067 3.809 1.00 69.35 C
-ATOM 8435 OG1 THR I 65 0.862 67.577 4.838 1.00 61.94 O
-ATOM 8436 CG2 THR I 65 1.281 69.469 3.421 1.00 71.42 C
-ATOM 8437 H THR I 65 -0.427 66.864 2.195 1.00 0.00 H
-ATOM 8438 HA THR I 65 2.523 67.314 1.941 1.00 0.00 H
-ATOM 8439 HB THR I 65 2.749 68.113 4.182 1.00 0.00 H
-ATOM 8440 HG1 THR I 65 0.900 66.618 4.849 1.00 0.00 H
-ATOM 8441 1HG2 THR I 65 1.329 70.120 4.289 1.00 0.00 H
-ATOM 8442 2HG2 THR I 65 1.927 69.857 2.638 1.00 0.00 H
-ATOM 8443 3HG2 THR I 65 0.254 69.436 3.060 1.00 0.00 H
-ATOM 8444 N ARG I 66 2.875 65.409 3.796 1.00 71.22 N
-ATOM 8445 CA ARG I 66 3.065 64.111 4.434 1.00 71.27 C
-ATOM 8446 C ARG I 66 1.962 63.753 5.425 1.00 71.49 C
-ATOM 8447 O ARG I 66 1.768 62.582 5.734 1.00 70.34 O
-ATOM 8448 CB ARG I 66 4.406 63.984 5.139 1.00 71.08 C
-ATOM 8449 CG ARG I 66 4.653 62.579 5.695 1.00 76.83 C
-ATOM 8450 CD ARG I 66 6.067 62.320 6.149 1.00 78.25 C
-ATOM 8451 NE ARG I 66 6.471 63.079 7.339 1.00 87.19 N
-ATOM 8452 CZ ARG I 66 7.680 62.926 7.934 1.00 45.00 C
-ATOM 8453 NH1 ARG I 66 8.531 62.047 7.448 1.00 45.00 N
-ATOM 8454 NH2 ARG I 66 8.032 63.627 8.994 1.00 45.00 N
-ATOM 8455 H ARG I 66 3.602 66.105 3.868 1.00 0.00 H
-ATOM 8456 HA ARG I 66 3.043 63.355 3.637 1.00 0.00 H
-ATOM 8457 1HB ARG I 66 5.222 64.237 4.464 1.00 0.00 H
-ATOM 8458 2HB ARG I 66 4.440 64.663 5.989 1.00 0.00 H
-ATOM 8459 1HG ARG I 66 3.996 62.423 6.552 1.00 0.00 H
-ATOM 8460 2HG ARG I 66 4.413 61.846 4.921 1.00 0.00 H
-ATOM 8461 1HD ARG I 66 6.165 61.262 6.379 1.00 0.00 H
-ATOM 8462 2HD ARG I 66 6.755 62.576 5.339 1.00 0.00 H
-ATOM 8463 HE ARG I 66 5.829 63.761 7.722 1.00 0.00 H
-ATOM 8464 1HH1 ARG I 66 8.284 61.506 6.635 1.00 0.00 H
-ATOM 8465 2HH1 ARG I 66 9.435 61.928 7.880 1.00 0.00 H
-ATOM 8466 1HH2 ARG I 66 7.419 64.333 9.418 1.00 0.00 H
-ATOM 8467 2HH2 ARG I 66 8.935 63.479 9.410 1.00 0.00 H
-ATOM 8468 N HIS I 67 1.284 64.764 5.995 1.00 72.63 N
-ATOM 8469 CA HIS I 67 0.318 64.456 7.045 1.00 73.73 C
-ATOM 8470 C HIS I 67 -1.117 64.397 6.521 1.00 74.97 C
-ATOM 8471 O HIS I 67 -2.065 64.363 7.309 1.00 76.99 O
-ATOM 8472 CB HIS I 67 0.398 65.509 8.157 1.00 65.78 C
-ATOM 8473 CG HIS I 67 1.756 65.603 8.793 1.00 66.08 C
-ATOM 8474 ND1 HIS I 67 2.510 64.498 9.123 1.00 66.88 N
-ATOM 8475 CD2 HIS I 67 2.476 66.680 9.181 1.00 60.13 C
-ATOM 8476 CE1 HIS I 67 3.648 64.899 9.669 1.00 62.77 C
-ATOM 8477 NE2 HIS I 67 3.644 66.215 9.721 1.00 64.15 N
-ATOM 8478 H HIS I 67 1.400 65.724 5.691 1.00 0.00 H
-ATOM 8479 HA HIS I 67 0.549 63.488 7.479 1.00 0.00 H
-ATOM 8480 1HB HIS I 67 0.134 66.492 7.760 1.00 0.00 H
-ATOM 8481 2HB HIS I 67 -0.324 65.266 8.939 1.00 0.00 H
-ATOM 8482 HD2 HIS I 67 2.187 67.716 9.095 1.00 0.00 H
-ATOM 8483 HE1 HIS I 67 4.448 64.253 10.030 1.00 0.00 H
-ATOM 8484 HE2 HIS I 67 4.385 66.817 10.105 1.00 0.00 H
-ATOM 8485 N GLY I 68 -1.290 64.379 5.196 1.00 75.33 N
-ATOM 8486 CA GLY I 68 -2.629 64.350 4.620 1.00 76.50 C
-ATOM 8487 C GLY I 68 -2.823 65.573 3.741 1.00 76.93 C
-ATOM 8488 O GLY I 68 -1.860 66.087 3.171 1.00 74.63 O
-ATOM 8489 H GLY I 68 -0.484 64.401 4.573 1.00 0.00 H
-ATOM 8490 1HA GLY I 68 -2.757 63.440 4.036 1.00 0.00 H
-ATOM 8491 2HA GLY I 68 -3.376 64.337 5.413 1.00 0.00 H
-ATOM 8492 N VAL I 69 -4.063 66.025 3.581 1.00 78.39 N
-ATOM 8493 CA VAL I 69 -4.276 67.189 2.732 1.00 81.69 C
-ATOM 8494 C VAL I 69 -4.934 68.291 3.534 1.00 83.09 C
-ATOM 8495 O VAL I 69 -5.529 68.036 4.585 1.00 83.44 O
-ATOM 8496 CB VAL I 69 -5.153 66.856 1.514 1.00 80.97 C
-ATOM 8497 CG1 VAL I 69 -4.486 65.788 0.680 1.00 77.43 C
-ATOM 8498 CG2 VAL I 69 -6.517 66.418 1.968 1.00 77.06 C
-ATOM 8499 H VAL I 69 -4.837 65.574 4.049 1.00 0.00 H
-ATOM 8500 HA VAL I 69 -3.318 67.554 2.376 1.00 0.00 H
-ATOM 8501 HB VAL I 69 -5.240 67.750 0.891 1.00 0.00 H
-ATOM 8502 1HG1 VAL I 69 -5.096 65.579 -0.193 1.00 0.00 H
-ATOM 8503 2HG1 VAL I 69 -3.514 66.136 0.371 1.00 0.00 H
-ATOM 8504 3HG1 VAL I 69 -4.373 64.879 1.263 1.00 0.00 H
-ATOM 8505 1HG2 VAL I 69 -7.136 66.201 1.098 1.00 0.00 H
-ATOM 8506 2HG2 VAL I 69 -6.425 65.525 2.584 1.00 0.00 H
-ATOM 8507 3HG2 VAL I 69 -6.972 67.220 2.551 1.00 0.00 H
-ATOM 8508 N ILE I 70 -4.800 69.518 3.047 1.00 84.21 N
-ATOM 8509 CA ILE I 70 -5.415 70.641 3.726 1.00 85.32 C
-ATOM 8510 C ILE I 70 -5.790 71.717 2.701 1.00 86.92 C
-ATOM 8511 O ILE I 70 -5.147 71.849 1.662 1.00 87.00 O
-ATOM 8512 CB ILE I 70 -4.437 71.175 4.793 1.00 85.89 C
-ATOM 8513 CG1 ILE I 70 -5.144 72.089 5.759 1.00 84.78 C
-ATOM 8514 CG2 ILE I 70 -3.299 71.908 4.105 1.00 83.84 C
-ATOM 8515 CD1 ILE I 70 -4.343 72.317 7.010 1.00 79.57 C
-ATOM 8516 H ILE I 70 -4.260 69.668 2.203 1.00 0.00 H
-ATOM 8517 HA ILE I 70 -6.324 70.310 4.218 1.00 0.00 H
-ATOM 8518 HB ILE I 70 -4.036 70.345 5.370 1.00 0.00 H
-ATOM 8519 1HG1 ILE I 70 -5.342 73.054 5.292 1.00 0.00 H
-ATOM 8520 2HG1 ILE I 70 -6.095 71.633 6.039 1.00 0.00 H
-ATOM 8521 1HG2 ILE I 70 -2.593 72.278 4.838 1.00 0.00 H
-ATOM 8522 2HG2 ILE I 70 -2.798 71.208 3.436 1.00 0.00 H
-ATOM 8523 3HG2 ILE I 70 -3.701 72.746 3.530 1.00 0.00 H
-ATOM 8524 1HD1 ILE I 70 -4.901 72.941 7.678 1.00 0.00 H
-ATOM 8525 2HD1 ILE I 70 -4.151 71.360 7.495 1.00 0.00 H
-ATOM 8526 3HD1 ILE I 70 -3.402 72.792 6.758 1.00 0.00 H
-ATOM 8527 N GLU I 71 -6.836 72.470 2.986 1.00 87.83 N
-ATOM 8528 CA GLU I 71 -7.198 73.529 2.053 1.00 88.54 C
-ATOM 8529 C GLU I 71 -7.190 74.889 2.707 1.00 88.59 C
-ATOM 8530 O GLU I 71 -7.649 75.069 3.839 1.00 89.84 O
-ATOM 8531 CB GLU I 71 -8.586 73.269 1.450 1.00 90.92 C
-ATOM 8532 CG GLU I 71 -8.647 72.030 0.588 1.00 93.57 C
-ATOM 8533 CD GLU I 71 -9.990 71.793 -0.037 1.00 97.01 C
-ATOM 8534 OE1 GLU I 71 -10.884 72.561 0.210 1.00 98.79 O
-ATOM 8535 OE2 GLU I 71 -10.123 70.837 -0.763 1.00 97.14 O
-ATOM 8536 H GLU I 71 -7.361 72.318 3.830 1.00 0.00 H
-ATOM 8537 HA GLU I 71 -6.470 73.546 1.239 1.00 0.00 H
-ATOM 8538 1HB GLU I 71 -9.327 73.172 2.249 1.00 0.00 H
-ATOM 8539 2HB GLU I 71 -8.882 74.122 0.832 1.00 0.00 H
-ATOM 8540 1HG GLU I 71 -7.919 72.173 -0.194 1.00 0.00 H
-ATOM 8541 2HG GLU I 71 -8.361 71.156 1.170 1.00 0.00 H
-ATOM 8542 N SER I 72 -6.698 75.856 1.951 1.00 88.23 N
-ATOM 8543 CA SER I 72 -6.707 77.253 2.307 1.00 88.88 C
-ATOM 8544 C SER I 72 -8.001 77.842 1.766 1.00 90.65 C
-ATOM 8545 O SER I 72 -8.347 77.580 0.596 1.00 88.92 O
-ATOM 8546 CB SER I 72 -5.507 77.914 1.710 1.00 86.16 C
-ATOM 8547 OG SER I 72 -5.520 77.687 0.346 1.00 88.94 O
-ATOM 8548 H SER I 72 -6.321 75.598 1.041 1.00 0.00 H
-ATOM 8549 HA SER I 72 -6.687 77.353 3.398 1.00 0.00 H
-ATOM 8550 1HB SER I 72 -5.520 78.975 1.903 1.00 0.00 H
-ATOM 8551 2HB SER I 72 -4.596 77.509 2.153 1.00 0.00 H
-ATOM 8552 HG SER I 72 -5.450 76.718 0.241 1.00 0.00 H
-ATOM 8553 N GLU I 73 -8.686 78.657 2.559 1.00 92.35 N
-ATOM 8554 CA GLU I 73 -9.988 79.211 2.174 1.00 94.17 C
-ATOM 8555 C GLU I 73 -10.017 80.736 2.183 1.00 94.92 C
-ATOM 8556 O GLU I 73 -9.054 81.390 1.762 1.00 96.37 O
-ATOM 8557 OXT GLU I 73 -11.081 81.300 2.486 1.00 0.00 O
-ATOM 8558 CB GLU I 73 -11.104 78.648 3.066 1.00 94.79 C
-ATOM 8559 CG GLU I 73 -11.257 77.137 2.944 1.00 95.00 C
-ATOM 8560 CD GLU I 73 -12.313 76.552 3.828 1.00 97.43 C
-ATOM 8561 OE1 GLU I 73 -13.465 76.602 3.474 1.00 98.60 O
-ATOM 8562 OE2 GLU I 73 -11.954 76.035 4.873 1.00 98.19 O
-ATOM 8563 H GLU I 73 -8.268 78.866 3.465 1.00 0.00 H
-ATOM 8564 HA GLU I 73 -10.210 78.885 1.151 1.00 0.00 H
-ATOM 8565 1HB GLU I 73 -10.912 78.891 4.111 1.00 0.00 H
-ATOM 8566 2HB GLU I 73 -12.067 79.114 2.797 1.00 0.00 H
-ATOM 8567 1HG GLU I 73 -11.492 76.898 1.898 1.00 0.00 H
-ATOM 8568 2HG GLU I 73 -10.310 76.662 3.183 1.00 0.00 H
-TER
-ATOM 8570 N SER J 7 14.382 65.904 9.706 1.00 78.91 N
-ATOM 8571 CA SER J 7 13.728 67.149 10.084 1.00 80.17 C
-ATOM 8572 C SER J 7 12.235 67.062 9.830 1.00 79.74 C
-ATOM 8573 O SER J 7 11.792 67.090 8.680 1.00 80.73 O
-ATOM 8574 CB SER J 7 14.326 68.303 9.305 1.00 82.70 C
-ATOM 8575 OG SER J 7 13.686 69.506 9.609 1.00 89.88 O
-ATOM 8576 1H SER J 7 15.127 65.697 10.354 1.00 0.00 H
-ATOM 8577 2H SER J 7 13.702 65.159 9.725 1.00 0.00 H
-ATOM 8578 3H SER J 7 14.757 65.992 8.773 1.00 0.00 H
-ATOM 8579 HA SER J 7 13.889 67.322 11.150 1.00 0.00 H
-ATOM 8580 1HB SER J 7 15.383 68.392 9.530 1.00 0.00 H
-ATOM 8581 2HB SER J 7 14.237 68.096 8.238 1.00 0.00 H
-ATOM 8582 HG SER J 7 13.939 69.740 10.521 1.00 0.00 H
-ATOM 8583 N ASP J 8 11.458 66.915 10.905 1.00 77.85 N
-ATOM 8584 CA ASP J 8 10.005 66.791 10.795 1.00 75.99 C
-ATOM 8585 C ASP J 8 9.375 68.172 10.684 1.00 75.14 C
-ATOM 8586 O ASP J 8 10.052 69.185 10.858 1.00 73.78 O
-ATOM 8587 CB ASP J 8 9.437 66.041 12.014 1.00 78.53 C
-ATOM 8588 CG ASP J 8 8.127 65.262 11.712 1.00 74.89 C
-ATOM 8589 OD1 ASP J 8 7.449 65.597 10.761 1.00 69.81 O
-ATOM 8590 OD2 ASP J 8 7.835 64.329 12.415 1.00 68.83 O
-ATOM 8591 H ASP J 8 11.879 66.906 11.821 1.00 0.00 H
-ATOM 8592 HA ASP J 8 9.763 66.233 9.891 1.00 0.00 H
-ATOM 8593 1HB ASP J 8 10.181 65.336 12.384 1.00 0.00 H
-ATOM 8594 2HB ASP J 8 9.234 66.752 12.813 1.00 0.00 H
-ATOM 8595 N PHE J 9 8.069 68.194 10.428 1.00 73.35 N
-ATOM 8596 CA PHE J 9 7.338 69.449 10.284 1.00 73.03 C
-ATOM 8597 C PHE J 9 5.902 69.374 10.758 1.00 72.11 C
-ATOM 8598 O PHE J 9 5.330 68.291 10.929 1.00 72.58 O
-ATOM 8599 CB PHE J 9 7.323 69.906 8.815 1.00 63.13 C
-ATOM 8600 CG PHE J 9 6.557 69.028 7.867 1.00 62.28 C
-ATOM 8601 CD1 PHE J 9 5.233 69.309 7.582 1.00 64.36 C
-ATOM 8602 CD2 PHE J 9 7.144 67.944 7.241 1.00 65.30 C
-ATOM 8603 CE1 PHE J 9 4.518 68.545 6.691 1.00 68.73 C
-ATOM 8604 CE2 PHE J 9 6.418 67.176 6.353 1.00 60.99 C
-ATOM 8605 CZ PHE J 9 5.107 67.486 6.080 1.00 62.14 C
-ATOM 8606 H PHE J 9 7.592 67.304 10.323 1.00 0.00 H
-ATOM 8607 HA PHE J 9 7.839 70.201 10.890 1.00 0.00 H
-ATOM 8608 1HB PHE J 9 6.889 70.898 8.752 1.00 0.00 H
-ATOM 8609 2HB PHE J 9 8.329 69.977 8.454 1.00 0.00 H
-ATOM 8610 HD1 PHE J 9 4.764 70.155 8.073 1.00 0.00 H
-ATOM 8611 HD2 PHE J 9 8.189 67.695 7.448 1.00 0.00 H
-ATOM 8612 HE1 PHE J 9 3.486 68.786 6.473 1.00 0.00 H
-ATOM 8613 HE2 PHE J 9 6.882 66.326 5.865 1.00 0.00 H
-ATOM 8614 HZ PHE J 9 4.550 66.892 5.383 1.00 0.00 H
-ATOM 8615 N VAL J 10 5.302 70.543 10.931 1.00 71.97 N
-ATOM 8616 CA VAL J 10 3.900 70.636 11.288 1.00 70.64 C
-ATOM 8617 C VAL J 10 3.171 71.454 10.228 1.00 69.90 C
-ATOM 8618 O VAL J 10 3.768 72.343 9.607 1.00 69.94 O
-ATOM 8619 CB VAL J 10 3.749 71.337 12.656 1.00 61.36 C
-ATOM 8620 CG1 VAL J 10 4.499 70.556 13.756 1.00 60.40 C
-ATOM 8621 CG2 VAL J 10 4.272 72.744 12.540 1.00 61.69 C
-ATOM 8622 H VAL J 10 5.859 71.389 10.805 1.00 0.00 H
-ATOM 8623 HA VAL J 10 3.465 69.636 11.331 1.00 0.00 H
-ATOM 8624 HB VAL J 10 2.693 71.364 12.933 1.00 0.00 H
-ATOM 8625 1HG1 VAL J 10 4.380 71.067 14.703 1.00 0.00 H
-ATOM 8626 2HG1 VAL J 10 4.098 69.548 13.828 1.00 0.00 H
-ATOM 8627 3HG1 VAL J 10 5.560 70.506 13.514 1.00 0.00 H
-ATOM 8628 1HG2 VAL J 10 4.155 73.251 13.494 1.00 0.00 H
-ATOM 8629 2HG2 VAL J 10 5.326 72.719 12.262 1.00 0.00 H
-ATOM 8630 3HG2 VAL J 10 3.706 73.273 11.773 1.00 0.00 H
-ATOM 8631 N VAL J 11 1.885 71.180 10.022 1.00 69.57 N
-ATOM 8632 CA VAL J 11 1.074 71.965 9.085 1.00 69.19 C
-ATOM 8633 C VAL J 11 0.019 72.723 9.853 1.00 70.39 C
-ATOM 8634 O VAL J 11 -0.825 72.115 10.517 1.00 68.56 O
-ATOM 8635 CB VAL J 11 0.350 71.073 8.072 1.00 68.45 C
-ATOM 8636 CG1 VAL J 11 -0.493 71.927 7.127 1.00 68.99 C
-ATOM 8637 CG2 VAL J 11 1.324 70.217 7.338 1.00 66.41 C
-ATOM 8638 H VAL J 11 1.446 70.415 10.541 1.00 0.00 H
-ATOM 8639 HA VAL J 11 1.715 72.676 8.560 1.00 0.00 H
-ATOM 8640 HB VAL J 11 -0.318 70.457 8.595 1.00 0.00 H
-ATOM 8641 1HG1 VAL J 11 -1.035 71.276 6.437 1.00 0.00 H
-ATOM 8642 2HG1 VAL J 11 -1.204 72.507 7.713 1.00 0.00 H
-ATOM 8643 3HG1 VAL J 11 0.129 72.600 6.568 1.00 0.00 H
-ATOM 8644 1HG2 VAL J 11 0.782 69.565 6.652 1.00 0.00 H
-ATOM 8645 2HG2 VAL J 11 2.005 70.826 6.790 1.00 0.00 H
-ATOM 8646 3HG2 VAL J 11 1.869 69.621 8.049 1.00 0.00 H
-ATOM 8647 N ILE J 12 0.047 74.040 9.791 1.00 71.43 N
-ATOM 8648 CA ILE J 12 -0.894 74.817 10.567 1.00 72.12 C
-ATOM 8649 C ILE J 12 -1.773 75.731 9.724 1.00 73.68 C
-ATOM 8650 O ILE J 12 -1.277 76.563 8.952 1.00 72.26 O
-ATOM 8651 CB ILE J 12 -0.134 75.631 11.627 1.00 68.42 C
-ATOM 8652 CG1 ILE J 12 0.667 74.693 12.542 1.00 64.63 C
-ATOM 8653 CG2 ILE J 12 -1.106 76.434 12.472 1.00 70.66 C
-ATOM 8654 CD1 ILE J 12 1.618 75.416 13.439 1.00 53.36 C
-ATOM 8655 H ILE J 12 0.760 74.509 9.230 1.00 0.00 H
-ATOM 8656 HA ILE J 12 -1.561 74.124 11.090 1.00 0.00 H
-ATOM 8657 HB ILE J 12 0.574 76.302 11.131 1.00 0.00 H
-ATOM 8658 1HG1 ILE J 12 -0.030 74.147 13.151 1.00 0.00 H
-ATOM 8659 2HG1 ILE J 12 1.237 73.986 11.950 1.00 0.00 H
-ATOM 8660 1HG2 ILE J 12 -0.539 76.988 13.211 1.00 0.00 H
-ATOM 8661 2HG2 ILE J 12 -1.667 77.125 11.847 1.00 0.00 H
-ATOM 8662 3HG2 ILE J 12 -1.802 75.752 12.972 1.00 0.00 H
-ATOM 8663 1HD1 ILE J 12 2.139 74.701 14.079 1.00 0.00 H
-ATOM 8664 2HD1 ILE J 12 2.351 75.961 12.836 1.00 0.00 H
-ATOM 8665 3HD1 ILE J 12 1.061 76.116 14.050 1.00 0.00 H
-ATOM 8666 N LYS J 13 -3.084 75.591 9.875 1.00 75.11 N
-ATOM 8667 CA LYS J 13 -4.065 76.421 9.201 1.00 75.96 C
-ATOM 8668 C LYS J 13 -4.770 77.351 10.139 1.00 77.08 C
-ATOM 8669 O LYS J 13 -5.353 76.943 11.160 1.00 77.11 O
-ATOM 8670 CB LYS J 13 -5.090 75.605 8.452 1.00 67.66 C
-ATOM 8671 CG LYS J 13 -6.195 76.411 7.775 1.00 71.11 C
-ATOM 8672 CD LYS J 13 -7.173 75.485 7.086 1.00 71.71 C
-ATOM 8673 CE LYS J 13 -8.422 76.226 6.577 1.00 72.95 C
-ATOM 8674 NZ LYS J 13 -9.360 75.278 5.918 1.00 67.34 N
-ATOM 8675 H LYS J 13 -3.426 74.855 10.504 1.00 0.00 H
-ATOM 8676 HA LYS J 13 -3.538 77.047 8.474 1.00 0.00 H
-ATOM 8677 1HB LYS J 13 -4.578 75.074 7.674 1.00 0.00 H
-ATOM 8678 2HB LYS J 13 -5.530 74.890 9.105 1.00 0.00 H
-ATOM 8679 1HG LYS J 13 -6.733 76.998 8.525 1.00 0.00 H
-ATOM 8680 2HG LYS J 13 -5.759 77.100 7.045 1.00 0.00 H
-ATOM 8681 1HD LYS J 13 -6.681 75.017 6.229 1.00 0.00 H
-ATOM 8682 2HD LYS J 13 -7.476 74.698 7.778 1.00 0.00 H
-ATOM 8683 1HE LYS J 13 -8.924 76.707 7.409 1.00 0.00 H
-ATOM 8684 2HE LYS J 13 -8.126 76.990 5.856 1.00 0.00 H
-ATOM 8685 1HZ LYS J 13 -10.213 75.739 5.565 1.00 0.00 H
-ATOM 8686 2HZ LYS J 13 -8.851 74.875 5.126 1.00 0.00 H
-ATOM 8687 3HZ LYS J 13 -9.634 74.556 6.569 1.00 0.00 H
-ATOM 8688 N ALA J 14 -4.750 78.617 9.819 1.00 77.83 N
-ATOM 8689 CA ALA J 14 -5.423 79.583 10.639 1.00 79.34 C
-ATOM 8690 C ALA J 14 -6.912 79.543 10.355 1.00 79.20 C
-ATOM 8691 O ALA J 14 -7.332 79.608 9.188 1.00 76.05 O
-ATOM 8692 CB ALA J 14 -4.838 80.957 10.368 1.00 77.96 C
-ATOM 8693 H ALA J 14 -4.263 78.905 8.956 1.00 0.00 H
-ATOM 8694 HA ALA J 14 -5.293 79.309 11.683 1.00 0.00 H
-ATOM 8695 1HB ALA J 14 -5.321 81.717 10.983 1.00 0.00 H
-ATOM 8696 2HB ALA J 14 -3.760 80.961 10.571 1.00 0.00 H
-ATOM 8697 3HB ALA J 14 -4.997 81.162 9.326 1.00 0.00 H
-ATOM 8698 N LEU J 15 -7.741 79.459 11.392 1.00 81.81 N
-ATOM 8699 CA LEU J 15 -9.181 79.469 11.225 1.00 84.89 C
-ATOM 8700 C LEU J 15 -9.695 80.813 11.687 1.00 86.74 C
-ATOM 8701 O LEU J 15 -10.827 81.218 11.485 1.00 87.11 O
-ATOM 8702 CB LEU J 15 -9.790 78.375 12.070 1.00 83.27 C
-ATOM 8703 CG LEU J 15 -9.290 76.954 11.731 1.00 85.46 C
-ATOM 8704 CD1 LEU J 15 -9.854 75.942 12.742 1.00 88.95 C
-ATOM 8705 CD2 LEU J 15 -9.694 76.620 10.335 1.00 92.06 C
-ATOM 8706 H LEU J 15 -7.379 79.379 12.336 1.00 0.00 H
-ATOM 8707 HA LEU J 15 -9.437 79.337 10.164 1.00 0.00 H
-ATOM 8708 1HB LEU J 15 -9.518 78.585 13.074 1.00 0.00 H
-ATOM 8709 2HB LEU J 15 -10.868 78.410 11.963 1.00 0.00 H
-ATOM 8710 HG LEU J 15 -8.211 76.917 11.787 1.00 0.00 H
-ATOM 8711 1HD1 LEU J 15 -9.502 74.945 12.491 1.00 0.00 H
-ATOM 8712 2HD1 LEU J 15 -9.524 76.192 13.742 1.00 0.00 H
-ATOM 8713 3HD1 LEU J 15 -10.944 75.947 12.695 1.00 0.00 H
-ATOM 8714 1HD2 LEU J 15 -9.329 75.624 10.075 1.00 0.00 H
-ATOM 8715 2HD2 LEU J 15 -10.782 76.649 10.245 1.00 0.00 H
-ATOM 8716 3HD2 LEU J 15 -9.258 77.353 9.648 1.00 0.00 H
-ATOM 8717 N GLU J 16 -8.770 81.448 12.384 1.00 86.85 N
-ATOM 8718 CA GLU J 16 -8.880 82.736 13.073 1.00 88.10 C
-ATOM 8719 C GLU J 16 -7.500 83.392 12.935 1.00 89.13 C
-ATOM 8720 O GLU J 16 -6.508 82.662 12.900 1.00 88.90 O
-ATOM 8721 CB GLU J 16 -9.239 82.468 14.545 1.00 90.33 C
-ATOM 8722 CG GLU J 16 -9.334 83.684 15.459 1.00 91.71 C
-ATOM 8723 CD GLU J 16 -9.712 83.326 16.819 1.00 96.82 C
-ATOM 8724 OE1 GLU J 16 -9.116 82.460 17.426 1.00 97.96 O
-ATOM 8725 OE2 GLU J 16 -10.649 83.951 17.291 1.00100.04 O
-ATOM 8726 H GLU J 16 -7.885 80.994 12.480 1.00 0.00 H
-ATOM 8727 HA GLU J 16 -9.646 83.360 12.595 1.00 0.00 H
-ATOM 8728 1HB GLU J 16 -10.210 81.990 14.594 1.00 0.00 H
-ATOM 8729 2HB GLU J 16 -8.497 81.789 14.983 1.00 0.00 H
-ATOM 8730 1HG GLU J 16 -10.126 84.314 15.057 1.00 0.00 H
-ATOM 8731 2HG GLU J 16 -8.422 84.249 15.498 1.00 0.00 H
-ATOM 8732 N ASP J 17 -7.468 84.732 12.772 1.00 88.88 N
-ATOM 8733 CA ASP J 17 -6.172 85.449 12.669 1.00 88.57 C
-ATOM 8734 C ASP J 17 -5.316 85.456 13.914 1.00 88.81 C
-ATOM 8735 O ASP J 17 -6.014 84.631 14.467 1.00 90.09 O
-ATOM 8736 CB ASP J 17 -6.357 86.956 12.340 1.00 95.80 C
-ATOM 8737 CG ASP J 17 -6.830 87.395 10.946 1.00 97.64 C
-ATOM 8738 OD1 ASP J 17 -7.167 88.577 10.823 1.00 97.04 O
-ATOM 8739 OD2 ASP J 17 -6.837 86.619 10.031 1.00 98.30 O
-ATOM 8740 H ASP J 17 -8.329 85.246 12.764 1.00 0.00 H
-ATOM 8741 HA ASP J 17 -5.568 84.971 11.909 1.00 0.00 H
-ATOM 8742 1HB ASP J 17 -5.411 87.459 12.594 1.00 0.00 H
-ATOM 8743 2HB ASP J 17 -7.152 87.352 13.006 1.00 0.00 H
-ATOM 8744 N GLY J 18 -4.164 85.220 13.400 1.00 88.03 N
-ATOM 8745 CA GLY J 18 -3.426 85.501 14.653 1.00 86.81 C
-ATOM 8746 C GLY J 18 -2.969 84.252 15.337 1.00 87.19 C
-ATOM 8747 O GLY J 18 -2.712 84.257 16.534 1.00 87.10 O
-ATOM 8748 H GLY J 18 -3.404 85.848 13.155 1.00 0.00 H
-ATOM 8749 1HA GLY J 18 -2.549 86.088 14.399 1.00 0.00 H
-ATOM 8750 2HA GLY J 18 -4.032 86.068 15.304 1.00 0.00 H
-ATOM 8751 N VAL J 19 -2.777 83.203 14.559 1.00 86.93 N
-ATOM 8752 CA VAL J 19 -2.277 81.966 15.113 1.00 84.43 C
-ATOM 8753 C VAL J 19 -0.917 82.199 15.714 1.00 82.61 C
-ATOM 8754 O VAL J 19 -0.504 81.619 16.747 1.00 82.88 O
-ATOM 8755 CB VAL J 19 -2.221 80.859 14.080 1.00 90.24 C
-ATOM 8756 CG1 VAL J 19 -1.578 79.695 14.702 1.00 89.22 C
-ATOM 8757 CG2 VAL J 19 -3.568 80.555 13.619 1.00 89.04 C
-ATOM 8758 H VAL J 19 -3.048 83.273 13.590 1.00 0.00 H
-ATOM 8759 HA VAL J 19 -2.985 81.639 15.848 1.00 0.00 H
-ATOM 8760 HB VAL J 19 -1.605 81.163 13.238 1.00 0.00 H
-ATOM 8761 1HG1 VAL J 19 -1.537 78.898 13.989 1.00 0.00 H
-ATOM 8762 2HG1 VAL J 19 -0.584 79.984 15.043 1.00 0.00 H
-ATOM 8763 3HG1 VAL J 19 -2.203 79.375 15.562 1.00 0.00 H
-ATOM 8764 1HG2 VAL J 19 -3.513 79.769 12.891 1.00 0.00 H
-ATOM 8765 2HG2 VAL J 19 -4.194 80.268 14.454 1.00 0.00 H
-ATOM 8766 3HG2 VAL J 19 -3.981 81.463 13.145 1.00 0.00 H
-ATOM 8767 N ASN J 20 -0.157 83.028 15.015 1.00 81.88 N
-ATOM 8768 CA ASN J 20 1.162 83.501 15.357 1.00 82.66 C
-ATOM 8769 C ASN J 20 2.089 82.426 15.826 1.00 82.47 C
-ATOM 8770 O ASN J 20 2.479 82.371 17.004 1.00 81.87 O
-ATOM 8771 CB ASN J 20 1.047 84.629 16.307 1.00 91.72 C
-ATOM 8772 CG ASN J 20 2.295 85.278 16.454 1.00 96.16 C
-ATOM 8773 OD1 ASN J 20 3.193 85.011 15.652 1.00 98.54 O
-ATOM 8774 ND2 ASN J 20 2.398 86.133 17.405 1.00100.55 N
-ATOM 8775 H ASN J 20 -0.604 83.412 14.175 1.00 0.00 H
-ATOM 8776 HA ASN J 20 1.613 83.908 14.450 1.00 0.00 H
-ATOM 8777 1HB ASN J 20 0.294 85.337 15.967 1.00 0.00 H
-ATOM 8778 2HB ASN J 20 0.718 84.262 17.295 1.00 0.00 H
-ATOM 8779 1HD2 ASN J 20 3.266 86.636 17.555 1.00 0.00 H
-ATOM 8780 2HD2 ASN J 20 1.589 86.297 17.968 1.00 0.00 H
-ATOM 8781 N VAL J 21 2.440 81.532 14.933 1.00 81.19 N
-ATOM 8782 CA VAL J 21 3.234 80.407 15.363 1.00 78.96 C
-ATOM 8783 C VAL J 21 4.617 80.902 15.820 1.00 77.44 C
-ATOM 8784 O VAL J 21 5.276 81.688 15.129 1.00 76.23 O
-ATOM 8785 CB VAL J 21 3.386 79.420 14.184 1.00 81.72 C
-ATOM 8786 CG1 VAL J 21 4.277 78.270 14.596 1.00 78.85 C
-ATOM 8787 CG2 VAL J 21 2.000 78.945 13.769 1.00 77.76 C
-ATOM 8788 H VAL J 21 2.139 81.651 13.975 1.00 0.00 H
-ATOM 8789 HA VAL J 21 2.733 79.938 16.189 1.00 0.00 H
-ATOM 8790 HB VAL J 21 3.876 79.938 13.360 1.00 0.00 H
-ATOM 8791 1HG1 VAL J 21 4.399 77.575 13.762 1.00 0.00 H
-ATOM 8792 2HG1 VAL J 21 5.262 78.628 14.906 1.00 0.00 H
-ATOM 8793 3HG1 VAL J 21 3.799 77.764 15.428 1.00 0.00 H
-ATOM 8794 1HG2 VAL J 21 2.099 78.258 12.932 1.00 0.00 H
-ATOM 8795 2HG2 VAL J 21 1.539 78.434 14.613 1.00 0.00 H
-ATOM 8796 3HG2 VAL J 21 1.388 79.788 13.463 1.00 0.00 H
-ATOM 8797 N ILE J 22 5.022 80.448 17.018 1.00 75.66 N
-ATOM 8798 CA ILE J 22 6.312 80.833 17.593 1.00 76.71 C
-ATOM 8799 C ILE J 22 7.347 79.724 17.696 1.00 76.44 C
-ATOM 8800 O ILE J 22 7.050 78.594 18.079 1.00 74.73 O
-ATOM 8801 CB ILE J 22 6.183 81.539 18.962 1.00 83.25 C
-ATOM 8802 CG1 ILE J 22 5.573 82.937 18.788 1.00 84.12 C
-ATOM 8803 CG2 ILE J 22 7.504 81.610 19.740 1.00 80.60 C
-ATOM 8804 CD1 ILE J 22 5.284 83.587 20.086 1.00 84.25 C
-ATOM 8805 H ILE J 22 4.423 79.839 17.537 1.00 0.00 H
-ATOM 8806 HA ILE J 22 6.726 81.582 16.912 1.00 0.00 H
-ATOM 8807 HB ILE J 22 5.480 80.986 19.574 1.00 0.00 H
-ATOM 8808 1HG1 ILE J 22 6.244 83.558 18.221 1.00 0.00 H
-ATOM 8809 2HG1 ILE J 22 4.647 82.864 18.201 1.00 0.00 H
-ATOM 8810 1HG2 ILE J 22 7.331 82.116 20.690 1.00 0.00 H
-ATOM 8811 2HG2 ILE J 22 7.878 80.596 19.908 1.00 0.00 H
-ATOM 8812 3HG2 ILE J 22 8.212 82.156 19.150 1.00 0.00 H
-ATOM 8813 1HD1 ILE J 22 4.869 84.577 19.910 1.00 0.00 H
-ATOM 8814 2HD1 ILE J 22 4.669 82.977 20.621 1.00 0.00 H
-ATOM 8815 3HD1 ILE J 22 6.201 83.705 20.673 1.00 0.00 H
-ATOM 8816 N GLY J 23 8.570 80.064 17.289 1.00 76.11 N
-ATOM 8817 CA GLY J 23 9.718 79.166 17.422 1.00 77.40 C
-ATOM 8818 C GLY J 23 10.463 79.451 18.737 1.00 78.57 C
-ATOM 8819 O GLY J 23 10.851 80.596 19.044 1.00 79.17 O
-ATOM 8820 H GLY J 23 8.723 81.016 16.957 1.00 0.00 H
-ATOM 8821 1HA GLY J 23 9.352 78.140 17.435 1.00 0.00 H
-ATOM 8822 2HA GLY J 23 10.375 79.268 16.563 1.00 0.00 H
-ATOM 8823 N LEU J 24 10.741 78.358 19.455 1.00 77.55 N
-ATOM 8824 CA LEU J 24 11.448 78.346 20.734 1.00 77.69 C
-ATOM 8825 C LEU J 24 12.871 77.836 20.547 1.00 76.63 C
-ATOM 8826 O LEU J 24 13.074 76.791 19.907 1.00 76.75 O
-ATOM 8827 CB LEU J 24 10.723 77.428 21.722 1.00 81.29 C
-ATOM 8828 CG LEU J 24 9.395 77.949 22.354 1.00 78.46 C
-ATOM 8829 CD1 LEU J 24 8.278 77.863 21.309 1.00 78.18 C
-ATOM 8830 CD2 LEU J 24 9.018 77.124 23.592 1.00 81.80 C
-ATOM 8831 H LEU J 24 10.377 77.473 19.111 1.00 0.00 H
-ATOM 8832 HA LEU J 24 11.481 79.362 21.127 1.00 0.00 H
-ATOM 8833 1HB LEU J 24 10.476 76.538 21.164 1.00 0.00 H
-ATOM 8834 2HB LEU J 24 11.409 77.151 22.514 1.00 0.00 H
-ATOM 8835 HG LEU J 24 9.519 78.994 22.643 1.00 0.00 H
-ATOM 8836 1HD1 LEU J 24 7.359 78.236 21.742 1.00 0.00 H
-ATOM 8837 2HD1 LEU J 24 8.519 78.450 20.440 1.00 0.00 H
-ATOM 8838 3HD1 LEU J 24 8.145 76.826 21.013 1.00 0.00 H
-ATOM 8839 1HD2 LEU J 24 8.092 77.520 24.017 1.00 0.00 H
-ATOM 8840 2HD2 LEU J 24 8.874 76.080 23.331 1.00 0.00 H
-ATOM 8841 3HD2 LEU J 24 9.810 77.201 24.335 1.00 0.00 H
-ATOM 8842 N THR J 25 13.854 78.555 21.101 1.00 75.34 N
-ATOM 8843 CA THR J 25 15.262 78.221 20.858 1.00 74.06 C
-ATOM 8844 C THR J 25 15.713 76.873 21.387 1.00 72.75 C
-ATOM 8845 O THR J 25 15.331 76.448 22.476 1.00 71.03 O
-ATOM 8846 CB THR J 25 16.233 79.258 21.464 1.00 74.97 C
-ATOM 8847 OG1 THR J 25 16.009 79.377 22.873 1.00 77.77 O
-ATOM 8848 CG2 THR J 25 16.075 80.614 20.800 1.00 69.86 C
-ATOM 8849 H THR J 25 13.604 79.388 21.631 1.00 0.00 H
-ATOM 8850 HA THR J 25 15.411 78.224 19.785 1.00 0.00 H
-ATOM 8851 HB THR J 25 17.251 78.923 21.311 1.00 0.00 H
-ATOM 8852 HG1 THR J 25 16.663 78.843 23.385 1.00 0.00 H
-ATOM 8853 1HG2 THR J 25 16.779 81.313 21.236 1.00 0.00 H
-ATOM 8854 2HG2 THR J 25 16.279 80.503 19.734 1.00 0.00 H
-ATOM 8855 3HG2 THR J 25 15.060 80.985 20.936 1.00 0.00 H
-ATOM 8856 N ARG J 26 16.593 76.258 20.597 1.00 72.48 N
-ATOM 8857 CA ARG J 26 17.273 75.012 20.915 1.00 72.17 C
-ATOM 8858 C ARG J 26 18.530 75.277 21.740 1.00 70.17 C
-ATOM 8859 O ARG J 26 19.368 76.097 21.359 1.00 68.60 O
-ATOM 8860 CB ARG J 26 17.673 74.276 19.632 1.00 70.03 C
-ATOM 8861 CG ARG J 26 18.249 72.887 19.852 1.00 61.68 C
-ATOM 8862 CD ARG J 26 18.638 72.187 18.570 1.00 60.44 C
-ATOM 8863 NE ARG J 26 17.512 71.986 17.649 1.00 55.89 N
-ATOM 8864 CZ ARG J 26 16.571 71.032 17.758 1.00 52.03 C
-ATOM 8865 NH1 ARG J 26 16.577 70.187 18.763 1.00 55.42 N
-ATOM 8866 NH2 ARG J 26 15.642 70.967 16.831 1.00 58.66 N
-ATOM 8867 H ARG J 26 16.777 76.686 19.694 1.00 0.00 H
-ATOM 8868 HA ARG J 26 16.602 74.384 21.499 1.00 0.00 H
-ATOM 8869 1HB ARG J 26 16.817 74.193 18.960 1.00 0.00 H
-ATOM 8870 2HB ARG J 26 18.433 74.856 19.109 1.00 0.00 H
-ATOM 8871 1HG ARG J 26 19.152 72.975 20.457 1.00 0.00 H
-ATOM 8872 2HG ARG J 26 17.521 72.274 20.378 1.00 0.00 H
-ATOM 8873 1HD ARG J 26 19.396 72.775 18.054 1.00 0.00 H
-ATOM 8874 2HD ARG J 26 19.052 71.213 18.817 1.00 0.00 H
-ATOM 8875 HE ARG J 26 17.436 72.597 16.824 1.00 0.00 H
-ATOM 8876 1HH1 ARG J 26 17.299 70.246 19.460 1.00 0.00 H
-ATOM 8877 2HH1 ARG J 26 15.857 69.477 18.825 1.00 0.00 H
-ATOM 8878 1HH2 ARG J 26 15.689 71.639 16.057 1.00 0.00 H
-ATOM 8879 2HH2 ARG J 26 14.893 70.273 16.879 1.00 0.00 H
-ATOM 8880 N GLY J 27 18.672 74.576 22.856 1.00 69.70 N
-ATOM 8881 CA GLY J 27 19.840 74.740 23.713 1.00 68.97 C
-ATOM 8882 C GLY J 27 19.421 74.869 25.166 1.00 69.46 C
-ATOM 8883 O GLY J 27 18.242 74.766 25.496 1.00 68.44 O
-ATOM 8884 H GLY J 27 17.951 73.925 23.128 1.00 0.00 H
-ATOM 8885 1HA GLY J 27 20.499 73.882 23.595 1.00 0.00 H
-ATOM 8886 2HA GLY J 27 20.403 75.622 23.410 1.00 0.00 H
-ATOM 8887 N ALA J 28 20.399 75.090 26.041 1.00 71.16 N
-ATOM 8888 CA ALA J 28 20.130 75.199 27.470 1.00 72.17 C
-ATOM 8889 C ALA J 28 19.162 76.342 27.752 1.00 72.59 C
-ATOM 8890 O ALA J 28 18.323 76.252 28.647 1.00 71.94 O
-ATOM 8891 CB ALA J 28 21.430 75.428 28.223 1.00 67.63 C
-ATOM 8892 H ALA J 28 21.347 75.169 25.706 1.00 0.00 H
-ATOM 8893 HA ALA J 28 19.671 74.271 27.812 1.00 0.00 H
-ATOM 8894 1HB ALA J 28 21.231 75.492 29.292 1.00 0.00 H
-ATOM 8895 2HB ALA J 28 22.109 74.600 28.029 1.00 0.00 H
-ATOM 8896 3HB ALA J 28 21.887 76.359 27.885 1.00 0.00 H
-ATOM 8897 N ASP J 29 19.286 77.416 26.983 1.00 72.43 N
-ATOM 8898 CA ASP J 29 18.422 78.572 27.152 1.00 74.01 C
-ATOM 8899 C ASP J 29 17.278 78.504 26.141 1.00 75.78 C
-ATOM 8900 O ASP J 29 17.500 78.569 24.922 1.00 76.70 O
-ATOM 8901 CB ASP J 29 19.215 79.871 26.986 1.00 78.92 C
-ATOM 8902 CG ASP J 29 20.236 80.068 28.101 1.00 80.44 C
-ATOM 8903 OD1 ASP J 29 19.975 79.668 29.210 1.00 73.23 O
-ATOM 8904 OD2 ASP J 29 21.271 80.620 27.827 1.00 86.15 O
-ATOM 8905 H ASP J 29 19.994 77.428 26.263 1.00 0.00 H
-ATOM 8906 HA ASP J 29 17.987 78.547 28.147 1.00 0.00 H
-ATOM 8907 1HB ASP J 29 19.741 79.872 26.032 1.00 0.00 H
-ATOM 8908 2HB ASP J 29 18.538 80.726 26.996 1.00 0.00 H
-ATOM 8909 N THR J 30 16.060 78.396 26.658 1.00 77.68 N
-ATOM 8910 CA THR J 30 14.866 78.293 25.828 1.00 79.29 C
-ATOM 8911 C THR J 30 14.192 79.655 25.768 1.00 81.57 C
-ATOM 8912 O THR J 30 13.763 80.184 26.785 1.00 80.45 O
-ATOM 8913 CB THR J 30 13.882 77.250 26.400 1.00 75.24 C
-ATOM 8914 OG1 THR J 30 14.511 75.963 26.419 1.00 71.74 O
-ATOM 8915 CG2 THR J 30 12.626 77.198 25.539 1.00 58.84 C
-ATOM 8916 H THR J 30 15.965 78.347 27.665 1.00 0.00 H
-ATOM 8917 HA THR J 30 15.148 77.993 24.821 1.00 0.00 H
-ATOM 8918 HB THR J 30 13.613 77.525 27.429 1.00 0.00 H
-ATOM 8919 HG1 THR J 30 15.236 75.965 27.052 1.00 0.00 H
-ATOM 8920 1HG2 THR J 30 11.934 76.449 25.944 1.00 0.00 H
-ATOM 8921 2HG2 THR J 30 12.142 78.170 25.543 1.00 0.00 H
-ATOM 8922 3HG2 THR J 30 12.897 76.923 24.521 1.00 0.00 H
-ATOM 8923 N ARG J 31 14.072 80.214 24.571 1.00 84.29 N
-ATOM 8924 CA ARG J 31 13.481 81.537 24.478 1.00 85.97 C
-ATOM 8925 C ARG J 31 12.847 81.815 23.136 1.00 86.57 C
-ATOM 8926 O ARG J 31 12.893 81.016 22.205 1.00 85.99 O
-ATOM 8927 CB ARG J 31 14.528 82.613 24.766 1.00 85.93 C
-ATOM 8928 CG ARG J 31 15.669 82.661 23.785 1.00 92.32 C
-ATOM 8929 CD ARG J 31 16.613 83.740 24.128 1.00 94.27 C
-ATOM 8930 NE ARG J 31 17.765 83.755 23.255 1.00 96.40 N
-ATOM 8931 CZ ARG J 31 17.819 84.388 22.054 1.00 95.42 C
-ATOM 8932 NH1 ARG J 31 16.777 85.059 21.599 1.00 94.69 N
-ATOM 8933 NH2 ARG J 31 18.933 84.334 21.342 1.00 92.99 N
-ATOM 8934 H ARG J 31 14.478 79.770 23.768 1.00 0.00 H
-ATOM 8935 HA ARG J 31 12.712 81.608 25.236 1.00 0.00 H
-ATOM 8936 1HB ARG J 31 14.058 83.580 24.758 1.00 0.00 H
-ATOM 8937 2HB ARG J 31 14.951 82.459 25.760 1.00 0.00 H
-ATOM 8938 1HG ARG J 31 16.202 81.717 23.801 1.00 0.00 H
-ATOM 8939 2HG ARG J 31 15.282 82.855 22.785 1.00 0.00 H
-ATOM 8940 1HD ARG J 31 16.109 84.704 24.035 1.00 0.00 H
-ATOM 8941 2HD ARG J 31 16.949 83.591 25.144 1.00 0.00 H
-ATOM 8942 HE ARG J 31 18.590 83.255 23.565 1.00 0.00 H
-ATOM 8943 1HH1 ARG J 31 15.923 85.104 22.148 1.00 0.00 H
-ATOM 8944 2HH1 ARG J 31 16.825 85.527 20.708 1.00 0.00 H
-ATOM 8945 1HH2 ARG J 31 19.732 83.821 21.697 1.00 0.00 H
-ATOM 8946 2HH2 ARG J 31 18.988 84.801 20.453 1.00 0.00 H
-ATOM 8947 N PHE J 32 12.211 82.974 23.093 1.00 86.18 N
-ATOM 8948 CA PHE J 32 11.531 83.477 21.899 1.00 85.28 C
-ATOM 8949 C PHE J 32 12.529 83.913 20.814 1.00 84.26 C
-ATOM 8950 O PHE J 32 13.333 84.806 21.053 1.00 84.78 O
-ATOM 8951 CB PHE J 32 10.653 84.662 22.330 1.00 90.82 C
-ATOM 8952 CG PHE J 32 9.945 85.347 21.283 1.00 45.00 C
-ATOM 8953 CD1 PHE J 32 9.362 84.657 20.280 1.00 45.00 C
-ATOM 8954 CD2 PHE J 32 9.819 86.724 21.294 1.00 45.00 C
-ATOM 8955 CE1 PHE J 32 8.641 85.264 19.287 1.00 45.00 C
-ATOM 8956 CE2 PHE J 32 9.104 87.382 20.342 1.00 45.00 C
-ATOM 8957 CZ PHE J 32 8.486 86.670 19.324 1.00 45.00 C
-ATOM 8958 H PHE J 32 12.205 83.529 23.924 1.00 0.00 H
-ATOM 8959 HA PHE J 32 10.900 82.699 21.499 1.00 0.00 H
-ATOM 8960 1HB PHE J 32 9.889 84.326 23.009 1.00 0.00 H
-ATOM 8961 2HB PHE J 32 11.254 85.409 22.874 1.00 0.00 H
-ATOM 8962 HD1 PHE J 32 9.493 83.560 20.270 1.00 0.00 H
-ATOM 8963 HD2 PHE J 32 10.273 87.269 22.097 1.00 0.00 H
-ATOM 8964 HE1 PHE J 32 8.201 84.725 18.515 1.00 0.00 H
-ATOM 8965 HE2 PHE J 32 8.991 88.485 20.398 1.00 0.00 H
-ATOM 8966 HZ PHE J 32 7.896 87.168 18.556 1.00 0.00 H
-ATOM 8967 N HIS J 33 12.474 83.270 19.643 1.00 83.55 N
-ATOM 8968 CA HIS J 33 13.345 83.761 18.580 1.00 81.73 C
-ATOM 8969 C HIS J 33 12.532 84.181 17.343 1.00 79.64 C
-ATOM 8970 O HIS J 33 12.957 85.111 16.628 1.00 78.91 O
-ATOM 8971 CB HIS J 33 14.404 82.743 18.160 1.00 87.54 C
-ATOM 8972 CG HIS J 33 13.952 81.585 17.312 1.00 91.83 C
-ATOM 8973 ND1 HIS J 33 13.742 81.723 15.959 1.00 90.43 N
-ATOM 8974 CD2 HIS J 33 13.692 80.277 17.592 1.00 89.04 C
-ATOM 8975 CE1 HIS J 33 13.376 80.581 15.445 1.00 93.17 C
-ATOM 8976 NE2 HIS J 33 13.336 79.676 16.396 1.00 90.86 N
-ATOM 8977 H HIS J 33 11.840 82.481 19.509 1.00 0.00 H
-ATOM 8978 HA HIS J 33 13.864 84.651 18.913 1.00 0.00 H
-ATOM 8979 1HB HIS J 33 15.183 83.278 17.608 1.00 0.00 H
-ATOM 8980 2HB HIS J 33 14.874 82.355 19.048 1.00 0.00 H
-ATOM 8981 HD2 HIS J 33 13.760 79.799 18.562 1.00 0.00 H
-ATOM 8982 HE1 HIS J 33 13.139 80.400 14.392 1.00 0.00 H
-ATOM 8983 HE2 HIS J 33 13.082 78.707 16.235 1.00 0.00 H
-ATOM 8984 N HIS J 34 11.367 83.584 17.087 1.00 78.67 N
-ATOM 8985 CA HIS J 34 10.590 84.030 15.934 1.00 79.07 C
-ATOM 8986 C HIS J 34 9.093 83.836 16.066 1.00 79.85 C
-ATOM 8987 O HIS J 34 8.620 82.832 16.609 1.00 80.24 O
-ATOM 8988 CB HIS J 34 11.027 83.397 14.607 1.00 79.95 C
-ATOM 8989 CG HIS J 34 10.293 83.982 13.410 1.00 68.68 C
-ATOM 8990 ND1 HIS J 34 10.491 85.280 12.973 1.00 74.08 N
-ATOM 8991 CD2 HIS J 34 9.378 83.435 12.568 1.00 65.01 C
-ATOM 8992 CE1 HIS J 34 9.724 85.509 11.909 1.00 72.04 C
-ATOM 8993 NE2 HIS J 34 9.040 84.407 11.642 1.00 74.14 N
-ATOM 8994 H HIS J 34 11.054 82.809 17.670 1.00 0.00 H
-ATOM 8995 HA HIS J 34 10.750 85.099 15.822 1.00 0.00 H
-ATOM 8996 1HB HIS J 34 12.096 83.545 14.454 1.00 0.00 H
-ATOM 8997 2HB HIS J 34 10.836 82.319 14.611 1.00 0.00 H
-ATOM 8998 HD2 HIS J 34 8.980 82.418 12.620 1.00 0.00 H
-ATOM 8999 HE1 HIS J 34 9.670 86.437 11.358 1.00 0.00 H
-ATOM 9000 HE2 HIS J 34 8.358 84.283 10.878 1.00 0.00 H
-ATOM 9001 N SER J 35 8.354 84.809 15.557 1.00 81.62 N
-ATOM 9002 CA SER J 35 6.893 84.842 15.557 1.00 84.14 C
-ATOM 9003 C SER J 35 6.358 85.067 14.162 1.00 84.20 C
-ATOM 9004 O SER J 35 6.653 86.104 13.566 1.00 84.18 O
-ATOM 9005 CB SER J 35 6.456 85.946 16.482 1.00 88.53 C
-ATOM 9006 OG SER J 35 5.119 86.273 16.395 1.00 88.56 O
-ATOM 9007 H SER J 35 8.841 85.590 15.128 1.00 0.00 H
-ATOM 9008 HA SER J 35 6.527 83.886 15.918 1.00 0.00 H
-ATOM 9009 1HB SER J 35 6.626 85.600 17.470 1.00 0.00 H
-ATOM 9010 2HB SER J 35 7.066 86.830 16.316 1.00 0.00 H
-ATOM 9011 HG SER J 35 4.651 85.517 16.061 1.00 0.00 H
-ATOM 9012 N GLU J 36 5.621 84.092 13.624 1.00 85.17 N
-ATOM 9013 CA GLU J 36 5.109 84.192 12.258 1.00 85.93 C
-ATOM 9014 C GLU J 36 3.592 84.373 12.213 1.00 87.02 C
-ATOM 9015 O GLU J 36 2.830 83.402 12.274 1.00 84.97 O
-ATOM 9016 CB GLU J 36 5.486 82.945 11.463 1.00 85.39 C
-ATOM 9017 CG GLU J 36 5.065 82.978 10.009 1.00 86.34 C
-ATOM 9018 CD GLU J 36 5.784 84.039 9.230 1.00 88.63 C
-ATOM 9019 OE1 GLU J 36 6.977 84.198 9.432 1.00 90.12 O
-ATOM 9020 OE2 GLU J 36 5.155 84.685 8.399 1.00 83.38 O
-ATOM 9021 H GLU J 36 5.423 83.256 14.175 1.00 0.00 H
-ATOM 9022 HA GLU J 36 5.555 85.071 11.774 1.00 0.00 H
-ATOM 9023 1HB GLU J 36 6.563 82.817 11.503 1.00 0.00 H
-ATOM 9024 2HB GLU J 36 5.028 82.060 11.930 1.00 0.00 H
-ATOM 9025 1HG GLU J 36 5.245 82.008 9.544 1.00 0.00 H
-ATOM 9026 2HG GLU J 36 3.995 83.176 9.976 1.00 0.00 H
-ATOM 9027 N LYS J 37 3.159 85.620 12.101 1.00 88.30 N
-ATOM 9028 CA LYS J 37 1.732 85.909 12.071 1.00 89.32 C
-ATOM 9029 C LYS J 37 1.055 85.247 10.874 1.00 89.79 C
-ATOM 9030 O LYS J 37 1.544 85.326 9.749 1.00 90.39 O
-ATOM 9031 CB LYS J 37 1.546 87.434 12.058 1.00 88.36 C
-ATOM 9032 CG LYS J 37 2.157 88.122 10.805 1.00 45.00 C
-ATOM 9033 CD LYS J 37 2.145 89.671 10.913 1.00 45.00 C
-ATOM 9034 CE LYS J 37 3.060 90.307 9.836 1.00 45.00 C
-ATOM 9035 NZ LYS J 37 3.258 91.814 10.047 1.00 45.00 N
-ATOM 9036 H LYS J 37 3.848 86.368 12.041 1.00 0.00 H
-ATOM 9037 HA LYS J 37 1.270 85.508 12.961 1.00 0.00 H
-ATOM 9038 1HB LYS J 37 0.490 87.669 12.105 1.00 0.00 H
-ATOM 9039 2HB LYS J 37 2.010 87.854 12.963 1.00 0.00 H
-ATOM 9040 1HG LYS J 37 3.179 87.781 10.661 1.00 0.00 H
-ATOM 9041 2HG LYS J 37 1.582 87.812 9.931 1.00 0.00 H
-ATOM 9042 1HD LYS J 37 1.127 90.040 10.741 1.00 0.00 H
-ATOM 9043 2HD LYS J 37 2.461 89.996 11.899 1.00 0.00 H
-ATOM 9044 1HE LYS J 37 4.037 89.813 9.886 1.00 0.00 H
-ATOM 9045 2HE LYS J 37 2.642 90.119 8.853 1.00 0.00 H
-ATOM 9046 1HZ LYS J 37 3.892 92.214 9.341 1.00 0.00 H
-ATOM 9047 2HZ LYS J 37 2.368 92.304 9.994 1.00 0.00 H
-ATOM 9048 3HZ LYS J 37 3.671 91.961 10.967 1.00 0.00 H
-ATOM 9049 N LEU J 38 -0.102 84.620 11.120 1.00 89.77 N
-ATOM 9050 CA LEU J 38 -0.899 84.009 10.045 1.00 89.14 C
-ATOM 9051 C LEU J 38 -2.260 84.710 9.982 1.00 89.54 C
-ATOM 9052 O LEU J 38 -2.717 85.258 10.994 1.00 88.56 O
-ATOM 9053 CB LEU J 38 -1.146 82.493 10.254 1.00 90.09 C
-ATOM 9054 CG LEU J 38 0.099 81.570 10.438 1.00 84.99 C
-ATOM 9055 CD1 LEU J 38 -0.358 80.049 10.624 1.00 85.13 C
-ATOM 9056 CD2 LEU J 38 1.025 81.753 9.260 1.00 82.45 C
-ATOM 9057 H LEU J 38 -0.450 84.577 12.059 1.00 0.00 H
-ATOM 9058 HA LEU J 38 -0.410 84.159 9.083 1.00 0.00 H
-ATOM 9059 1HB LEU J 38 -1.762 82.370 11.130 1.00 0.00 H
-ATOM 9060 2HB LEU J 38 -1.707 82.114 9.391 1.00 0.00 H
-ATOM 9061 HG LEU J 38 0.631 81.869 11.351 1.00 0.00 H
-ATOM 9062 1HD1 LEU J 38 0.525 79.423 10.784 1.00 0.00 H
-ATOM 9063 2HD1 LEU J 38 -1.009 79.946 11.482 1.00 0.00 H
-ATOM 9064 3HD1 LEU J 38 -0.890 79.704 9.730 1.00 0.00 H
-ATOM 9065 1HD2 LEU J 38 1.899 81.156 9.394 1.00 0.00 H
-ATOM 9066 2HD2 LEU J 38 0.518 81.460 8.343 1.00 0.00 H
-ATOM 9067 3HD2 LEU J 38 1.330 82.796 9.193 1.00 0.00 H
-ATOM 9068 N ASP J 39 -2.903 84.686 8.819 1.00 89.21 N
-ATOM 9069 CA ASP J 39 -4.241 85.229 8.665 1.00 89.80 C
-ATOM 9070 C ASP J 39 -5.202 84.082 8.456 1.00 89.42 C
-ATOM 9071 O ASP J 39 -4.802 83.034 7.929 1.00 90.82 O
-ATOM 9072 CB ASP J 39 -4.282 86.191 7.496 1.00 93.52 C
-ATOM 9073 CG ASP J 39 -3.390 87.336 7.707 1.00 93.67 C
-ATOM 9074 OD1 ASP J 39 -2.671 87.690 6.811 1.00 85.27 O
-ATOM 9075 OD2 ASP J 39 -3.399 87.862 8.794 1.00 95.84 O
-ATOM 9076 H ASP J 39 -2.470 84.257 8.011 1.00 0.00 H
-ATOM 9077 HA ASP J 39 -4.533 85.754 9.564 1.00 0.00 H
-ATOM 9078 1HB ASP J 39 -3.979 85.666 6.578 1.00 0.00 H
-ATOM 9079 2HB ASP J 39 -5.267 86.567 7.357 1.00 0.00 H
-ATOM 9080 N LYS J 40 -6.457 84.245 8.835 1.00 88.31 N
-ATOM 9081 CA LYS J 40 -7.392 83.145 8.693 1.00 86.73 C
-ATOM 9082 C LYS J 40 -7.432 82.696 7.245 1.00 84.84 C
-ATOM 9083 O LYS J 40 -7.505 83.515 6.336 1.00 84.38 O
-ATOM 9084 CB LYS J 40 -8.794 83.528 9.143 1.00 49.39 C
-ATOM 9085 CG LYS J 40 -9.475 84.532 8.285 1.00 45.00 C
-ATOM 9086 CD LYS J 40 -10.883 84.785 8.765 1.00 45.00 C
-ATOM 9087 CE LYS J 40 -11.576 85.797 7.862 1.00 45.00 C
-ATOM 9088 NZ LYS J 40 -12.998 86.043 8.265 1.00 45.00 N
-ATOM 9089 H LYS J 40 -6.737 85.134 9.246 1.00 0.00 H
-ATOM 9090 HA LYS J 40 -7.045 82.318 9.298 1.00 0.00 H
-ATOM 9091 1HB LYS J 40 -9.411 82.643 9.184 1.00 0.00 H
-ATOM 9092 2HB LYS J 40 -8.755 83.959 10.148 1.00 0.00 H
-ATOM 9093 1HG LYS J 40 -8.917 85.476 8.320 1.00 0.00 H
-ATOM 9094 2HG LYS J 40 -9.504 84.169 7.272 1.00 0.00 H
-ATOM 9095 1HD LYS J 40 -11.438 83.839 8.764 1.00 0.00 H
-ATOM 9096 2HD LYS J 40 -10.846 85.163 9.785 1.00 0.00 H
-ATOM 9097 1HE LYS J 40 -11.019 86.724 7.911 1.00 0.00 H
-ATOM 9098 2HE LYS J 40 -11.568 85.433 6.827 1.00 0.00 H
-ATOM 9099 1HZ LYS J 40 -13.394 86.730 7.641 1.00 0.00 H
-ATOM 9100 2HZ LYS J 40 -13.526 85.180 8.198 1.00 0.00 H
-ATOM 9101 3HZ LYS J 40 -13.040 86.385 9.220 1.00 0.00 H
-ATOM 9102 N GLY J 41 -7.424 81.398 7.054 1.00 84.90 N
-ATOM 9103 CA GLY J 41 -7.475 80.796 5.739 1.00 85.45 C
-ATOM 9104 C GLY J 41 -6.094 80.453 5.202 1.00 86.13 C
-ATOM 9105 O GLY J 41 -6.013 79.670 4.253 1.00 85.75 O
-ATOM 9106 H GLY J 41 -7.361 80.784 7.861 1.00 0.00 H
-ATOM 9107 1HA GLY J 41 -8.063 79.881 5.788 1.00 0.00 H
-ATOM 9108 2HA GLY J 41 -7.984 81.459 5.035 1.00 0.00 H
-ATOM 9109 N GLU J 42 -5.024 81.004 5.819 1.00 86.37 N
-ATOM 9110 CA GLU J 42 -3.649 80.732 5.367 1.00 86.80 C
-ATOM 9111 C GLU J 42 -3.068 79.478 5.986 1.00 87.29 C
-ATOM 9112 O GLU J 42 -3.455 79.055 7.082 1.00 87.53 O
-ATOM 9113 CB GLU J 42 -2.681 81.907 5.627 1.00 89.84 C
-ATOM 9114 CG GLU J 42 -2.937 83.137 4.764 1.00 94.30 C
-ATOM 9115 CD GLU J 42 -1.901 84.222 4.934 1.00 99.12 C
-ATOM 9116 OE1 GLU J 42 -1.170 84.164 5.901 1.00 96.63 O
-ATOM 9117 OE2 GLU J 42 -1.831 85.098 4.098 1.00 98.11 O
-ATOM 9118 H GLU J 42 -5.163 81.637 6.605 1.00 0.00 H
-ATOM 9119 HA GLU J 42 -3.682 80.586 4.286 1.00 0.00 H
-ATOM 9120 1HB GLU J 42 -2.723 82.206 6.680 1.00 0.00 H
-ATOM 9121 2HB GLU J 42 -1.659 81.580 5.424 1.00 0.00 H
-ATOM 9122 1HG GLU J 42 -2.949 82.826 3.708 1.00 0.00 H
-ATOM 9123 2HG GLU J 42 -3.915 83.536 5.015 1.00 0.00 H
-ATOM 9124 N VAL J 43 -2.122 78.881 5.260 1.00 86.52 N
-ATOM 9125 CA VAL J 43 -1.446 77.678 5.738 1.00 84.15 C
-ATOM 9126 C VAL J 43 0.071 77.853 5.862 1.00 82.49 C
-ATOM 9127 O VAL J 43 0.727 78.376 4.960 1.00 81.61 O
-ATOM 9128 CB VAL J 43 -1.769 76.477 4.809 1.00 85.05 C
-ATOM 9129 CG1 VAL J 43 -0.995 75.243 5.268 1.00 87.66 C
-ATOM 9130 CG2 VAL J 43 -3.294 76.186 4.838 1.00 80.87 C
-ATOM 9131 H VAL J 43 -1.861 79.291 4.363 1.00 0.00 H
-ATOM 9132 HA VAL J 43 -1.836 77.443 6.727 1.00 0.00 H
-ATOM 9133 HB VAL J 43 -1.454 76.710 3.794 1.00 0.00 H
-ATOM 9134 1HG1 VAL J 43 -1.219 74.408 4.609 1.00 0.00 H
-ATOM 9135 2HG1 VAL J 43 0.072 75.449 5.235 1.00 0.00 H
-ATOM 9136 3HG1 VAL J 43 -1.289 74.993 6.289 1.00 0.00 H
-ATOM 9137 1HG2 VAL J 43 -3.520 75.345 4.191 1.00 0.00 H
-ATOM 9138 2HG2 VAL J 43 -3.589 75.949 5.849 1.00 0.00 H
-ATOM 9139 3HG2 VAL J 43 -3.848 77.061 4.498 1.00 0.00 H
-ATOM 9140 N LEU J 44 0.623 77.442 7.004 1.00 80.62 N
-ATOM 9141 CA LEU J 44 2.064 77.490 7.231 1.00 79.26 C
-ATOM 9142 C LEU J 44 2.600 76.102 7.506 1.00 78.79 C
-ATOM 9143 O LEU J 44 2.132 75.411 8.411 1.00 78.83 O
-ATOM 9144 CB LEU J 44 2.407 78.371 8.430 1.00 71.77 C
-ATOM 9145 CG LEU J 44 3.927 78.452 8.829 1.00 72.26 C
-ATOM 9146 CD1 LEU J 44 4.709 79.200 7.739 1.00 67.61 C
-ATOM 9147 CD2 LEU J 44 4.068 79.131 10.192 1.00 65.21 C
-ATOM 9148 H LEU J 44 0.020 77.065 7.729 1.00 0.00 H
-ATOM 9149 HA LEU J 44 2.553 77.876 6.341 1.00 0.00 H
-ATOM 9150 1HB LEU J 44 2.085 79.358 8.180 1.00 0.00 H
-ATOM 9151 2HB LEU J 44 1.849 78.021 9.296 1.00 0.00 H
-ATOM 9152 HG LEU J 44 4.336 77.444 8.894 1.00 0.00 H
-ATOM 9153 1HD1 LEU J 44 5.758 79.245 8.011 1.00 0.00 H
-ATOM 9154 2HD1 LEU J 44 4.606 78.675 6.792 1.00 0.00 H
-ATOM 9155 3HD1 LEU J 44 4.316 80.210 7.641 1.00 0.00 H
-ATOM 9156 1HD2 LEU J 44 5.117 79.164 10.471 1.00 0.00 H
-ATOM 9157 2HD2 LEU J 44 3.681 80.139 10.152 1.00 0.00 H
-ATOM 9158 3HD2 LEU J 44 3.515 78.560 10.936 1.00 0.00 H
-ATOM 9159 N ILE J 45 3.577 75.686 6.723 1.00 77.96 N
-ATOM 9160 CA ILE J 45 4.178 74.391 6.938 1.00 76.09 C
-ATOM 9161 C ILE J 45 5.601 74.641 7.414 1.00 75.26 C
-ATOM 9162 O ILE J 45 6.376 75.315 6.737 1.00 74.67 O
-ATOM 9163 CB ILE J 45 4.125 73.571 5.651 1.00 76.04 C
-ATOM 9164 CG1 ILE J 45 2.669 73.469 5.235 1.00 74.06 C
-ATOM 9165 CG2 ILE J 45 4.650 72.189 5.941 1.00 77.13 C
-ATOM 9166 CD1 ILE J 45 2.421 72.895 3.905 1.00 69.95 C
-ATOM 9167 H ILE J 45 3.906 76.278 5.971 1.00 0.00 H
-ATOM 9168 HA ILE J 45 3.635 73.863 7.713 1.00 0.00 H
-ATOM 9169 HB ILE J 45 4.696 74.055 4.861 1.00 0.00 H
-ATOM 9170 1HG1 ILE J 45 2.177 72.872 5.959 1.00 0.00 H
-ATOM 9171 2HG1 ILE J 45 2.232 74.460 5.252 1.00 0.00 H
-ATOM 9172 1HG2 ILE J 45 4.592 71.572 5.048 1.00 0.00 H
-ATOM 9173 2HG2 ILE J 45 5.676 72.240 6.285 1.00 0.00 H
-ATOM 9174 3HG2 ILE J 45 4.042 71.764 6.719 1.00 0.00 H
-ATOM 9175 1HD1 ILE J 45 1.351 72.864 3.736 1.00 0.00 H
-ATOM 9176 2HD1 ILE J 45 2.897 73.508 3.136 1.00 0.00 H
-ATOM 9177 3HD1 ILE J 45 2.819 71.897 3.879 1.00 0.00 H
-ATOM 9178 N ALA J 46 5.944 74.148 8.601 1.00 74.74 N
-ATOM 9179 CA ALA J 46 7.251 74.527 9.141 1.00 74.83 C
-ATOM 9180 C ALA J 46 7.979 73.398 9.836 1.00 73.55 C
-ATOM 9181 O ALA J 46 7.387 72.575 10.539 1.00 72.20 O
-ATOM 9182 CB ALA J 46 7.071 75.676 10.121 1.00 71.96 C
-ATOM 9183 H ALA J 46 5.291 73.561 9.114 1.00 0.00 H
-ATOM 9184 HA ALA J 46 7.879 74.853 8.316 1.00 0.00 H
-ATOM 9185 1HB ALA J 46 8.048 75.984 10.493 1.00 0.00 H
-ATOM 9186 2HB ALA J 46 6.592 76.513 9.614 1.00 0.00 H
-ATOM 9187 3HB ALA J 46 6.449 75.349 10.953 1.00 0.00 H
-ATOM 9188 N GLN J 47 9.295 73.390 9.637 1.00 72.40 N
-ATOM 9189 CA GLN J 47 10.183 72.378 10.184 1.00 70.67 C
-ATOM 9190 C GLN J 47 10.800 72.704 11.529 1.00 69.35 C
-ATOM 9191 O GLN J 47 10.940 73.869 11.905 1.00 70.84 O
-ATOM 9192 CB GLN J 47 11.323 72.103 9.206 1.00 61.95 C
-ATOM 9193 CG GLN J 47 10.899 71.493 7.900 1.00 61.34 C
-ATOM 9194 CD GLN J 47 12.070 71.196 7.013 1.00 63.01 C
-ATOM 9195 OE1 GLN J 47 12.985 72.023 6.853 1.00 65.83 O
-ATOM 9196 NE2 GLN J 47 12.063 70.008 6.417 1.00 53.94 N
-ATOM 9197 H GLN J 47 9.708 74.108 9.041 1.00 0.00 H
-ATOM 9198 HA GLN J 47 9.612 71.469 10.301 1.00 0.00 H
-ATOM 9199 1HB GLN J 47 11.854 73.032 8.996 1.00 0.00 H
-ATOM 9200 2HB GLN J 47 12.030 71.422 9.673 1.00 0.00 H
-ATOM 9201 1HG GLN J 47 10.420 70.548 8.116 1.00 0.00 H
-ATOM 9202 2HG GLN J 47 10.211 72.165 7.378 1.00 0.00 H
-ATOM 9203 1HE2 GLN J 47 12.813 69.742 5.810 1.00 0.00 H
-ATOM 9204 2HE2 GLN J 47 11.302 69.375 6.575 1.00 0.00 H
-ATOM 9205 N PHE J 48 11.237 71.654 12.216 1.00 67.44 N
-ATOM 9206 CA PHE J 48 12.049 71.810 13.418 1.00 66.71 C
-ATOM 9207 C PHE J 48 13.477 71.941 12.899 1.00 66.91 C
-ATOM 9208 O PHE J 48 13.843 71.253 11.937 1.00 66.97 O
-ATOM 9209 CB PHE J 48 11.909 70.613 14.335 1.00 71.61 C
-ATOM 9210 CG PHE J 48 10.534 70.457 14.910 1.00 74.10 C
-ATOM 9211 CD1 PHE J 48 10.142 71.116 16.073 1.00 76.27 C
-ATOM 9212 CD2 PHE J 48 9.623 69.632 14.268 1.00 80.42 C
-ATOM 9213 CE1 PHE J 48 8.854 70.936 16.571 1.00 78.32 C
-ATOM 9214 CE2 PHE J 48 8.353 69.454 14.755 1.00 82.81 C
-ATOM 9215 CZ PHE J 48 7.969 70.103 15.903 1.00 80.93 C
-ATOM 9216 H PHE J 48 11.014 70.724 11.858 1.00 0.00 H
-ATOM 9217 HA PHE J 48 11.771 72.725 13.949 1.00 0.00 H
-ATOM 9218 1HB PHE J 48 12.169 69.705 13.798 1.00 0.00 H
-ATOM 9219 2HB PHE J 48 12.611 70.725 15.161 1.00 0.00 H
-ATOM 9220 HD1 PHE J 48 10.854 71.770 16.588 1.00 0.00 H
-ATOM 9221 HD2 PHE J 48 9.933 69.121 13.360 1.00 0.00 H
-ATOM 9222 HE1 PHE J 48 8.540 71.448 17.478 1.00 0.00 H
-ATOM 9223 HE2 PHE J 48 7.652 68.800 14.230 1.00 0.00 H
-ATOM 9224 HZ PHE J 48 6.974 69.961 16.275 1.00 0.00 H
-ATOM 9225 N THR J 49 14.255 72.860 13.468 1.00 66.99 N
-ATOM 9226 CA THR J 49 15.569 73.163 12.892 1.00 66.10 C
-ATOM 9227 C THR J 49 16.693 73.198 13.911 1.00 67.66 C
-ATOM 9228 O THR J 49 16.515 72.914 15.093 1.00 68.33 O
-ATOM 9229 CB THR J 49 15.580 74.529 12.171 1.00 69.23 C
-ATOM 9230 OG1 THR J 49 15.590 75.608 13.138 1.00 66.63 O
-ATOM 9231 CG2 THR J 49 14.324 74.672 11.294 1.00 61.58 C
-ATOM 9232 H THR J 49 13.928 73.333 14.307 1.00 0.00 H
-ATOM 9233 HA THR J 49 15.810 72.388 12.165 1.00 0.00 H
-ATOM 9234 HB THR J 49 16.455 74.604 11.532 1.00 0.00 H
-ATOM 9235 HG1 THR J 49 16.500 75.785 13.384 1.00 0.00 H
-ATOM 9236 1HG2 THR J 49 14.351 75.634 10.792 1.00 0.00 H
-ATOM 9237 2HG2 THR J 49 14.287 73.875 10.548 1.00 0.00 H
-ATOM 9238 3HG2 THR J 49 13.430 74.620 11.914 1.00 0.00 H
-ATOM 9239 N GLU J 50 17.861 73.610 13.432 1.00 67.93 N
-ATOM 9240 CA GLU J 50 19.039 73.817 14.263 1.00 70.97 C
-ATOM 9241 C GLU J 50 18.748 74.796 15.404 1.00 72.99 C
-ATOM 9242 O GLU J 50 19.387 74.729 16.456 1.00 72.73 O
-ATOM 9243 CB GLU J 50 20.192 74.353 13.405 1.00 71.79 C
-ATOM 9244 CG GLU J 50 21.497 74.561 14.149 1.00 76.45 C
-ATOM 9245 CD GLU J 50 22.628 74.980 13.245 1.00 84.50 C
-ATOM 9246 OE1 GLU J 50 23.715 75.164 13.736 1.00 88.15 O
-ATOM 9247 OE2 GLU J 50 22.407 75.113 12.062 1.00 91.89 O
-ATOM 9248 H GLU J 50 17.940 73.796 12.445 1.00 0.00 H
-ATOM 9249 HA GLU J 50 19.335 72.862 14.696 1.00 0.00 H
-ATOM 9250 1HB GLU J 50 20.384 73.664 12.583 1.00 0.00 H
-ATOM 9251 2HB GLU J 50 19.908 75.312 12.969 1.00 0.00 H
-ATOM 9252 1HG GLU J 50 21.344 75.340 14.900 1.00 0.00 H
-ATOM 9253 2HG GLU J 50 21.765 73.640 14.666 1.00 0.00 H
-ATOM 9254 N HIS J 51 17.832 75.744 15.171 1.00 74.66 N
-ATOM 9255 CA HIS J 51 17.508 76.758 16.161 1.00 77.88 C
-ATOM 9256 C HIS J 51 16.143 76.522 16.809 1.00 78.50 C
-ATOM 9257 O HIS J 51 15.959 76.854 17.978 1.00 79.42 O
-ATOM 9258 CB HIS J 51 17.530 78.149 15.515 1.00 81.98 C
-ATOM 9259 CG HIS J 51 18.882 78.550 15.005 1.00 81.42 C
-ATOM 9260 ND1 HIS J 51 19.363 78.146 13.779 1.00 80.35 N
-ATOM 9261 CD2 HIS J 51 19.844 79.328 15.550 1.00 77.26 C
-ATOM 9262 CE1 HIS J 51 20.576 78.643 13.601 1.00 78.78 C
-ATOM 9263 NE2 HIS J 51 20.887 79.371 14.657 1.00 74.56 N
-ATOM 9264 H HIS J 51 17.313 75.734 14.305 1.00 0.00 H
-ATOM 9265 HA HIS J 51 18.258 76.742 16.952 1.00 0.00 H
-ATOM 9266 1HB HIS J 51 16.820 78.182 14.687 1.00 0.00 H
-ATOM 9267 2HB HIS J 51 17.210 78.892 16.248 1.00 0.00 H
-ATOM 9268 HD2 HIS J 51 19.799 79.829 16.517 1.00 0.00 H
-ATOM 9269 HE1 HIS J 51 21.209 78.480 12.726 1.00 0.00 H
-ATOM 9270 HE2 HIS J 51 21.752 79.876 14.795 1.00 0.00 H
-ATOM 9271 N THR J 52 15.187 75.922 16.082 1.00 77.48 N
-ATOM 9272 CA THR J 52 13.852 75.717 16.658 1.00 76.41 C
-ATOM 9273 C THR J 52 13.664 74.311 17.208 1.00 75.66 C
-ATOM 9274 O THR J 52 13.633 73.340 16.444 1.00 74.36 O
-ATOM 9275 CB THR J 52 12.729 75.952 15.624 1.00 71.17 C
-ATOM 9276 OG1 THR J 52 12.780 77.298 15.145 1.00 66.14 O
-ATOM 9277 CG2 THR J 52 11.365 75.689 16.271 1.00 75.88 C
-ATOM 9278 H THR J 52 15.370 75.642 15.127 1.00 0.00 H
-ATOM 9279 HA THR J 52 13.717 76.423 17.477 1.00 0.00 H
-ATOM 9280 HB THR J 52 12.857 75.270 14.777 1.00 0.00 H
-ATOM 9281 HG1 THR J 52 13.470 77.364 14.476 1.00 0.00 H
-ATOM 9282 1HG2 THR J 52 10.573 75.854 15.545 1.00 0.00 H
-ATOM 9283 2HG2 THR J 52 11.319 74.658 16.630 1.00 0.00 H
-ATOM 9284 3HG2 THR J 52 11.234 76.370 17.109 1.00 0.00 H
-ATOM 9285 N SER J 53 13.482 74.213 18.526 1.00 74.98 N
-ATOM 9286 CA SER J 53 13.311 72.919 19.186 1.00 74.06 C
-ATOM 9287 C SER J 53 11.856 72.628 19.514 1.00 73.37 C
-ATOM 9288 O SER J 53 11.512 71.512 19.913 1.00 73.29 O
-ATOM 9289 CB SER J 53 14.117 72.853 20.457 1.00 73.89 C
-ATOM 9290 OG SER J 53 13.661 73.777 21.405 1.00 62.86 O
-ATOM 9291 H SER J 53 13.490 75.069 19.084 1.00 0.00 H
-ATOM 9292 HA SER J 53 13.671 72.139 18.512 1.00 0.00 H
-ATOM 9293 1HB SER J 53 14.043 71.854 20.859 1.00 0.00 H
-ATOM 9294 2HB SER J 53 15.149 73.036 20.232 1.00 0.00 H
-ATOM 9295 HG SER J 53 13.609 74.633 20.949 1.00 0.00 H
-ATOM 9296 N ALA J 54 11.023 73.654 19.398 1.00 73.39 N
-ATOM 9297 CA ALA J 54 9.609 73.541 19.721 1.00 73.24 C
-ATOM 9298 C ALA J 54 8.816 74.612 18.986 1.00 73.02 C
-ATOM 9299 O ALA J 54 9.324 75.709 18.709 1.00 74.31 O
-ATOM 9300 CB ALA J 54 9.409 73.620 21.227 1.00 75.09 C
-ATOM 9301 H ALA J 54 11.391 74.532 19.061 1.00 0.00 H
-ATOM 9302 HA ALA J 54 9.251 72.574 19.376 1.00 0.00 H
-ATOM 9303 1HB ALA J 54 8.356 73.506 21.457 1.00 0.00 H
-ATOM 9304 2HB ALA J 54 9.978 72.816 21.702 1.00 0.00 H
-ATOM 9305 3HB ALA J 54 9.751 74.555 21.598 1.00 0.00 H
-ATOM 9306 N ILE J 55 7.557 74.285 18.705 1.00 73.06 N
-ATOM 9307 CA ILE J 55 6.619 75.159 18.010 1.00 73.01 C
-ATOM 9308 C ILE J 55 5.368 75.427 18.862 1.00 74.87 C
-ATOM 9309 O ILE J 55 4.681 74.500 19.296 1.00 74.50 O
-ATOM 9310 CB ILE J 55 6.233 74.538 16.643 1.00 69.45 C
-ATOM 9311 CG1 ILE J 55 7.511 74.360 15.757 1.00 75.53 C
-ATOM 9312 CG2 ILE J 55 5.231 75.389 15.960 1.00 72.03 C
-ATOM 9313 CD1 ILE J 55 7.279 73.606 14.467 1.00 64.07 C
-ATOM 9314 H ILE J 55 7.217 73.379 19.015 1.00 0.00 H
-ATOM 9315 HA ILE J 55 7.106 76.112 17.824 1.00 0.00 H
-ATOM 9316 HB ILE J 55 5.801 73.549 16.801 1.00 0.00 H
-ATOM 9317 1HG1 ILE J 55 7.912 75.342 15.510 1.00 0.00 H
-ATOM 9318 2HG1 ILE J 55 8.256 73.813 16.322 1.00 0.00 H
-ATOM 9319 1HG2 ILE J 55 4.955 74.954 15.003 1.00 0.00 H
-ATOM 9320 2HG2 ILE J 55 4.343 75.487 16.581 1.00 0.00 H
-ATOM 9321 3HG2 ILE J 55 5.686 76.357 15.809 1.00 0.00 H
-ATOM 9322 1HD1 ILE J 55 8.223 73.516 13.915 1.00 0.00 H
-ATOM 9323 2HD1 ILE J 55 6.898 72.608 14.690 1.00 0.00 H
-ATOM 9324 3HD1 ILE J 55 6.558 74.144 13.861 1.00 0.00 H
-ATOM 9325 N LYS J 56 5.089 76.702 19.128 1.00 75.05 N
-ATOM 9326 CA LYS J 56 3.955 77.028 19.984 1.00 75.84 C
-ATOM 9327 C LYS J 56 2.867 77.720 19.180 1.00 75.09 C
-ATOM 9328 O LYS J 56 3.134 78.646 18.405 1.00 75.50 O
-ATOM 9329 CB LYS J 56 4.458 77.836 21.163 1.00 76.19 C
-ATOM 9330 CG LYS J 56 3.478 78.164 22.206 1.00 76.70 C
-ATOM 9331 CD LYS J 56 4.245 78.764 23.353 1.00 82.14 C
-ATOM 9332 CE LYS J 56 3.407 78.937 24.578 1.00 81.21 C
-ATOM 9333 NZ LYS J 56 4.150 79.642 25.636 1.00 74.25 N
-ATOM 9334 H LYS J 56 5.683 77.431 18.749 1.00 0.00 H
-ATOM 9335 HA LYS J 56 3.539 76.104 20.374 1.00 0.00 H
-ATOM 9336 1HB LYS J 56 5.243 77.286 21.654 1.00 0.00 H
-ATOM 9337 2HB LYS J 56 4.887 78.780 20.804 1.00 0.00 H
-ATOM 9338 1HG LYS J 56 2.744 78.892 21.822 1.00 0.00 H
-ATOM 9339 2HG LYS J 56 2.937 77.252 22.507 1.00 0.00 H
-ATOM 9340 1HD LYS J 56 5.090 78.091 23.573 1.00 0.00 H
-ATOM 9341 2HD LYS J 56 4.640 79.739 23.050 1.00 0.00 H
-ATOM 9342 1HE LYS J 56 2.511 79.502 24.339 1.00 0.00 H
-ATOM 9343 2HE LYS J 56 3.129 77.946 24.946 1.00 0.00 H
-ATOM 9344 1HZ LYS J 56 3.580 79.746 26.480 1.00 0.00 H
-ATOM 9345 2HZ LYS J 56 4.989 79.107 25.865 1.00 0.00 H
-ATOM 9346 3HZ LYS J 56 4.418 80.559 25.304 1.00 0.00 H
-ATOM 9347 N VAL J 57 1.634 77.225 19.336 1.00 75.16 N
-ATOM 9348 CA VAL J 57 0.531 77.692 18.517 1.00 76.66 C
-ATOM 9349 C VAL J 57 -0.676 78.166 19.358 1.00 77.96 C
-ATOM 9350 O VAL J 57 -1.082 77.484 20.315 1.00 77.81 O
-ATOM 9351 CB VAL J 57 0.093 76.537 17.593 1.00 72.61 C
-ATOM 9352 CG1 VAL J 57 -0.973 77.015 16.652 1.00 72.01 C
-ATOM 9353 CG2 VAL J 57 1.331 75.964 16.866 1.00 74.90 C
-ATOM 9354 H VAL J 57 1.470 76.492 20.022 1.00 0.00 H
-ATOM 9355 HA VAL J 57 0.891 78.523 17.893 1.00 0.00 H
-ATOM 9356 HB VAL J 57 -0.351 75.752 18.197 1.00 0.00 H
-ATOM 9357 1HG1 VAL J 57 -1.309 76.222 16.003 1.00 0.00 H
-ATOM 9358 2HG1 VAL J 57 -1.829 77.403 17.210 1.00 0.00 H
-ATOM 9359 3HG1 VAL J 57 -0.527 77.785 16.073 1.00 0.00 H
-ATOM 9360 1HG2 VAL J 57 1.032 75.137 16.236 1.00 0.00 H
-ATOM 9361 2HG2 VAL J 57 1.785 76.744 16.265 1.00 0.00 H
-ATOM 9362 3HG2 VAL J 57 2.052 75.603 17.604 1.00 0.00 H
-ATOM 9363 N ARG J 58 -1.255 79.337 19.054 1.00 79.73 N
-ATOM 9364 CA ARG J 58 -2.428 79.797 19.815 1.00 80.69 C
-ATOM 9365 C ARG J 58 -3.533 80.260 18.870 1.00 80.92 C
-ATOM 9366 O ARG J 58 -3.260 80.575 17.722 1.00 80.65 O
-ATOM 9367 CB ARG J 58 -2.102 80.953 20.763 1.00 82.03 C
-ATOM 9368 CG ARG J 58 -1.115 80.712 21.870 1.00 92.11 C
-ATOM 9369 CD ARG J 58 -0.994 81.917 22.668 1.00 90.80 C
-ATOM 9370 NE ARG J 58 0.088 81.804 23.602 1.00 88.36 N
-ATOM 9371 CZ ARG J 58 -0.137 81.466 24.864 1.00 90.83 C
-ATOM 9372 NH1 ARG J 58 0.249 80.342 25.459 1.00 93.42 N
-ATOM 9373 NH2 ARG J 58 0.529 82.339 25.538 1.00 84.89 N
-ATOM 9374 H ARG J 58 -0.926 79.920 18.273 1.00 0.00 H
-ATOM 9375 HA ARG J 58 -2.819 78.966 20.405 1.00 0.00 H
-ATOM 9376 1HB ARG J 58 -1.728 81.815 20.188 1.00 0.00 H
-ATOM 9377 2HB ARG J 58 -3.000 81.237 21.278 1.00 0.00 H
-ATOM 9378 1HG ARG J 58 -1.425 79.861 22.509 1.00 0.00 H
-ATOM 9379 2HG ARG J 58 -0.110 80.513 21.486 1.00 0.00 H
-ATOM 9380 1HD ARG J 58 -1.919 82.021 23.281 1.00 0.00 H
-ATOM 9381 2HD ARG J 58 -0.795 82.779 21.995 1.00 0.00 H
-ATOM 9382 HE ARG J 58 0.409 82.752 23.562 1.00 0.00 H
-ATOM 9383 1HH1 ARG J 58 -0.566 79.741 25.706 1.00 0.00 H
-ATOM 9384 2HH1 ARG J 58 0.572 80.483 26.381 1.00 0.00 H
-ATOM 9385 1HH2 ARG J 58 0.614 81.672 26.288 1.00 0.00 H
-ATOM 9386 2HH2 ARG J 58 0.977 82.650 26.427 1.00 0.00 H
-ATOM 9387 N GLY J 59 -4.774 80.346 19.338 1.00 80.95 N
-ATOM 9388 CA GLY J 59 -5.863 80.873 18.519 1.00 80.75 C
-ATOM 9389 C GLY J 59 -6.548 79.747 17.778 1.00 81.27 C
-ATOM 9390 O GLY J 59 -6.042 78.625 17.738 1.00 81.15 O
-ATOM 9391 H GLY J 59 -5.010 80.035 20.286 1.00 0.00 H
-ATOM 9392 1HA GLY J 59 -6.606 81.370 19.151 1.00 0.00 H
-ATOM 9393 2HA GLY J 59 -5.479 81.610 17.809 1.00 0.00 H
-ATOM 9394 N LYS J 60 -7.727 80.014 17.223 1.00 80.39 N
-ATOM 9395 CA LYS J 60 -8.452 78.936 16.581 1.00 80.93 C
-ATOM 9396 C LYS J 60 -7.653 78.490 15.375 1.00 81.91 C
-ATOM 9397 O LYS J 60 -7.485 79.262 14.423 1.00 82.48 O
-ATOM 9398 CB LYS J 60 -9.859 79.408 16.193 1.00 78.94 C
-ATOM 9399 CG LYS J 60 -10.826 78.370 15.800 1.00 83.16 C
-ATOM 9400 CD LYS J 60 -11.286 77.557 16.992 1.00 84.38 C
-ATOM 9401 CE LYS J 60 -12.422 76.628 16.616 1.00 94.65 C
-ATOM 9402 NZ LYS J 60 -12.837 75.797 17.762 1.00 97.36 N
-ATOM 9403 H LYS J 60 -8.130 80.952 17.259 1.00 0.00 H
-ATOM 9404 HA LYS J 60 -8.536 78.109 17.260 1.00 0.00 H
-ATOM 9405 1HB LYS J 60 -10.296 80.038 16.979 1.00 0.00 H
-ATOM 9406 2HB LYS J 60 -9.781 79.981 15.302 1.00 0.00 H
-ATOM 9407 1HG LYS J 60 -11.677 78.875 15.347 1.00 0.00 H
-ATOM 9408 2HG LYS J 60 -10.365 77.735 15.075 1.00 0.00 H
-ATOM 9409 1HD LYS J 60 -10.450 76.958 17.378 1.00 0.00 H
-ATOM 9410 2HD LYS J 60 -11.622 78.227 17.781 1.00 0.00 H
-ATOM 9411 1HE LYS J 60 -13.278 77.223 16.288 1.00 0.00 H
-ATOM 9412 2HE LYS J 60 -12.100 75.979 15.793 1.00 0.00 H
-ATOM 9413 1HZ LYS J 60 -13.598 75.185 17.493 1.00 0.00 H
-ATOM 9414 2HZ LYS J 60 -12.050 75.230 18.062 1.00 0.00 H
-ATOM 9415 3HZ LYS J 60 -13.139 76.412 18.518 1.00 0.00 H
-ATOM 9416 N ALA J 61 -7.170 77.253 15.415 1.00 81.78 N
-ATOM 9417 CA ALA J 61 -6.358 76.756 14.309 1.00 81.97 C
-ATOM 9418 C ALA J 61 -6.501 75.250 14.141 1.00 81.53 C
-ATOM 9419 O ALA J 61 -6.785 74.513 15.088 1.00 82.06 O
-ATOM 9420 CB ALA J 61 -4.879 77.090 14.496 1.00 67.97 C
-ATOM 9421 H ALA J 61 -7.337 76.689 16.246 1.00 0.00 H
-ATOM 9422 HA ALA J 61 -6.708 77.241 13.407 1.00 0.00 H
-ATOM 9423 1HB ALA J 61 -4.315 76.738 13.629 1.00 0.00 H
-ATOM 9424 2HB ALA J 61 -4.765 78.155 14.584 1.00 0.00 H
-ATOM 9425 3HB ALA J 61 -4.493 76.621 15.384 1.00 0.00 H
-ATOM 9426 N TYR J 62 -6.265 74.809 12.911 1.00 79.93 N
-ATOM 9427 CA TYR J 62 -6.280 73.393 12.554 1.00 79.10 C
-ATOM 9428 C TYR J 62 -4.824 72.947 12.382 1.00 78.03 C
-ATOM 9429 O TYR J 62 -4.137 73.402 11.466 1.00 78.35 O
-ATOM 9430 CB TYR J 62 -7.084 73.211 11.256 1.00 77.62 C
-ATOM 9431 CG TYR J 62 -7.429 71.794 10.870 1.00 76.53 C
-ATOM 9432 CD1 TYR J 62 -8.536 71.201 11.448 1.00 76.30 C
-ATOM 9433 CD2 TYR J 62 -6.672 71.095 9.935 1.00 75.40 C
-ATOM 9434 CE1 TYR J 62 -8.905 69.923 11.097 1.00 76.04 C
-ATOM 9435 CE2 TYR J 62 -7.037 69.804 9.580 1.00 73.85 C
-ATOM 9436 CZ TYR J 62 -8.159 69.220 10.156 1.00 75.64 C
-ATOM 9437 OH TYR J 62 -8.552 67.935 9.807 1.00 77.18 O
-ATOM 9438 H TYR J 62 -6.036 75.491 12.200 1.00 0.00 H
-ATOM 9439 HA TYR J 62 -6.729 72.816 13.353 1.00 0.00 H
-ATOM 9440 1HB TYR J 62 -8.016 73.766 11.325 1.00 0.00 H
-ATOM 9441 2HB TYR J 62 -6.539 73.631 10.451 1.00 0.00 H
-ATOM 9442 HD1 TYR J 62 -9.128 71.753 12.183 1.00 0.00 H
-ATOM 9443 HD2 TYR J 62 -5.801 71.563 9.480 1.00 0.00 H
-ATOM 9444 HE1 TYR J 62 -9.781 69.469 11.556 1.00 0.00 H
-ATOM 9445 HE2 TYR J 62 -6.452 69.256 8.847 1.00 0.00 H
-ATOM 9446 HH TYR J 62 -7.849 67.499 9.322 1.00 0.00 H
-ATOM 9447 N ILE J 63 -4.338 72.101 13.296 1.00 76.86 N
-ATOM 9448 CA ILE J 63 -2.929 71.708 13.282 1.00 75.49 C
-ATOM 9449 C ILE J 63 -2.768 70.225 12.927 1.00 74.40 C
-ATOM 9450 O ILE J 63 -3.330 69.354 13.591 1.00 73.46 O
-ATOM 9451 CB ILE J 63 -2.342 71.894 14.687 1.00 77.11 C
-ATOM 9452 CG1 ILE J 63 -2.467 73.345 15.154 1.00 72.47 C
-ATOM 9453 CG2 ILE J 63 -0.890 71.477 14.681 1.00 79.28 C
-ATOM 9454 CD1 ILE J 63 -2.280 73.485 16.645 1.00 72.38 C
-ATOM 9455 H ILE J 63 -4.923 71.750 14.047 1.00 0.00 H
-ATOM 9456 HA ILE J 63 -2.381 72.301 12.559 1.00 0.00 H
-ATOM 9457 HB ILE J 63 -2.876 71.286 15.366 1.00 0.00 H
-ATOM 9458 1HG1 ILE J 63 -1.711 73.944 14.669 1.00 0.00 H
-ATOM 9459 2HG1 ILE J 63 -3.447 73.734 14.889 1.00 0.00 H
-ATOM 9460 1HG2 ILE J 63 -0.489 71.584 15.680 1.00 0.00 H
-ATOM 9461 2HG2 ILE J 63 -0.828 70.445 14.371 1.00 0.00 H
-ATOM 9462 3HG2 ILE J 63 -0.324 72.092 13.993 1.00 0.00 H
-ATOM 9463 1HD1 ILE J 63 -2.381 74.520 16.929 1.00 0.00 H
-ATOM 9464 2HD1 ILE J 63 -3.048 72.900 17.159 1.00 0.00 H
-ATOM 9465 3HD1 ILE J 63 -1.291 73.116 16.925 1.00 0.00 H
-ATOM 9466 N GLN J 64 -1.977 69.935 11.892 1.00 74.15 N
-ATOM 9467 CA GLN J 64 -1.724 68.545 11.515 1.00 71.46 C
-ATOM 9468 C GLN J 64 -0.273 68.211 11.855 1.00 70.31 C
-ATOM 9469 O GLN J 64 0.648 68.916 11.421 1.00 67.94 O
-ATOM 9470 CB GLN J 64 -1.909 68.318 10.009 1.00 64.23 C
-ATOM 9471 CG GLN J 64 -3.253 68.670 9.419 1.00 69.38 C
-ATOM 9472 CD GLN J 64 -3.256 68.533 7.890 1.00 65.44 C
-ATOM 9473 OE1 GLN J 64 -2.245 68.791 7.232 1.00 60.37 O
-ATOM 9474 NE2 GLN J 64 -4.399 68.128 7.345 1.00 52.46 N
-ATOM 9475 H GLN J 64 -1.547 70.688 11.362 1.00 0.00 H
-ATOM 9476 HA GLN J 64 -2.377 67.878 12.081 1.00 0.00 H
-ATOM 9477 1HB GLN J 64 -1.156 68.817 9.482 1.00 0.00 H
-ATOM 9478 2HB GLN J 64 -1.767 67.258 9.809 1.00 0.00 H
-ATOM 9479 1HG GLN J 64 -4.010 68.011 9.815 1.00 0.00 H
-ATOM 9480 2HG GLN J 64 -3.492 69.707 9.672 1.00 0.00 H
-ATOM 9481 1HE2 GLN J 64 -4.513 68.016 6.338 1.00 0.00 H
-ATOM 9482 2HE2 GLN J 64 -5.176 67.927 7.928 1.00 0.00 H
-ATOM 9483 N THR J 65 -0.050 67.160 12.630 1.00 68.72 N
-ATOM 9484 CA THR J 65 1.316 66.757 12.963 1.00 69.10 C
-ATOM 9485 C THR J 65 1.447 65.261 12.734 1.00 69.35 C
-ATOM 9486 O THR J 65 0.479 64.578 12.398 1.00 69.91 O
-ATOM 9487 CB THR J 65 1.719 67.031 14.436 1.00 67.11 C
-ATOM 9488 OG1 THR J 65 1.064 66.089 15.294 1.00 60.30 O
-ATOM 9489 CG2 THR J 65 1.316 68.432 14.867 1.00 64.92 C
-ATOM 9490 H THR J 65 -0.838 66.618 12.990 1.00 0.00 H
-ATOM 9491 HA THR J 65 2.018 67.267 12.303 1.00 0.00 H
-ATOM 9492 HB THR J 65 2.799 66.934 14.532 1.00 0.00 H
-ATOM 9493 HG1 THR J 65 1.018 65.240 14.853 1.00 0.00 H
-ATOM 9494 1HG2 THR J 65 1.616 68.604 15.904 1.00 0.00 H
-ATOM 9495 2HG2 THR J 65 1.793 69.169 14.228 1.00 0.00 H
-ATOM 9496 3HG2 THR J 65 0.241 68.520 14.786 1.00 0.00 H
-ATOM 9497 N ARG J 66 2.632 64.733 12.989 1.00 70.71 N
-ATOM 9498 CA ARG J 66 2.870 63.299 12.913 1.00 71.32 C
-ATOM 9499 C ARG J 66 1.924 62.486 13.795 1.00 71.00 C
-ATOM 9500 O ARG J 66 1.693 61.307 13.527 1.00 69.46 O
-ATOM 9501 CB ARG J 66 4.301 62.940 13.299 1.00 71.51 C
-ATOM 9502 CG ARG J 66 4.587 61.445 13.198 1.00 82.69 C
-ATOM 9503 CD ARG J 66 6.020 61.090 13.421 1.00 91.07 C
-ATOM 9504 NE ARG J 66 6.206 59.629 13.438 1.00 95.34 N
-ATOM 9505 CZ ARG J 66 6.342 58.849 12.339 1.00 96.01 C
-ATOM 9506 NH1 ARG J 66 6.500 57.549 12.471 1.00 95.05 N
-ATOM 9507 NH2 ARG J 66 6.310 59.387 11.132 1.00 95.41 N
-ATOM 9508 H ARG J 66 3.400 65.343 13.239 1.00 0.00 H
-ATOM 9509 HA ARG J 66 2.715 62.989 11.879 1.00 0.00 H
-ATOM 9510 1HB ARG J 66 5.012 63.468 12.658 1.00 0.00 H
-ATOM 9511 2HB ARG J 66 4.490 63.240 14.329 1.00 0.00 H
-ATOM 9512 1HG ARG J 66 3.992 60.927 13.952 1.00 0.00 H
-ATOM 9513 2HG ARG J 66 4.301 61.096 12.208 1.00 0.00 H
-ATOM 9514 1HD ARG J 66 6.634 61.508 12.620 1.00 0.00 H
-ATOM 9515 2HD ARG J 66 6.355 61.488 14.382 1.00 0.00 H
-ATOM 9516 HE ARG J 66 6.235 59.174 14.341 1.00 0.00 H
-ATOM 9517 1HH1 ARG J 66 6.521 57.134 13.390 1.00 0.00 H
-ATOM 9518 2HH1 ARG J 66 6.598 56.965 11.652 1.00 0.00 H
-ATOM 9519 1HH2 ARG J 66 6.185 60.385 11.028 1.00 0.00 H
-ATOM 9520 2HH2 ARG J 66 6.407 58.801 10.315 1.00 0.00 H
-ATOM 9521 N HIS J 67 1.412 63.087 14.872 1.00 71.13 N
-ATOM 9522 CA HIS J 67 0.617 62.318 15.811 1.00 71.96 C
-ATOM 9523 C HIS J 67 -0.891 62.487 15.588 1.00 72.49 C
-ATOM 9524 O HIS J 67 -1.696 62.097 16.436 1.00 71.65 O
-ATOM 9525 CB HIS J 67 0.986 62.729 17.236 1.00 76.13 C
-ATOM 9526 CG HIS J 67 2.447 62.572 17.504 1.00 71.38 C
-ATOM 9527 ND1 HIS J 67 3.183 61.492 17.052 1.00 70.44 N
-ATOM 9528 CD2 HIS J 67 3.306 63.348 18.192 1.00 73.13 C
-ATOM 9529 CE1 HIS J 67 4.439 61.635 17.445 1.00 78.64 C
-ATOM 9530 NE2 HIS J 67 4.529 62.743 18.142 1.00 75.21 N
-ATOM 9531 H HIS J 67 1.555 64.080 15.043 1.00 0.00 H
-ATOM 9532 HA HIS J 67 0.846 61.261 15.699 1.00 0.00 H
-ATOM 9533 1HB HIS J 67 0.712 63.774 17.408 1.00 0.00 H
-ATOM 9534 2HB HIS J 67 0.439 62.116 17.957 1.00 0.00 H
-ATOM 9535 HD2 HIS J 67 3.075 64.276 18.703 1.00 0.00 H
-ATOM 9536 HE1 HIS J 67 5.264 60.950 17.243 1.00 0.00 H
-ATOM 9537 HE2 HIS J 67 5.371 63.103 18.596 1.00 0.00 H
-ATOM 9538 N GLY J 68 -1.276 63.060 14.443 1.00 74.09 N
-ATOM 9539 CA GLY J 68 -2.691 63.246 14.146 1.00 74.98 C
-ATOM 9540 C GLY J 68 -3.062 64.713 14.034 1.00 75.55 C
-ATOM 9541 O GLY J 68 -2.243 65.561 13.678 1.00 74.87 O
-ATOM 9542 H GLY J 68 -0.587 63.380 13.765 1.00 0.00 H
-ATOM 9543 1HA GLY J 68 -2.933 62.736 13.212 1.00 0.00 H
-ATOM 9544 2HA GLY J 68 -3.291 62.782 14.924 1.00 0.00 H
-ATOM 9545 N VAL J 69 -4.329 65.003 14.265 1.00 75.32 N
-ATOM 9546 CA VAL J 69 -4.825 66.363 14.133 1.00 75.84 C
-ATOM 9547 C VAL J 69 -5.309 66.866 15.468 1.00 75.13 C
-ATOM 9548 O VAL J 69 -5.928 66.122 16.234 1.00 74.55 O
-ATOM 9549 CB VAL J 69 -5.944 66.461 13.088 1.00 75.88 C
-ATOM 9550 CG1 VAL J 69 -6.491 67.879 13.043 1.00 81.33 C
-ATOM 9551 CG2 VAL J 69 -5.375 66.056 11.745 1.00 81.26 C
-ATOM 9552 H VAL J 69 -4.963 64.268 14.546 1.00 0.00 H
-ATOM 9553 HA VAL J 69 -4.009 67.001 13.806 1.00 0.00 H
-ATOM 9554 HB VAL J 69 -6.768 65.809 13.356 1.00 0.00 H
-ATOM 9555 1HG1 VAL J 69 -7.267 67.911 12.308 1.00 0.00 H
-ATOM 9556 2HG1 VAL J 69 -6.908 68.152 14.012 1.00 0.00 H
-ATOM 9557 3HG1 VAL J 69 -5.702 68.585 12.777 1.00 0.00 H
-ATOM 9558 1HG2 VAL J 69 -6.142 66.126 10.978 1.00 0.00 H
-ATOM 9559 2HG2 VAL J 69 -4.551 66.717 11.502 1.00 0.00 H
-ATOM 9560 3HG2 VAL J 69 -5.014 65.034 11.804 1.00 0.00 H
-ATOM 9561 N ILE J 70 -4.953 68.099 15.772 1.00 74.99 N
-ATOM 9562 CA ILE J 70 -5.376 68.725 17.006 1.00 75.87 C
-ATOM 9563 C ILE J 70 -5.826 70.151 16.695 1.00 76.24 C
-ATOM 9564 O ILE J 70 -5.221 70.832 15.870 1.00 74.81 O
-ATOM 9565 CB ILE J 70 -4.214 68.739 18.029 1.00 75.15 C
-ATOM 9566 CG1 ILE J 70 -4.702 69.226 19.380 1.00 68.99 C
-ATOM 9567 CG2 ILE J 70 -3.105 69.632 17.546 1.00 68.26 C
-ATOM 9568 CD1 ILE J 70 -3.715 68.966 20.480 1.00 63.69 C
-ATOM 9569 H ILE J 70 -4.402 68.625 15.095 1.00 0.00 H
-ATOM 9570 HA ILE J 70 -6.214 68.169 17.421 1.00 0.00 H
-ATOM 9571 HB ILE J 70 -3.823 67.741 18.159 1.00 0.00 H
-ATOM 9572 1HG1 ILE J 70 -4.902 70.298 19.339 1.00 0.00 H
-ATOM 9573 2HG1 ILE J 70 -5.632 68.708 19.627 1.00 0.00 H
-ATOM 9574 1HG2 ILE J 70 -2.310 69.638 18.268 1.00 0.00 H
-ATOM 9575 2HG2 ILE J 70 -2.721 69.263 16.585 1.00 0.00 H
-ATOM 9576 3HG2 ILE J 70 -3.496 70.630 17.433 1.00 0.00 H
-ATOM 9577 1HD1 ILE J 70 -4.122 69.312 21.407 1.00 0.00 H
-ATOM 9578 2HD1 ILE J 70 -3.513 67.894 20.551 1.00 0.00 H
-ATOM 9579 3HD1 ILE J 70 -2.793 69.491 20.267 1.00 0.00 H
-ATOM 9580 N GLU J 71 -6.886 70.606 17.341 1.00 77.76 N
-ATOM 9581 CA GLU J 71 -7.276 71.994 17.146 1.00 78.48 C
-ATOM 9582 C GLU J 71 -6.883 72.817 18.361 1.00 79.28 C
-ATOM 9583 O GLU J 71 -6.982 72.347 19.502 1.00 77.74 O
-ATOM 9584 CB GLU J 71 -8.774 72.127 16.860 1.00 74.90 C
-ATOM 9585 CG GLU J 71 -9.217 71.514 15.531 1.00 83.11 C
-ATOM 9586 CD GLU J 71 -10.695 71.734 15.244 1.00 85.44 C
-ATOM 9587 OE1 GLU J 71 -11.370 72.290 16.078 1.00 85.43 O
-ATOM 9588 OE2 GLU J 71 -11.141 71.343 14.190 1.00 88.07 O
-ATOM 9589 H GLU J 71 -7.393 70.011 17.978 1.00 0.00 H
-ATOM 9590 HA GLU J 71 -6.730 72.395 16.293 1.00 0.00 H
-ATOM 9591 1HB GLU J 71 -9.338 71.647 17.658 1.00 0.00 H
-ATOM 9592 2HB GLU J 71 -9.049 73.186 16.853 1.00 0.00 H
-ATOM 9593 1HG GLU J 71 -8.628 71.963 14.727 1.00 0.00 H
-ATOM 9594 2HG GLU J 71 -9.000 70.443 15.542 1.00 0.00 H
-ATOM 9595 N SER J 72 -6.475 74.055 18.112 1.00 80.83 N
-ATOM 9596 CA SER J 72 -6.105 74.973 19.192 1.00 82.00 C
-ATOM 9597 C SER J 72 -7.161 76.054 19.325 1.00 83.96 C
-ATOM 9598 O SER J 72 -7.917 76.284 18.374 1.00 83.91 O
-ATOM 9599 CB SER J 72 -4.721 75.547 18.939 1.00 76.60 C
-ATOM 9600 OG SER J 72 -4.684 76.314 17.782 1.00 67.77 O
-ATOM 9601 H SER J 72 -6.439 74.353 17.137 1.00 0.00 H
-ATOM 9602 HA SER J 72 -6.072 74.430 20.131 1.00 0.00 H
-ATOM 9603 1HB SER J 72 -4.386 76.135 19.806 1.00 0.00 H
-ATOM 9604 2HB SER J 72 -4.036 74.732 18.836 1.00 0.00 H
-ATOM 9605 HG SER J 72 -5.193 77.129 17.970 1.00 0.00 H
-ATOM 9606 N GLU J 73 -7.217 76.704 20.492 1.00 85.18 N
-ATOM 9607 CA GLU J 73 -8.143 77.810 20.716 1.00 85.69 C
-ATOM 9608 C GLU J 73 -7.429 79.009 21.319 1.00 85.21 C
-ATOM 9609 O GLU J 73 -6.197 79.086 21.290 1.00 84.77 O
-ATOM 9610 OXT GLU J 73 -8.087 79.994 21.646 1.00 0.00 O
-ATOM 9611 CB GLU J 73 -9.303 77.395 21.635 1.00 86.69 C
-ATOM 9612 CG GLU J 73 -10.191 76.287 21.084 1.00 92.67 C
-ATOM 9613 CD GLU J 73 -11.353 75.931 21.955 1.00 96.12 C
-ATOM 9614 OE1 GLU J 73 -12.426 75.770 21.423 1.00 97.01 O
-ATOM 9615 OE2 GLU J 73 -11.176 75.801 23.145 1.00 96.56 O
-ATOM 9616 H GLU J 73 -6.584 76.431 21.242 1.00 0.00 H
-ATOM 9617 HA GLU J 73 -8.555 78.115 19.757 1.00 0.00 H
-ATOM 9618 1HB GLU J 73 -8.911 77.064 22.594 1.00 0.00 H
-ATOM 9619 2HB GLU J 73 -9.936 78.263 21.829 1.00 0.00 H
-ATOM 9620 1HG GLU J 73 -10.563 76.585 20.099 1.00 0.00 H
-ATOM 9621 2HG GLU J 73 -9.587 75.397 20.958 1.00 0.00 H
-TER
-ATOM 9623 N SER K 7 15.069 63.913 16.398 1.00 80.60 N
-ATOM 9624 CA SER K 7 14.458 63.709 17.706 1.00 80.73 C
-ATOM 9625 C SER K 7 12.941 63.768 17.611 1.00 80.11 C
-ATOM 9626 O SER K 7 12.382 64.516 16.807 1.00 82.35 O
-ATOM 9627 CB SER K 7 14.978 64.732 18.691 1.00 90.75 C
-ATOM 9628 OG SER K 7 16.355 64.553 18.887 1.00 96.26 O
-ATOM 9629 1H SER K 7 15.837 63.268 16.283 1.00 0.00 H
-ATOM 9630 2H SER K 7 14.380 63.748 15.678 1.00 0.00 H
-ATOM 9631 3H SER K 7 15.412 64.859 16.331 1.00 0.00 H
-ATOM 9632 HA SER K 7 14.733 62.717 18.067 1.00 0.00 H
-ATOM 9633 1HB SER K 7 14.783 65.743 18.326 1.00 0.00 H
-ATOM 9634 2HB SER K 7 14.452 64.621 19.640 1.00 0.00 H
-ATOM 9635 HG SER K 7 16.752 64.625 18.017 1.00 0.00 H
-ATOM 9636 N ASP K 8 12.278 62.948 18.422 1.00 77.15 N
-ATOM 9637 CA ASP K 8 10.820 62.857 18.412 1.00 74.30 C
-ATOM 9638 C ASP K 8 10.221 64.014 19.200 1.00 71.74 C
-ATOM 9639 O ASP K 8 10.958 64.778 19.833 1.00 68.33 O
-ATOM 9640 CB ASP K 8 10.382 61.502 19.002 1.00 75.58 C
-ATOM 9641 CG ASP K 8 9.054 60.957 18.438 1.00 79.88 C
-ATOM 9642 OD1 ASP K 8 8.254 61.737 17.981 1.00 69.54 O
-ATOM 9643 OD2 ASP K 8 8.872 59.754 18.445 1.00 81.16 O
-ATOM 9644 H ASP K 8 12.794 62.367 19.065 1.00 0.00 H
-ATOM 9645 HA ASP K 8 10.468 62.926 17.382 1.00 0.00 H
-ATOM 9646 1HB ASP K 8 11.160 60.760 18.844 1.00 0.00 H
-ATOM 9647 2HB ASP K 8 10.256 61.615 20.082 1.00 0.00 H
-ATOM 9648 N PHE K 9 8.892 64.120 19.162 1.00 70.57 N
-ATOM 9649 CA PHE K 9 8.181 65.208 19.841 1.00 70.15 C
-ATOM 9650 C PHE K 9 6.820 64.822 20.382 1.00 70.38 C
-ATOM 9651 O PHE K 9 6.257 63.788 20.020 1.00 70.49 O
-ATOM 9652 CB PHE K 9 7.975 66.414 18.900 1.00 64.57 C
-ATOM 9653 CG PHE K 9 7.081 66.195 17.726 1.00 62.97 C
-ATOM 9654 CD1 PHE K 9 5.730 66.508 17.810 1.00 60.99 C
-ATOM 9655 CD2 PHE K 9 7.572 65.712 16.533 1.00 62.03 C
-ATOM 9656 CE1 PHE K 9 4.894 66.337 16.729 1.00 63.86 C
-ATOM 9657 CE2 PHE K 9 6.738 65.540 15.451 1.00 63.86 C
-ATOM 9658 CZ PHE K 9 5.401 65.853 15.549 1.00 63.59 C
-ATOM 9659 H PHE K 9 8.384 63.416 18.626 1.00 0.00 H
-ATOM 9660 HA PHE K 9 8.783 65.519 20.692 1.00 0.00 H
-ATOM 9661 1HB PHE K 9 7.546 67.228 19.462 1.00 0.00 H
-ATOM 9662 2HB PHE K 9 8.918 66.745 18.534 1.00 0.00 H
-ATOM 9663 HD1 PHE K 9 5.338 66.893 18.750 1.00 0.00 H
-ATOM 9664 HD2 PHE K 9 8.632 65.466 16.448 1.00 0.00 H
-ATOM 9665 HE1 PHE K 9 3.839 66.587 16.813 1.00 0.00 H
-ATOM 9666 HE2 PHE K 9 7.136 65.157 14.514 1.00 0.00 H
-ATOM 9667 HZ PHE K 9 4.761 65.715 14.693 1.00 0.00 H
-ATOM 9668 N VAL K 10 6.284 65.683 21.241 1.00 69.29 N
-ATOM 9669 CA VAL K 10 4.948 65.494 21.784 1.00 68.48 C
-ATOM 9670 C VAL K 10 4.107 66.741 21.527 1.00 67.61 C
-ATOM 9671 O VAL K 10 4.645 67.844 21.401 1.00 66.73 O
-ATOM 9672 CB VAL K 10 5.023 65.244 23.306 1.00 62.16 C
-ATOM 9673 CG1 VAL K 10 5.865 64.004 23.607 1.00 61.69 C
-ATOM 9674 CG2 VAL K 10 5.618 66.463 23.990 1.00 70.51 C
-ATOM 9675 H VAL K 10 6.838 66.495 21.513 1.00 0.00 H
-ATOM 9676 HA VAL K 10 4.475 64.640 21.292 1.00 0.00 H
-ATOM 9677 HB VAL K 10 4.014 65.065 23.686 1.00 0.00 H
-ATOM 9678 1HG1 VAL K 10 5.893 63.854 24.674 1.00 0.00 H
-ATOM 9679 2HG1 VAL K 10 5.428 63.132 23.122 1.00 0.00 H
-ATOM 9680 3HG1 VAL K 10 6.878 64.152 23.243 1.00 0.00 H
-ATOM 9681 1HG2 VAL K 10 5.658 66.293 25.068 1.00 0.00 H
-ATOM 9682 2HG2 VAL K 10 6.628 66.634 23.609 1.00 0.00 H
-ATOM 9683 3HG2 VAL K 10 5.002 67.339 23.785 1.00 0.00 H
-ATOM 9684 N VAL K 11 2.785 66.580 21.483 1.00 66.98 N
-ATOM 9685 CA VAL K 11 1.886 67.722 21.328 1.00 66.60 C
-ATOM 9686 C VAL K 11 1.022 67.864 22.569 1.00 67.36 C
-ATOM 9687 O VAL K 11 0.306 66.933 22.932 1.00 66.25 O
-ATOM 9688 CB VAL K 11 0.961 67.534 20.119 1.00 63.92 C
-ATOM 9689 CG1 VAL K 11 0.053 68.727 19.990 1.00 65.81 C
-ATOM 9690 CG2 VAL K 11 1.771 67.304 18.858 1.00 64.94 C
-ATOM 9691 H VAL K 11 2.386 65.643 21.555 1.00 0.00 H
-ATOM 9692 HA VAL K 11 2.473 68.629 21.205 1.00 0.00 H
-ATOM 9693 HB VAL K 11 0.340 66.688 20.295 1.00 0.00 H
-ATOM 9694 1HG1 VAL K 11 -0.609 68.559 19.152 1.00 0.00 H
-ATOM 9695 2HG1 VAL K 11 -0.530 68.839 20.905 1.00 0.00 H
-ATOM 9696 3HG1 VAL K 11 0.634 69.624 19.826 1.00 0.00 H
-ATOM 9697 1HG2 VAL K 11 1.093 67.152 18.015 1.00 0.00 H
-ATOM 9698 2HG2 VAL K 11 2.394 68.151 18.667 1.00 0.00 H
-ATOM 9699 3HG2 VAL K 11 2.388 66.424 18.984 1.00 0.00 H
-ATOM 9700 N ILE K 12 1.087 69.014 23.228 1.00 67.73 N
-ATOM 9701 CA ILE K 12 0.357 69.223 24.474 1.00 66.15 C
-ATOM 9702 C ILE K 12 -0.628 70.392 24.420 1.00 64.95 C
-ATOM 9703 O ILE K 12 -0.231 71.522 24.130 1.00 63.83 O
-ATOM 9704 CB ILE K 12 1.375 69.481 25.604 1.00 69.39 C
-ATOM 9705 CG1 ILE K 12 2.328 68.268 25.746 1.00 65.58 C
-ATOM 9706 CG2 ILE K 12 0.650 69.765 26.921 1.00 71.36 C
-ATOM 9707 CD1 ILE K 12 3.495 68.532 26.627 1.00 59.92 C
-ATOM 9708 H ILE K 12 1.694 69.751 22.876 1.00 0.00 H
-ATOM 9709 HA ILE K 12 -0.211 68.319 24.700 1.00 0.00 H
-ATOM 9710 HB ILE K 12 1.991 70.341 25.339 1.00 0.00 H
-ATOM 9711 1HG1 ILE K 12 1.784 67.442 26.156 1.00 0.00 H
-ATOM 9712 2HG1 ILE K 12 2.708 67.981 24.769 1.00 0.00 H
-ATOM 9713 1HG2 ILE K 12 1.379 69.955 27.700 1.00 0.00 H
-ATOM 9714 2HG2 ILE K 12 0.013 70.643 26.799 1.00 0.00 H
-ATOM 9715 3HG2 ILE K 12 0.040 68.913 27.197 1.00 0.00 H
-ATOM 9716 1HD1 ILE K 12 4.113 67.635 26.694 1.00 0.00 H
-ATOM 9717 2HD1 ILE K 12 4.083 69.352 26.216 1.00 0.00 H
-ATOM 9718 3HD1 ILE K 12 3.138 68.804 27.605 1.00 0.00 H
-ATOM 9719 N LYS K 13 -1.904 70.141 24.736 1.00 64.93 N
-ATOM 9720 CA LYS K 13 -2.891 71.219 24.762 1.00 65.84 C
-ATOM 9721 C LYS K 13 -3.507 71.409 26.130 1.00 65.80 C
-ATOM 9722 O LYS K 13 -4.064 70.487 26.722 1.00 64.00 O
-ATOM 9723 CB LYS K 13 -4.022 71.010 23.772 1.00 66.24 C
-ATOM 9724 CG LYS K 13 -5.030 72.180 23.803 1.00 64.47 C
-ATOM 9725 CD LYS K 13 -6.027 72.176 22.664 1.00 65.96 C
-ATOM 9726 CE LYS K 13 -6.987 71.011 22.724 1.00 64.18 C
-ATOM 9727 NZ LYS K 13 -8.115 71.228 21.784 1.00 60.33 N
-ATOM 9728 H LYS K 13 -2.198 69.191 24.940 1.00 0.00 H
-ATOM 9729 HA LYS K 13 -2.384 72.138 24.505 1.00 0.00 H
-ATOM 9730 1HB LYS K 13 -3.621 70.903 22.789 1.00 0.00 H
-ATOM 9731 2HB LYS K 13 -4.557 70.096 24.018 1.00 0.00 H
-ATOM 9732 1HG LYS K 13 -5.580 72.159 24.741 1.00 0.00 H
-ATOM 9733 2HG LYS K 13 -4.475 73.121 23.759 1.00 0.00 H
-ATOM 9734 1HD LYS K 13 -6.603 73.104 22.681 1.00 0.00 H
-ATOM 9735 2HD LYS K 13 -5.492 72.132 21.714 1.00 0.00 H
-ATOM 9736 1HE LYS K 13 -6.452 70.107 22.432 1.00 0.00 H
-ATOM 9737 2HE LYS K 13 -7.376 70.882 23.734 1.00 0.00 H
-ATOM 9738 1HZ LYS K 13 -8.746 70.443 21.792 1.00 0.00 H
-ATOM 9739 2HZ LYS K 13 -8.614 72.064 22.052 1.00 0.00 H
-ATOM 9740 3HZ LYS K 13 -7.730 71.365 20.841 1.00 0.00 H
-ATOM 9741 N ALA K 14 -3.423 72.610 26.658 1.00 66.69 N
-ATOM 9742 CA ALA K 14 -4.004 72.842 27.972 1.00 66.58 C
-ATOM 9743 C ALA K 14 -5.515 72.698 27.939 1.00 67.09 C
-ATOM 9744 O ALA K 14 -6.188 73.260 27.070 1.00 63.14 O
-ATOM 9745 CB ALA K 14 -3.647 74.211 28.448 1.00 61.61 C
-ATOM 9746 H ALA K 14 -2.974 73.363 26.129 1.00 0.00 H
-ATOM 9747 HA ALA K 14 -3.611 72.093 28.660 1.00 0.00 H
-ATOM 9748 1HB ALA K 14 -4.073 74.400 29.429 1.00 0.00 H
-ATOM 9749 2HB ALA K 14 -2.582 74.309 28.495 1.00 0.00 H
-ATOM 9750 3HB ALA K 14 -4.051 74.886 27.733 1.00 0.00 H
-ATOM 9751 N LEU K 15 -6.077 72.033 28.934 1.00 68.52 N
-ATOM 9752 CA LEU K 15 -7.529 71.938 29.063 1.00 70.99 C
-ATOM 9753 C LEU K 15 -8.040 72.877 30.151 1.00 72.89 C
-ATOM 9754 O LEU K 15 -9.248 73.071 30.314 1.00 73.08 O
-ATOM 9755 CB LEU K 15 -7.929 70.479 29.290 1.00 66.63 C
-ATOM 9756 CG LEU K 15 -8.238 69.629 27.995 1.00 69.17 C
-ATOM 9757 CD1 LEU K 15 -7.259 69.962 26.889 1.00 63.39 C
-ATOM 9758 CD2 LEU K 15 -8.119 68.142 28.348 1.00 64.58 C
-ATOM 9759 H LEU K 15 -5.494 71.568 29.631 1.00 0.00 H
-ATOM 9760 HA LEU K 15 -7.976 72.249 28.121 1.00 0.00 H
-ATOM 9761 1HB LEU K 15 -7.105 70.000 29.787 1.00 0.00 H
-ATOM 9762 2HB LEU K 15 -8.796 70.444 29.943 1.00 0.00 H
-ATOM 9763 HG LEU K 15 -9.246 69.845 27.642 1.00 0.00 H
-ATOM 9764 1HD1 LEU K 15 -7.477 69.365 26.007 1.00 0.00 H
-ATOM 9765 2HD1 LEU K 15 -7.342 71.012 26.633 1.00 0.00 H
-ATOM 9766 3HD1 LEU K 15 -6.284 69.759 27.223 1.00 0.00 H
-ATOM 9767 1HD2 LEU K 15 -8.334 67.529 27.468 1.00 0.00 H
-ATOM 9768 2HD2 LEU K 15 -7.116 67.925 28.696 1.00 0.00 H
-ATOM 9769 3HD2 LEU K 15 -8.825 67.898 29.127 1.00 0.00 H
-ATOM 9770 N GLU K 16 -7.100 73.484 30.867 1.00 74.24 N
-ATOM 9771 CA GLU K 16 -7.395 74.430 31.936 1.00 76.94 C
-ATOM 9772 C GLU K 16 -6.281 75.470 32.037 1.00 76.71 C
-ATOM 9773 O GLU K 16 -5.188 75.280 31.514 1.00 77.64 O
-ATOM 9774 CB GLU K 16 -7.602 73.722 33.287 1.00 80.56 C
-ATOM 9775 CG GLU K 16 -6.394 72.989 33.859 1.00 81.34 C
-ATOM 9776 CD GLU K 16 -6.730 72.286 35.172 1.00 87.32 C
-ATOM 9777 OE1 GLU K 16 -7.810 72.492 35.675 1.00 89.42 O
-ATOM 9778 OE2 GLU K 16 -5.928 71.499 35.635 1.00 93.67 O
-ATOM 9779 H GLU K 16 -6.135 73.262 30.665 1.00 0.00 H
-ATOM 9780 HA GLU K 16 -8.317 74.952 31.692 1.00 0.00 H
-ATOM 9781 1HB GLU K 16 -7.939 74.448 34.031 1.00 0.00 H
-ATOM 9782 2HB GLU K 16 -8.392 72.979 33.180 1.00 0.00 H
-ATOM 9783 1HG GLU K 16 -6.036 72.267 33.136 1.00 0.00 H
-ATOM 9784 2HG GLU K 16 -5.595 73.713 34.036 1.00 0.00 H
-ATOM 9785 N ASP K 17 -6.570 76.595 32.667 1.00 75.58 N
-ATOM 9786 CA ASP K 17 -5.561 77.628 32.880 1.00 75.76 C
-ATOM 9787 C ASP K 17 -4.452 77.128 33.814 1.00 75.05 C
-ATOM 9788 O ASP K 17 -4.712 76.312 34.699 1.00 75.31 O
-ATOM 9789 CB ASP K 17 -6.222 78.891 33.410 1.00 88.19 C
-ATOM 9790 CG ASP K 17 -7.104 79.532 32.353 1.00 94.80 C
-ATOM 9791 OD1 ASP K 17 -7.019 79.132 31.197 1.00 95.90 O
-ATOM 9792 OD2 ASP K 17 -7.881 80.386 32.697 1.00 97.41 O
-ATOM 9793 H ASP K 17 -7.495 76.724 33.047 1.00 0.00 H
-ATOM 9794 HA ASP K 17 -5.113 77.873 31.930 1.00 0.00 H
-ATOM 9795 1HB ASP K 17 -6.829 78.667 34.291 1.00 0.00 H
-ATOM 9796 2HB ASP K 17 -5.446 79.608 33.711 1.00 0.00 H
-ATOM 9797 N GLY K 18 -3.221 77.629 33.636 1.00 73.93 N
-ATOM 9798 CA GLY K 18 -2.109 77.274 34.521 1.00 73.88 C
-ATOM 9799 C GLY K 18 -1.436 75.906 34.273 1.00 73.96 C
-ATOM 9800 O GLY K 18 -0.901 75.311 35.210 1.00 73.39 O
-ATOM 9801 H GLY K 18 -3.048 78.313 32.891 1.00 0.00 H
-ATOM 9802 1HA GLY K 18 -1.349 78.054 34.429 1.00 0.00 H
-ATOM 9803 2HA GLY K 18 -2.461 77.306 35.551 1.00 0.00 H
-ATOM 9804 N VAL K 19 -1.471 75.391 33.047 1.00 74.37 N
-ATOM 9805 CA VAL K 19 -0.812 74.113 32.755 1.00 73.64 C
-ATOM 9806 C VAL K 19 0.684 74.347 32.622 1.00 72.53 C
-ATOM 9807 O VAL K 19 1.125 75.286 31.949 1.00 71.27 O
-ATOM 9808 CB VAL K 19 -1.387 73.444 31.492 1.00 76.81 C
-ATOM 9809 CG1 VAL K 19 -0.579 72.187 31.092 1.00 81.35 C
-ATOM 9810 CG2 VAL K 19 -2.814 73.048 31.785 1.00 76.39 C
-ATOM 9811 H VAL K 19 -1.911 75.902 32.286 1.00 0.00 H
-ATOM 9812 HA VAL K 19 -0.984 73.439 33.597 1.00 0.00 H
-ATOM 9813 HB VAL K 19 -1.353 74.144 30.668 1.00 0.00 H
-ATOM 9814 1HG1 VAL K 19 -1.020 71.744 30.200 1.00 0.00 H
-ATOM 9815 2HG1 VAL K 19 0.461 72.462 30.885 1.00 0.00 H
-ATOM 9816 3HG1 VAL K 19 -0.604 71.461 31.909 1.00 0.00 H
-ATOM 9817 1HG2 VAL K 19 -3.259 72.588 30.922 1.00 0.00 H
-ATOM 9818 2HG2 VAL K 19 -2.838 72.343 32.615 1.00 0.00 H
-ATOM 9819 3HG2 VAL K 19 -3.366 73.931 32.056 1.00 0.00 H
-ATOM 9820 N ASN K 20 1.465 73.533 33.309 1.00 71.91 N
-ATOM 9821 CA ASN K 20 2.912 73.706 33.328 1.00 73.16 C
-ATOM 9822 C ASN K 20 3.644 72.529 32.690 1.00 72.75 C
-ATOM 9823 O ASN K 20 3.548 71.392 33.163 1.00 71.11 O
-ATOM 9824 CB ASN K 20 3.369 73.947 34.756 1.00 81.30 C
-ATOM 9825 CG ASN K 20 4.819 74.332 34.884 1.00 87.32 C
-ATOM 9826 OD1 ASN K 20 5.610 74.188 33.953 1.00 93.01 O
-ATOM 9827 ND2 ASN K 20 5.178 74.823 36.052 1.00 82.44 N
-ATOM 9828 H ASN K 20 1.035 72.774 33.834 1.00 0.00 H
-ATOM 9829 HA ASN K 20 3.160 74.587 32.739 1.00 0.00 H
-ATOM 9830 1HB ASN K 20 2.752 74.734 35.198 1.00 0.00 H
-ATOM 9831 2HB ASN K 20 3.210 73.048 35.335 1.00 0.00 H
-ATOM 9832 1HD2 ASN K 20 6.128 75.096 36.214 1.00 0.00 H
-ATOM 9833 2HD2 ASN K 20 4.503 74.926 36.781 1.00 0.00 H
-ATOM 9834 N VAL K 21 4.316 72.782 31.564 1.00 72.83 N
-ATOM 9835 CA VAL K 21 5.057 71.723 30.900 1.00 71.38 C
-ATOM 9836 C VAL K 21 6.537 71.911 31.244 1.00 71.61 C
-ATOM 9837 O VAL K 21 7.135 72.948 30.963 1.00 70.16 O
-ATOM 9838 CB VAL K 21 4.840 71.764 29.385 1.00 65.67 C
-ATOM 9839 CG1 VAL K 21 5.632 70.648 28.767 1.00 68.55 C
-ATOM 9840 CG2 VAL K 21 3.345 71.646 29.080 1.00 63.57 C
-ATOM 9841 H VAL K 21 4.349 73.726 31.186 1.00 0.00 H
-ATOM 9842 HA VAL K 21 4.726 70.758 31.271 1.00 0.00 H
-ATOM 9843 HB VAL K 21 5.218 72.704 28.983 1.00 0.00 H
-ATOM 9844 1HG1 VAL K 21 5.507 70.652 27.696 1.00 0.00 H
-ATOM 9845 2HG1 VAL K 21 6.688 70.778 29.007 1.00 0.00 H
-ATOM 9846 3HG1 VAL K 21 5.280 69.706 29.172 1.00 0.00 H
-ATOM 9847 1HG2 VAL K 21 3.192 71.674 28.002 1.00 0.00 H
-ATOM 9848 2HG2 VAL K 21 2.965 70.711 29.479 1.00 0.00 H
-ATOM 9849 3HG2 VAL K 21 2.814 72.483 29.541 1.00 0.00 H
-ATOM 9850 N ILE K 22 7.112 70.921 31.911 1.00 71.20 N
-ATOM 9851 CA ILE K 22 8.448 71.074 32.458 1.00 70.22 C
-ATOM 9852 C ILE K 22 9.498 70.206 31.768 1.00 70.21 C
-ATOM 9853 O ILE K 22 9.322 69.002 31.581 1.00 70.22 O
-ATOM 9854 CB ILE K 22 8.408 70.761 33.968 1.00 65.80 C
-ATOM 9855 CG1 ILE K 22 7.438 71.716 34.671 1.00 60.59 C
-ATOM 9856 CG2 ILE K 22 9.788 70.883 34.560 1.00 58.94 C
-ATOM 9857 CD1 ILE K 22 7.142 71.327 36.097 1.00 62.88 C
-ATOM 9858 H ILE K 22 6.592 70.078 32.086 1.00 0.00 H
-ATOM 9859 HA ILE K 22 8.742 72.108 32.341 1.00 0.00 H
-ATOM 9860 HB ILE K 22 8.038 69.783 34.119 1.00 0.00 H
-ATOM 9861 1HG1 ILE K 22 7.852 72.717 34.659 1.00 0.00 H
-ATOM 9862 2HG1 ILE K 22 6.493 71.723 34.127 1.00 0.00 H
-ATOM 9863 1HG2 ILE K 22 9.745 70.662 35.626 1.00 0.00 H
-ATOM 9864 2HG2 ILE K 22 10.459 70.182 34.073 1.00 0.00 H
-ATOM 9865 3HG2 ILE K 22 10.154 71.902 34.410 1.00 0.00 H
-ATOM 9866 1HD1 ILE K 22 6.443 72.041 36.532 1.00 0.00 H
-ATOM 9867 2HD1 ILE K 22 6.700 70.329 36.114 1.00 0.00 H
-ATOM 9868 3HD1 ILE K 22 8.068 71.327 36.672 1.00 0.00 H
-ATOM 9869 N GLY K 23 10.591 70.848 31.356 1.00 68.10 N
-ATOM 9870 CA GLY K 23 11.693 70.135 30.724 1.00 66.40 C
-ATOM 9871 C GLY K 23 12.682 69.662 31.783 1.00 66.18 C
-ATOM 9872 O GLY K 23 13.153 70.459 32.609 1.00 66.25 O
-ATOM 9873 H GLY K 23 10.665 71.844 31.526 1.00 0.00 H
-ATOM 9874 1HA GLY K 23 11.312 69.280 30.164 1.00 0.00 H
-ATOM 9875 2HA GLY K 23 12.199 70.793 30.016 1.00 0.00 H
-ATOM 9876 N LEU K 24 13.018 68.364 31.712 1.00 64.83 N
-ATOM 9877 CA LEU K 24 13.958 67.685 32.610 1.00 63.59 C
-ATOM 9878 C LEU K 24 15.276 67.410 31.896 1.00 63.02 C
-ATOM 9879 O LEU K 24 15.297 66.878 30.772 1.00 62.05 O
-ATOM 9880 CB LEU K 24 13.364 66.361 33.099 1.00 60.04 C
-ATOM 9881 CG LEU K 24 12.304 66.435 34.224 1.00 67.47 C
-ATOM 9882 CD1 LEU K 24 10.998 67.014 33.673 1.00 59.94 C
-ATOM 9883 CD2 LEU K 24 12.076 65.033 34.788 1.00 72.45 C
-ATOM 9884 H LEU K 24 12.558 67.796 31.004 1.00 0.00 H
-ATOM 9885 HA LEU K 24 14.156 68.324 33.464 1.00 0.00 H
-ATOM 9886 1HB LEU K 24 12.888 65.913 32.256 1.00 0.00 H
-ATOM 9887 2HB LEU K 24 14.175 65.708 33.431 1.00 0.00 H
-ATOM 9888 HG LEU K 24 12.660 67.092 35.018 1.00 0.00 H
-ATOM 9889 1HD1 LEU K 24 10.267 67.069 34.472 1.00 0.00 H
-ATOM 9890 2HD1 LEU K 24 11.167 68.000 33.288 1.00 0.00 H
-ATOM 9891 3HD1 LEU K 24 10.616 66.376 32.871 1.00 0.00 H
-ATOM 9892 1HD2 LEU K 24 11.335 65.075 35.591 1.00 0.00 H
-ATOM 9893 2HD2 LEU K 24 11.715 64.377 34.002 1.00 0.00 H
-ATOM 9894 3HD2 LEU K 24 13.016 64.647 35.185 1.00 0.00 H
-ATOM 9895 N THR K 25 16.374 67.760 32.564 1.00 62.26 N
-ATOM 9896 CA THR K 25 17.699 67.710 31.957 1.00 62.03 C
-ATOM 9897 C THR K 25 18.195 66.342 31.532 1.00 60.59 C
-ATOM 9898 O THR K 25 17.941 65.332 32.186 1.00 60.59 O
-ATOM 9899 CB THR K 25 18.764 68.287 32.910 1.00 57.99 C
-ATOM 9900 OG1 THR K 25 18.759 67.552 34.154 1.00 56.19 O
-ATOM 9901 CG2 THR K 25 18.504 69.732 33.174 1.00 51.65 C
-ATOM 9902 H THR K 25 16.274 68.144 33.501 1.00 0.00 H
-ATOM 9903 HA THR K 25 17.665 68.344 31.083 1.00 0.00 H
-ATOM 9904 HB THR K 25 19.750 68.193 32.453 1.00 0.00 H
-ATOM 9905 HG1 THR K 25 19.508 66.904 34.188 1.00 0.00 H
-ATOM 9906 1HG2 THR K 25 19.270 70.118 33.843 1.00 0.00 H
-ATOM 9907 2HG2 THR K 25 18.533 70.273 32.230 1.00 0.00 H
-ATOM 9908 3HG2 THR K 25 17.533 69.849 33.629 1.00 0.00 H
-ATOM 9909 N ARG K 26 18.956 66.359 30.437 1.00 57.21 N
-ATOM 9910 CA ARG K 26 19.671 65.208 29.910 1.00 57.02 C
-ATOM 9911 C ARG K 26 21.078 65.175 30.477 1.00 55.71 C
-ATOM 9912 O ARG K 26 21.799 66.171 30.423 1.00 57.12 O
-ATOM 9913 CB ARG K 26 19.784 65.275 28.392 1.00 60.52 C
-ATOM 9914 CG ARG K 26 20.439 64.053 27.750 1.00 66.49 C
-ATOM 9915 CD ARG K 26 20.608 64.212 26.275 1.00 60.94 C
-ATOM 9916 NE ARG K 26 19.338 64.407 25.600 1.00 60.07 N
-ATOM 9917 CZ ARG K 26 18.495 63.426 25.262 1.00 56.19 C
-ATOM 9918 NH1 ARG K 26 18.790 62.179 25.530 1.00 57.13 N
-ATOM 9919 NH2 ARG K 26 17.376 63.747 24.660 1.00 49.05 N
-ATOM 9920 H ARG K 26 19.031 67.242 29.941 1.00 0.00 H
-ATOM 9921 HA ARG K 26 19.150 64.298 30.206 1.00 0.00 H
-ATOM 9922 1HB ARG K 26 18.797 65.402 27.948 1.00 0.00 H
-ATOM 9923 2HB ARG K 26 20.377 66.145 28.111 1.00 0.00 H
-ATOM 9924 1HG ARG K 26 21.430 63.901 28.181 1.00 0.00 H
-ATOM 9925 2HG ARG K 26 19.828 63.170 27.933 1.00 0.00 H
-ATOM 9926 1HD ARG K 26 21.240 65.073 26.073 1.00 0.00 H
-ATOM 9927 2HD ARG K 26 21.079 63.316 25.869 1.00 0.00 H
-ATOM 9928 HE ARG K 26 19.054 65.358 25.341 1.00 0.00 H
-ATOM 9929 1HH1 ARG K 26 19.665 61.963 25.988 1.00 0.00 H
-ATOM 9930 2HH1 ARG K 26 18.160 61.434 25.267 1.00 0.00 H
-ATOM 9931 1HH2 ARG K 26 17.205 64.735 24.467 1.00 0.00 H
-ATOM 9932 2HH2 ARG K 26 16.689 63.042 24.405 1.00 0.00 H
-ATOM 9933 N GLY K 27 21.480 64.031 31.008 1.00 54.08 N
-ATOM 9934 CA GLY K 27 22.823 63.887 31.547 1.00 55.69 C
-ATOM 9935 C GLY K 27 22.800 63.166 32.881 1.00 58.14 C
-ATOM 9936 O GLY K 27 21.754 62.692 33.325 1.00 60.70 O
-ATOM 9937 H GLY K 27 20.843 63.247 31.044 1.00 0.00 H
-ATOM 9938 1HA GLY K 27 23.437 63.334 30.836 1.00 0.00 H
-ATOM 9939 2HA GLY K 27 23.281 64.868 31.666 1.00 0.00 H
-ATOM 9940 N ALA K 28 23.957 63.074 33.525 1.00 57.47 N
-ATOM 9941 CA ALA K 28 24.066 62.381 34.806 1.00 60.30 C
-ATOM 9942 C ALA K 28 23.157 63.011 35.858 1.00 61.47 C
-ATOM 9943 O ALA K 28 22.596 62.311 36.702 1.00 60.83 O
-ATOM 9944 CB ALA K 28 25.502 62.392 35.292 1.00 54.94 C
-ATOM 9945 H ALA K 28 24.782 63.489 33.111 1.00 0.00 H
-ATOM 9946 HA ALA K 28 23.743 61.344 34.657 1.00 0.00 H
-ATOM 9947 1HB ALA K 28 25.565 61.848 36.233 1.00 0.00 H
-ATOM 9948 2HB ALA K 28 26.146 61.917 34.553 1.00 0.00 H
-ATOM 9949 3HB ALA K 28 25.825 63.423 35.448 1.00 0.00 H
-ATOM 9950 N ASP K 29 23.018 64.337 35.819 1.00 61.96 N
-ATOM 9951 CA ASP K 29 22.178 65.038 36.776 1.00 64.40 C
-ATOM 9952 C ASP K 29 20.792 65.327 36.200 1.00 65.76 C
-ATOM 9953 O ASP K 29 20.676 66.030 35.186 1.00 65.21 O
-ATOM 9954 CB ASP K 29 22.785 66.373 37.202 1.00 63.92 C
-ATOM 9955 CG ASP K 29 24.066 66.267 38.040 1.00 74.67 C
-ATOM 9956 OD1 ASP K 29 24.372 65.203 38.515 1.00 76.16 O
-ATOM 9957 OD2 ASP K 29 24.695 67.290 38.234 1.00 77.93 O
-ATOM 9958 H ASP K 29 23.504 64.859 35.101 1.00 0.00 H
-ATOM 9959 HA ASP K 29 22.053 64.413 37.658 1.00 0.00 H
-ATOM 9960 1HB ASP K 29 22.992 66.982 36.320 1.00 0.00 H
-ATOM 9961 2HB ASP K 29 22.042 66.905 37.793 1.00 0.00 H
-ATOM 9962 N THR K 30 19.753 64.821 36.861 1.00 66.39 N
-ATOM 9963 CA THR K 30 18.399 65.100 36.395 1.00 67.36 C
-ATOM 9964 C THR K 30 17.761 66.166 37.282 1.00 70.91 C
-ATOM 9965 O THR K 30 17.637 65.994 38.492 1.00 70.32 O
-ATOM 9966 CB THR K 30 17.492 63.854 36.403 1.00 61.54 C
-ATOM 9967 OG1 THR K 30 18.040 62.844 35.552 1.00 41.25 O
-ATOM 9968 CG2 THR K 30 16.089 64.249 35.882 1.00 46.56 C
-ATOM 9969 H THR K 30 19.906 64.238 37.673 1.00 0.00 H
-ATOM 9970 HA THR K 30 18.441 65.471 35.378 1.00 0.00 H
-ATOM 9971 HB THR K 30 17.416 63.467 37.404 1.00 0.00 H
-ATOM 9972 HG1 THR K 30 18.849 62.505 35.948 1.00 0.00 H
-ATOM 9973 1HG2 THR K 30 15.435 63.379 35.875 1.00 0.00 H
-ATOM 9974 2HG2 THR K 30 15.661 65.014 36.528 1.00 0.00 H
-ATOM 9975 3HG2 THR K 30 16.177 64.642 34.863 1.00 0.00 H
-ATOM 9976 N ARG K 31 17.338 67.257 36.658 1.00 71.32 N
-ATOM 9977 CA ARG K 31 16.691 68.364 37.349 1.00 70.99 C
-ATOM 9978 C ARG K 31 15.818 69.107 36.354 1.00 71.17 C
-ATOM 9979 O ARG K 31 15.924 68.890 35.152 1.00 70.03 O
-ATOM 9980 CB ARG K 31 17.726 69.326 37.932 1.00 69.21 C
-ATOM 9981 CG ARG K 31 18.639 69.983 36.891 1.00 63.94 C
-ATOM 9982 CD ARG K 31 19.579 71.001 37.492 1.00 55.58 C
-ATOM 9983 NE ARG K 31 20.578 70.415 38.395 1.00 58.86 N
-ATOM 9984 CZ ARG K 31 21.799 69.944 38.016 1.00 64.10 C
-ATOM 9985 NH1 ARG K 31 22.178 70.001 36.758 1.00 65.67 N
-ATOM 9986 NH2 ARG K 31 22.621 69.428 38.923 1.00 52.57 N
-ATOM 9987 H ARG K 31 17.531 67.338 35.667 1.00 0.00 H
-ATOM 9988 HA ARG K 31 16.071 67.973 38.155 1.00 0.00 H
-ATOM 9989 1HB ARG K 31 17.219 70.124 38.474 1.00 0.00 H
-ATOM 9990 2HB ARG K 31 18.360 68.796 38.642 1.00 0.00 H
-ATOM 9991 1HG ARG K 31 19.230 69.203 36.406 1.00 0.00 H
-ATOM 9992 2HG ARG K 31 18.019 70.483 36.146 1.00 0.00 H
-ATOM 9993 1HD ARG K 31 20.110 71.501 36.682 1.00 0.00 H
-ATOM 9994 2HD ARG K 31 19.003 71.737 38.051 1.00 0.00 H
-ATOM 9995 HE ARG K 31 20.334 70.348 39.376 1.00 0.00 H
-ATOM 9996 1HH1 ARG K 31 21.562 70.397 36.060 1.00 0.00 H
-ATOM 9997 2HH1 ARG K 31 23.089 69.652 36.489 1.00 0.00 H
-ATOM 9998 1HH2 ARG K 31 22.341 69.379 39.890 1.00 0.00 H
-ATOM 9999 2HH2 ARG K 31 23.544 69.055 38.644 1.00 0.00 H
-ATOM 10000 N PHE K 32 14.905 69.954 36.823 1.00 72.26 N
-ATOM 10001 CA PHE K 32 14.154 70.709 35.816 1.00 73.67 C
-ATOM 10002 C PHE K 32 15.087 71.772 35.255 1.00 73.87 C
-ATOM 10003 O PHE K 32 15.953 72.257 35.980 1.00 75.86 O
-ATOM 10004 CB PHE K 32 12.916 71.365 36.412 1.00 74.97 C
-ATOM 10005 CG PHE K 32 13.142 72.706 37.029 1.00 45.00 C
-ATOM 10006 CD1 PHE K 32 13.494 72.866 38.363 1.00 45.00 C
-ATOM 10007 CD2 PHE K 32 12.962 73.831 36.249 1.00 45.00 C
-ATOM 10008 CE1 PHE K 32 13.672 74.147 38.881 1.00 45.00 C
-ATOM 10009 CE2 PHE K 32 13.134 75.091 36.750 1.00 45.00 C
-ATOM 10010 CZ PHE K 32 13.492 75.256 38.072 1.00 45.00 C
-ATOM 10011 H PHE K 32 14.772 70.111 37.804 1.00 0.00 H
-ATOM 10012 HA PHE K 32 13.850 70.036 35.014 1.00 0.00 H
-ATOM 10013 1HB PHE K 32 12.190 71.494 35.625 1.00 0.00 H
-ATOM 10014 2HB PHE K 32 12.474 70.717 37.162 1.00 0.00 H
-ATOM 10015 HD1 PHE K 32 13.632 71.991 38.993 1.00 0.00 H
-ATOM 10016 HD2 PHE K 32 12.674 73.700 35.208 1.00 0.00 H
-ATOM 10017 HE1 PHE K 32 13.950 74.277 39.928 1.00 0.00 H
-ATOM 10018 HE2 PHE K 32 12.982 75.958 36.108 1.00 0.00 H
-ATOM 10019 HZ PHE K 32 13.623 76.258 38.479 1.00 0.00 H
-ATOM 10020 N HIS K 33 14.877 72.194 34.008 1.00 72.88 N
-ATOM 10021 CA HIS K 33 15.646 73.343 33.528 1.00 70.45 C
-ATOM 10022 C HIS K 33 14.722 74.417 32.965 1.00 68.10 C
-ATOM 10023 O HIS K 33 15.120 75.576 32.837 1.00 67.54 O
-ATOM 10024 CB HIS K 33 16.675 72.942 32.477 1.00 74.84 C
-ATOM 10025 CG HIS K 33 16.132 72.472 31.151 1.00 71.41 C
-ATOM 10026 ND1 HIS K 33 15.769 73.357 30.157 1.00 74.77 N
-ATOM 10027 CD2 HIS K 33 15.887 71.235 30.654 1.00 68.11 C
-ATOM 10028 CE1 HIS K 33 15.328 72.690 29.114 1.00 72.63 C
-ATOM 10029 NE2 HIS K 33 15.389 71.405 29.386 1.00 74.67 N
-ATOM 10030 H HIS K 33 14.201 71.720 33.425 1.00 0.00 H
-ATOM 10031 HA HIS K 33 16.182 73.798 34.363 1.00 0.00 H
-ATOM 10032 1HB HIS K 33 17.310 73.803 32.265 1.00 0.00 H
-ATOM 10033 2HB HIS K 33 17.311 72.180 32.881 1.00 0.00 H
-ATOM 10034 HD2 HIS K 33 16.047 70.289 31.160 1.00 0.00 H
-ATOM 10035 HE1 HIS K 33 14.977 73.130 28.177 1.00 0.00 H
-ATOM 10036 HE2 HIS K 33 15.113 70.674 28.747 1.00 0.00 H
-ATOM 10037 N HIS K 34 13.484 74.043 32.661 1.00 64.91 N
-ATOM 10038 CA HIS K 34 12.558 75.010 32.080 1.00 66.19 C
-ATOM 10039 C HIS K 34 11.095 74.685 32.324 1.00 68.79 C
-ATOM 10040 O HIS K 34 10.666 73.536 32.207 1.00 68.51 O
-ATOM 10041 CB HIS K 34 12.799 75.156 30.573 1.00 70.91 C
-ATOM 10042 CG HIS K 34 11.943 76.190 29.907 1.00 69.71 C
-ATOM 10043 ND1 HIS K 34 12.128 77.548 30.083 1.00 68.41 N
-ATOM 10044 CD2 HIS K 34 10.909 76.058 29.049 1.00 65.44 C
-ATOM 10045 CE1 HIS K 34 11.227 78.203 29.358 1.00 68.50 C
-ATOM 10046 NE2 HIS K 34 10.485 77.316 28.723 1.00 70.10 N
-ATOM 10047 H HIS K 34 13.218 73.068 32.783 1.00 0.00 H
-ATOM 10048 HA HIS K 34 12.738 75.984 32.533 1.00 0.00 H
-ATOM 10049 1HB HIS K 34 13.843 75.418 30.395 1.00 0.00 H
-ATOM 10050 2HB HIS K 34 12.613 74.201 30.087 1.00 0.00 H
-ATOM 10051 HD2 HIS K 34 10.487 75.125 28.679 1.00 0.00 H
-ATOM 10052 HE1 HIS K 34 11.120 79.284 29.290 1.00 0.00 H
-ATOM 10053 HE2 HIS K 34 9.712 77.514 28.081 1.00 0.00 H
-ATOM 10054 N SER K 35 10.320 75.722 32.628 1.00 71.63 N
-ATOM 10055 CA SER K 35 8.878 75.595 32.816 1.00 73.34 C
-ATOM 10056 C SER K 35 8.128 76.436 31.782 1.00 74.33 C
-ATOM 10057 O SER K 35 8.217 77.666 31.791 1.00 76.13 O
-ATOM 10058 CB SER K 35 8.502 76.049 34.214 1.00 80.70 C
-ATOM 10059 OG SER K 35 9.106 75.239 35.182 1.00 89.74 O
-ATOM 10060 H SER K 35 10.746 76.636 32.713 1.00 0.00 H
-ATOM 10061 HA SER K 35 8.584 74.552 32.689 1.00 0.00 H
-ATOM 10062 1HB SER K 35 8.805 77.086 34.358 1.00 0.00 H
-ATOM 10063 2HB SER K 35 7.425 76.009 34.328 1.00 0.00 H
-ATOM 10064 HG SER K 35 8.840 74.340 34.970 1.00 0.00 H
-ATOM 10065 N GLU K 36 7.406 75.760 30.886 1.00 74.87 N
-ATOM 10066 CA GLU K 36 6.667 76.417 29.811 1.00 75.61 C
-ATOM 10067 C GLU K 36 5.176 76.426 30.154 1.00 77.36 C
-ATOM 10068 O GLU K 36 4.568 75.379 30.369 1.00 77.57 O
-ATOM 10069 CB GLU K 36 6.905 75.682 28.483 1.00 67.50 C
-ATOM 10070 CG GLU K 36 6.355 76.375 27.219 1.00 67.53 C
-ATOM 10071 CD GLU K 36 7.191 77.554 26.761 1.00 67.31 C
-ATOM 10072 OE1 GLU K 36 8.384 77.524 26.929 1.00 65.93 O
-ATOM 10073 OE2 GLU K 36 6.638 78.484 26.218 1.00 55.58 O
-ATOM 10074 H GLU K 36 7.373 74.749 30.944 1.00 0.00 H
-ATOM 10075 HA GLU K 36 7.009 77.448 29.718 1.00 0.00 H
-ATOM 10076 1HB GLU K 36 7.969 75.528 28.338 1.00 0.00 H
-ATOM 10077 2HB GLU K 36 6.443 74.700 28.539 1.00 0.00 H
-ATOM 10078 1HG GLU K 36 6.327 75.658 26.413 1.00 0.00 H
-ATOM 10079 2HG GLU K 36 5.335 76.711 27.408 1.00 0.00 H
-ATOM 10080 N LYS K 37 4.600 77.610 30.277 1.00 78.20 N
-ATOM 10081 CA LYS K 37 3.207 77.689 30.690 1.00 78.96 C
-ATOM 10082 C LYS K 37 2.224 77.742 29.526 1.00 79.00 C
-ATOM 10083 O LYS K 37 2.448 78.444 28.532 1.00 77.49 O
-ATOM 10084 CB LYS K 37 3.001 78.907 31.603 1.00 78.48 C
-ATOM 10085 CG LYS K 37 3.737 78.807 32.972 1.00 45.00 C
-ATOM 10086 CD LYS K 37 3.504 80.047 33.862 1.00 45.00 C
-ATOM 10087 CE LYS K 37 4.237 79.899 35.202 1.00 45.00 C
-ATOM 10088 NZ LYS K 37 4.035 81.075 36.085 1.00 45.00 N
-ATOM 10089 H LYS K 37 5.129 78.450 30.093 1.00 0.00 H
-ATOM 10090 HA LYS K 37 2.970 76.794 31.265 1.00 0.00 H
-ATOM 10091 1HB LYS K 37 3.365 79.809 31.089 1.00 0.00 H
-ATOM 10092 2HB LYS K 37 1.931 79.048 31.779 1.00 0.00 H
-ATOM 10093 1HG LYS K 37 3.394 77.910 33.507 1.00 0.00 H
-ATOM 10094 2HG LYS K 37 4.808 78.702 32.798 1.00 0.00 H
-ATOM 10095 1HD LYS K 37 3.876 80.938 33.351 1.00 0.00 H
-ATOM 10096 2HD LYS K 37 2.442 80.182 34.065 1.00 0.00 H
-ATOM 10097 1HE LYS K 37 3.867 79.012 35.710 1.00 0.00 H
-ATOM 10098 2HE LYS K 37 5.307 79.778 35.016 1.00 0.00 H
-ATOM 10099 1HZ LYS K 37 4.529 80.935 36.957 1.00 0.00 H
-ATOM 10100 2HZ LYS K 37 4.388 81.901 35.629 1.00 0.00 H
-ATOM 10101 3HZ LYS K 37 3.050 81.186 36.271 1.00 0.00 H
-ATOM 10102 N LEU K 38 1.119 77.015 29.688 1.00 79.03 N
-ATOM 10103 CA LEU K 38 -0.012 77.025 28.760 1.00 81.55 C
-ATOM 10104 C LEU K 38 -1.313 77.319 29.502 1.00 82.78 C
-ATOM 10105 O LEU K 38 -1.580 76.757 30.570 1.00 83.45 O
-ATOM 10106 CB LEU K 38 -0.170 75.666 28.067 1.00 81.01 C
-ATOM 10107 CG LEU K 38 0.957 75.183 27.159 1.00 81.46 C
-ATOM 10108 CD1 LEU K 38 0.650 73.718 26.741 1.00 83.57 C
-ATOM 10109 CD2 LEU K 38 1.049 76.105 25.946 1.00 81.49 C
-ATOM 10110 H LEU K 38 1.054 76.433 30.519 1.00 0.00 H
-ATOM 10111 HA LEU K 38 0.150 77.804 28.009 1.00 0.00 H
-ATOM 10112 1HB LEU K 38 -0.300 74.912 28.828 1.00 0.00 H
-ATOM 10113 2HB LEU K 38 -1.070 75.711 27.453 1.00 0.00 H
-ATOM 10114 HG LEU K 38 1.910 75.193 27.700 1.00 0.00 H
-ATOM 10115 1HD1 LEU K 38 1.435 73.346 26.098 1.00 0.00 H
-ATOM 10116 2HD1 LEU K 38 0.593 73.099 27.631 1.00 0.00 H
-ATOM 10117 3HD1 LEU K 38 -0.303 73.672 26.204 1.00 0.00 H
-ATOM 10118 1HD2 LEU K 38 1.842 75.781 25.293 1.00 0.00 H
-ATOM 10119 2HD2 LEU K 38 0.098 76.085 25.407 1.00 0.00 H
-ATOM 10120 3HD2 LEU K 38 1.258 77.117 26.282 1.00 0.00 H
-ATOM 10121 N ASP K 39 -2.162 78.151 28.921 1.00 81.69 N
-ATOM 10122 CA ASP K 39 -3.452 78.399 29.528 1.00 83.05 C
-ATOM 10123 C ASP K 39 -4.491 77.672 28.670 1.00 82.89 C
-ATOM 10124 O ASP K 39 -4.123 77.138 27.629 1.00 82.27 O
-ATOM 10125 CB ASP K 39 -3.649 79.906 29.761 1.00 82.64 C
-ATOM 10126 CG ASP K 39 -2.554 80.390 30.800 1.00 83.93 C
-ATOM 10127 OD1 ASP K 39 -2.521 79.859 31.922 1.00 84.88 O
-ATOM 10128 OD2 ASP K 39 -1.739 81.239 30.467 1.00 75.49 O
-ATOM 10129 H ASP K 39 -1.940 78.631 28.052 1.00 0.00 H
-ATOM 10130 HA ASP K 39 -3.477 77.938 30.513 1.00 0.00 H
-ATOM 10131 1HB ASP K 39 -3.568 80.472 28.824 1.00 0.00 H
-ATOM 10132 2HB ASP K 39 -4.633 80.081 30.190 1.00 0.00 H
-ATOM 10133 N LYS K 40 -5.748 77.568 29.115 1.00 82.64 N
-ATOM 10134 CA LYS K 40 -6.718 76.721 28.403 1.00 81.19 C
-ATOM 10135 C LYS K 40 -6.795 76.960 26.902 1.00 80.06 C
-ATOM 10136 O LYS K 40 -6.958 78.090 26.444 1.00 79.57 O
-ATOM 10137 CB LYS K 40 -8.105 76.930 28.997 1.00 88.33 C
-ATOM 10138 CG LYS K 40 -9.194 76.083 28.385 1.00 92.76 C
-ATOM 10139 CD LYS K 40 -10.487 76.267 29.130 1.00 96.40 C
-ATOM 10140 CE LYS K 40 -11.541 75.280 28.660 1.00 98.44 C
-ATOM 10141 NZ LYS K 40 -12.061 75.610 27.287 1.00 95.59 N
-ATOM 10142 H LYS K 40 -6.054 78.055 29.962 1.00 0.00 H
-ATOM 10143 HA LYS K 40 -6.429 75.684 28.558 1.00 0.00 H
-ATOM 10144 1HB LYS K 40 -8.077 76.710 30.059 1.00 0.00 H
-ATOM 10145 2HB LYS K 40 -8.385 77.974 28.900 1.00 0.00 H
-ATOM 10146 1HG LYS K 40 -9.343 76.376 27.344 1.00 0.00 H
-ATOM 10147 2HG LYS K 40 -8.912 75.037 28.413 1.00 0.00 H
-ATOM 10148 1HD LYS K 40 -10.311 76.134 30.200 1.00 0.00 H
-ATOM 10149 2HD LYS K 40 -10.855 77.285 28.957 1.00 0.00 H
-ATOM 10150 1HE LYS K 40 -11.101 74.275 28.643 1.00 0.00 H
-ATOM 10151 2HE LYS K 40 -12.368 75.290 29.368 1.00 0.00 H
-ATOM 10152 1HZ LYS K 40 -12.759 74.927 27.013 1.00 0.00 H
-ATOM 10153 2HZ LYS K 40 -12.475 76.534 27.294 1.00 0.00 H
-ATOM 10154 3HZ LYS K 40 -11.294 75.592 26.623 1.00 0.00 H
-ATOM 10155 N GLY K 41 -6.709 75.865 26.135 1.00 79.66 N
-ATOM 10156 CA GLY K 41 -6.819 75.892 24.679 1.00 78.34 C
-ATOM 10157 C GLY K 41 -5.494 76.091 23.935 1.00 76.89 C
-ATOM 10158 O GLY K 41 -5.437 76.003 22.706 1.00 75.87 O
-ATOM 10159 H GLY K 41 -6.550 74.963 26.578 1.00 0.00 H
-ATOM 10160 1HA GLY K 41 -7.297 74.974 24.343 1.00 0.00 H
-ATOM 10161 2HA GLY K 41 -7.491 76.707 24.410 1.00 0.00 H
-ATOM 10162 N GLU K 42 -4.420 76.349 24.664 1.00 76.74 N
-ATOM 10163 CA GLU K 42 -3.144 76.644 24.019 1.00 76.91 C
-ATOM 10164 C GLU K 42 -2.298 75.394 23.761 1.00 77.06 C
-ATOM 10165 O GLU K 42 -2.309 74.455 24.562 1.00 77.71 O
-ATOM 10166 CB GLU K 42 -2.481 77.686 24.882 1.00 68.67 C
-ATOM 10167 CG GLU K 42 -3.399 78.957 24.916 1.00 79.24 C
-ATOM 10168 CD GLU K 42 -2.955 80.031 25.790 1.00 76.34 C
-ATOM 10169 OE1 GLU K 42 -2.030 79.805 26.530 1.00 80.91 O
-ATOM 10170 OE2 GLU K 42 -3.490 81.102 25.723 1.00 74.71 O
-ATOM 10171 H GLU K 42 -4.495 76.414 25.679 1.00 0.00 H
-ATOM 10172 HA GLU K 42 -3.352 77.103 23.053 1.00 0.00 H
-ATOM 10173 1HB GLU K 42 -2.366 77.302 25.896 1.00 0.00 H
-ATOM 10174 2HB GLU K 42 -1.491 77.918 24.499 1.00 0.00 H
-ATOM 10175 1HG GLU K 42 -3.496 79.336 23.901 1.00 0.00 H
-ATOM 10176 2HG GLU K 42 -4.394 78.664 25.250 1.00 0.00 H
-ATOM 10177 N VAL K 43 -1.574 75.378 22.620 1.00 76.63 N
-ATOM 10178 CA VAL K 43 -0.816 74.191 22.210 1.00 75.80 C
-ATOM 10179 C VAL K 43 0.702 74.354 22.138 1.00 74.14 C
-ATOM 10180 O VAL K 43 1.232 75.291 21.532 1.00 73.72 O
-ATOM 10181 CB VAL K 43 -1.324 73.707 20.825 1.00 74.16 C
-ATOM 10182 CG1 VAL K 43 -0.502 72.508 20.325 1.00 75.36 C
-ATOM 10183 CG2 VAL K 43 -2.766 73.300 20.950 1.00 72.75 C
-ATOM 10184 H VAL K 43 -1.564 76.186 21.998 1.00 0.00 H
-ATOM 10185 HA VAL K 43 -1.033 73.407 22.925 1.00 0.00 H
-ATOM 10186 HB VAL K 43 -1.226 74.518 20.100 1.00 0.00 H
-ATOM 10187 1HG1 VAL K 43 -0.879 72.183 19.354 1.00 0.00 H
-ATOM 10188 2HG1 VAL K 43 0.542 72.795 20.224 1.00 0.00 H
-ATOM 10189 3HG1 VAL K 43 -0.588 71.691 21.042 1.00 0.00 H
-ATOM 10190 1HG2 VAL K 43 -3.139 72.955 19.989 1.00 0.00 H
-ATOM 10191 2HG2 VAL K 43 -2.822 72.509 21.659 1.00 0.00 H
-ATOM 10192 3HG2 VAL K 43 -3.361 74.143 21.297 1.00 0.00 H
-ATOM 10193 N LEU K 44 1.401 73.393 22.734 1.00 71.93 N
-ATOM 10194 CA LEU K 44 2.852 73.327 22.682 1.00 69.93 C
-ATOM 10195 C LEU K 44 3.306 72.067 21.963 1.00 68.25 C
-ATOM 10196 O LEU K 44 2.977 70.953 22.379 1.00 68.19 O
-ATOM 10197 CB LEU K 44 3.445 73.297 24.090 1.00 65.19 C
-ATOM 10198 CG LEU K 44 4.963 73.174 24.178 1.00 67.11 C
-ATOM 10199 CD1 LEU K 44 5.624 74.440 23.568 1.00 60.95 C
-ATOM 10200 CD2 LEU K 44 5.336 72.972 25.637 1.00 73.53 C
-ATOM 10201 H LEU K 44 0.892 72.668 23.233 1.00 0.00 H
-ATOM 10202 HA LEU K 44 3.233 74.192 22.141 1.00 0.00 H
-ATOM 10203 1HB LEU K 44 3.167 74.194 24.604 1.00 0.00 H
-ATOM 10204 2HB LEU K 44 3.021 72.444 24.621 1.00 0.00 H
-ATOM 10205 HG LEU K 44 5.300 72.314 23.600 1.00 0.00 H
-ATOM 10206 1HD1 LEU K 44 6.709 74.355 23.626 1.00 0.00 H
-ATOM 10207 2HD1 LEU K 44 5.327 74.535 22.520 1.00 0.00 H
-ATOM 10208 3HD1 LEU K 44 5.301 75.327 24.119 1.00 0.00 H
-ATOM 10209 1HD2 LEU K 44 6.417 72.873 25.730 1.00 0.00 H
-ATOM 10210 2HD2 LEU K 44 4.996 73.822 26.224 1.00 0.00 H
-ATOM 10211 3HD2 LEU K 44 4.856 72.069 26.003 1.00 0.00 H
-ATOM 10212 N ILE K 45 4.058 72.224 20.892 1.00 66.92 N
-ATOM 10213 CA ILE K 45 4.584 71.073 20.184 1.00 63.47 C
-ATOM 10214 C ILE K 45 6.074 71.059 20.476 1.00 62.13 C
-ATOM 10215 O ILE K 45 6.766 72.023 20.151 1.00 58.36 O
-ATOM 10216 CB ILE K 45 4.346 71.202 18.679 1.00 59.92 C
-ATOM 10217 CG1 ILE K 45 2.844 71.379 18.410 1.00 60.60 C
-ATOM 10218 CG2 ILE K 45 4.877 69.969 18.010 1.00 71.18 C
-ATOM 10219 CD1 ILE K 45 2.487 71.776 17.004 1.00 68.90 C
-ATOM 10220 H ILE K 45 4.281 73.151 20.538 1.00 0.00 H
-ATOM 10221 HA ILE K 45 4.129 70.161 20.562 1.00 0.00 H
-ATOM 10222 HB ILE K 45 4.858 72.072 18.299 1.00 0.00 H
-ATOM 10223 1HG1 ILE K 45 2.339 70.460 18.644 1.00 0.00 H
-ATOM 10224 2HG1 ILE K 45 2.478 72.158 19.071 1.00 0.00 H
-ATOM 10225 1HG2 ILE K 45 4.722 70.035 16.940 1.00 0.00 H
-ATOM 10226 2HG2 ILE K 45 5.938 69.881 18.231 1.00 0.00 H
-ATOM 10227 3HG2 ILE K 45 4.365 69.105 18.400 1.00 0.00 H
-ATOM 10228 1HD1 ILE K 45 1.410 71.891 16.937 1.00 0.00 H
-ATOM 10229 2HD1 ILE K 45 2.971 72.725 16.752 1.00 0.00 H
-ATOM 10230 3HD1 ILE K 45 2.812 71.006 16.318 1.00 0.00 H
-ATOM 10231 N ALA K 46 6.602 70.012 21.097 1.00 62.27 N
-ATOM 10232 CA ALA K 46 8.007 70.135 21.474 1.00 63.65 C
-ATOM 10233 C ALA K 46 8.804 68.859 21.366 1.00 64.34 C
-ATOM 10234 O ALA K 46 8.338 67.768 21.705 1.00 63.59 O
-ATOM 10235 CB ALA K 46 8.091 70.656 22.901 1.00 51.66 C
-ATOM 10236 H ALA K 46 6.033 69.197 21.327 1.00 0.00 H
-ATOM 10237 HA ALA K 46 8.471 70.851 20.804 1.00 0.00 H
-ATOM 10238 1HB ALA K 46 9.139 70.796 23.175 1.00 0.00 H
-ATOM 10239 2HB ALA K 46 7.567 71.606 22.968 1.00 0.00 H
-ATOM 10240 3HB ALA K 46 7.632 69.937 23.577 1.00 0.00 H
-ATOM 10241 N GLN K 47 10.041 69.025 20.898 1.00 62.80 N
-ATOM 10242 CA GLN K 47 10.968 67.924 20.729 1.00 62.85 C
-ATOM 10243 C GLN K 47 11.764 67.633 21.972 1.00 63.63 C
-ATOM 10244 O GLN K 47 11.963 68.493 22.832 1.00 63.04 O
-ATOM 10245 CB GLN K 47 11.968 68.195 19.597 1.00 62.80 C
-ATOM 10246 CG GLN K 47 11.390 68.269 18.206 1.00 54.93 C
-ATOM 10247 CD GLN K 47 12.464 68.508 17.170 1.00 58.15 C
-ATOM 10248 OE1 GLN K 47 13.295 69.422 17.303 1.00 57.45 O
-ATOM 10249 NE2 GLN K 47 12.462 67.684 16.126 1.00 62.82 N
-ATOM 10250 H GLN K 47 10.368 69.953 20.632 1.00 0.00 H
-ATOM 10251 HA GLN K 47 10.404 67.041 20.483 1.00 0.00 H
-ATOM 10252 1HB GLN K 47 12.497 69.124 19.799 1.00 0.00 H
-ATOM 10253 2HB GLN K 47 12.714 67.397 19.591 1.00 0.00 H
-ATOM 10254 1HG GLN K 47 10.942 67.311 17.976 1.00 0.00 H
-ATOM 10255 2HG GLN K 47 10.650 69.065 18.155 1.00 0.00 H
-ATOM 10256 1HE2 GLN K 47 13.145 67.782 15.405 1.00 0.00 H
-ATOM 10257 2HE2 GLN K 47 11.770 66.954 16.067 1.00 0.00 H
-ATOM 10258 N PHE K 48 12.283 66.421 22.017 1.00 63.02 N
-ATOM 10259 CA PHE K 48 13.264 66.075 23.026 1.00 63.23 C
-ATOM 10260 C PHE K 48 14.573 66.590 22.444 1.00 61.18 C
-ATOM 10261 O PHE K 48 14.732 66.607 21.223 1.00 60.89 O
-ATOM 10262 CB PHE K 48 13.277 64.585 23.269 1.00 66.08 C
-ATOM 10263 CG PHE K 48 12.005 64.097 23.912 1.00 72.93 C
-ATOM 10264 CD1 PHE K 48 11.821 64.120 25.293 1.00 69.02 C
-ATOM 10265 CD2 PHE K 48 10.968 63.636 23.110 1.00 69.79 C
-ATOM 10266 CE1 PHE K 48 10.624 63.683 25.834 1.00 65.58 C
-ATOM 10267 CE2 PHE K 48 9.786 63.210 23.656 1.00 69.79 C
-ATOM 10268 CZ PHE K 48 9.617 63.239 25.012 1.00 59.32 C
-ATOM 10269 H PHE K 48 12.009 65.748 21.302 1.00 0.00 H
-ATOM 10270 HA PHE K 48 13.052 66.601 23.959 1.00 0.00 H
-ATOM 10271 1HB PHE K 48 13.423 64.058 22.333 1.00 0.00 H
-ATOM 10272 2HB PHE K 48 14.109 64.347 23.931 1.00 0.00 H
-ATOM 10273 HD1 PHE K 48 12.624 64.484 25.942 1.00 0.00 H
-ATOM 10274 HD2 PHE K 48 11.103 63.624 22.032 1.00 0.00 H
-ATOM 10275 HE1 PHE K 48 10.468 63.700 26.901 1.00 0.00 H
-ATOM 10276 HE2 PHE K 48 8.982 62.856 23.012 1.00 0.00 H
-ATOM 10277 HZ PHE K 48 8.689 62.921 25.431 1.00 0.00 H
-ATOM 10278 N THR K 49 15.463 67.101 23.281 1.00 57.53 N
-ATOM 10279 CA THR K 49 16.665 67.755 22.760 1.00 53.38 C
-ATOM 10280 C THR K 49 17.949 67.282 23.398 1.00 54.10 C
-ATOM 10281 O THR K 49 17.975 66.364 24.215 1.00 54.01 O
-ATOM 10282 CB THR K 49 16.627 69.283 22.957 1.00 57.59 C
-ATOM 10283 OG1 THR K 49 16.799 69.590 24.345 1.00 51.40 O
-ATOM 10284 CG2 THR K 49 15.309 69.860 22.477 1.00 38.20 C
-ATOM 10285 H THR K 49 15.313 67.009 24.284 1.00 0.00 H
-ATOM 10286 HA THR K 49 16.734 67.545 21.693 1.00 0.00 H
-ATOM 10287 HB THR K 49 17.430 69.747 22.391 1.00 0.00 H
-ATOM 10288 HG1 THR K 49 17.459 68.996 24.721 1.00 0.00 H
-ATOM 10289 1HG2 THR K 49 15.316 70.938 22.634 1.00 0.00 H
-ATOM 10290 2HG2 THR K 49 15.174 69.645 21.415 1.00 0.00 H
-ATOM 10291 3HG2 THR K 49 14.488 69.423 23.040 1.00 0.00 H
-ATOM 10292 N GLU K 50 19.023 67.970 23.036 1.00 55.70 N
-ATOM 10293 CA GLU K 50 20.349 67.749 23.577 1.00 58.37 C
-ATOM 10294 C GLU K 50 20.375 68.059 25.077 1.00 61.15 C
-ATOM 10295 O GLU K 50 21.251 67.582 25.798 1.00 60.14 O
-ATOM 10296 CB GLU K 50 21.361 68.627 22.825 1.00 52.29 C
-ATOM 10297 CG GLU K 50 21.591 68.222 21.360 1.00 53.74 C
-ATOM 10298 CD GLU K 50 22.542 69.140 20.620 1.00 53.75 C
-ATOM 10299 OE1 GLU K 50 22.814 68.877 19.474 1.00 48.94 O
-ATOM 10300 OE2 GLU K 50 22.994 70.097 21.207 1.00 54.28 O
-ATOM 10301 H GLU K 50 18.916 68.700 22.345 1.00 0.00 H
-ATOM 10302 HA GLU K 50 20.613 66.700 23.436 1.00 0.00 H
-ATOM 10303 1HB GLU K 50 21.012 69.663 22.826 1.00 0.00 H
-ATOM 10304 2HB GLU K 50 22.320 68.604 23.340 1.00 0.00 H
-ATOM 10305 1HG GLU K 50 22.007 67.218 21.342 1.00 0.00 H
-ATOM 10306 2HG GLU K 50 20.634 68.202 20.838 1.00 0.00 H
-ATOM 10307 N HIS K 51 19.420 68.880 25.545 1.00 61.89 N
-ATOM 10308 CA HIS K 51 19.352 69.245 26.951 1.00 66.41 C
-ATOM 10309 C HIS K 51 18.104 68.686 27.651 1.00 68.94 C
-ATOM 10310 O HIS K 51 18.128 68.517 28.864 1.00 68.97 O
-ATOM 10311 CB HIS K 51 19.415 70.768 27.111 1.00 71.02 C
-ATOM 10312 CG HIS K 51 20.716 71.350 26.618 1.00 72.98 C
-ATOM 10313 ND1 HIS K 51 20.947 71.630 25.292 1.00 76.16 N
-ATOM 10314 CD2 HIS K 51 21.853 71.688 27.278 1.00 77.14 C
-ATOM 10315 CE1 HIS K 51 22.171 72.112 25.151 1.00 74.97 C
-ATOM 10316 NE2 HIS K 51 22.741 72.159 26.338 1.00 76.08 N
-ATOM 10317 H HIS K 51 18.703 69.236 24.926 1.00 0.00 H
-ATOM 10318 HA HIS K 51 20.218 68.829 27.468 1.00 0.00 H
-ATOM 10319 1HB HIS K 51 18.595 71.227 26.553 1.00 0.00 H
-ATOM 10320 2HB HIS K 51 19.286 71.039 28.161 1.00 0.00 H
-ATOM 10321 HD2 HIS K 51 22.035 71.600 28.349 1.00 0.00 H
-ATOM 10322 HE1 HIS K 51 22.628 72.415 24.210 1.00 0.00 H
-ATOM 10323 HE2 HIS K 51 23.681 72.481 26.532 1.00 0.00 H
-ATOM 10324 N THR K 52 17.031 68.373 26.893 1.00 69.75 N
-ATOM 10325 CA THR K 52 15.794 67.841 27.507 1.00 69.68 C
-ATOM 10326 C THR K 52 15.613 66.346 27.218 1.00 70.20 C
-ATOM 10327 O THR K 52 15.434 65.945 26.068 1.00 71.48 O
-ATOM 10328 CB THR K 52 14.526 68.551 26.965 1.00 65.46 C
-ATOM 10329 OG1 THR K 52 14.570 69.951 27.262 1.00 65.52 O
-ATOM 10330 CG2 THR K 52 13.255 67.937 27.588 1.00 69.69 C
-ATOM 10331 H THR K 52 17.054 68.543 25.901 1.00 0.00 H
-ATOM 10332 HA THR K 52 15.850 67.975 28.582 1.00 0.00 H
-ATOM 10333 HB THR K 52 14.486 68.425 25.886 1.00 0.00 H
-ATOM 10334 HG1 THR K 52 13.979 70.420 26.649 1.00 0.00 H
-ATOM 10335 1HG2 THR K 52 12.369 68.441 27.190 1.00 0.00 H
-ATOM 10336 2HG2 THR K 52 13.199 66.878 27.347 1.00 0.00 H
-ATOM 10337 3HG2 THR K 52 13.291 68.060 28.669 1.00 0.00 H
-ATOM 10338 N SER K 53 15.610 65.529 28.281 1.00 68.10 N
-ATOM 10339 CA SER K 53 15.448 64.079 28.127 1.00 65.00 C
-ATOM 10340 C SER K 53 14.038 63.639 28.489 1.00 64.54 C
-ATOM 10341 O SER K 53 13.602 62.535 28.146 1.00 63.74 O
-ATOM 10342 CB SER K 53 16.435 63.321 28.987 1.00 67.80 C
-ATOM 10343 OG SER K 53 16.208 63.541 30.348 1.00 45.11 O
-ATOM 10344 H SER K 53 15.730 65.934 29.208 1.00 0.00 H
-ATOM 10345 HA SER K 53 15.627 63.812 27.086 1.00 0.00 H
-ATOM 10346 1HB SER K 53 16.353 62.259 28.774 1.00 0.00 H
-ATOM 10347 2HB SER K 53 17.430 63.621 28.728 1.00 0.00 H
-ATOM 10348 HG SER K 53 16.083 64.498 30.453 1.00 0.00 H
-ATOM 10349 N ALA K 54 13.321 64.508 29.192 1.00 66.03 N
-ATOM 10350 CA ALA K 54 11.959 64.161 29.579 1.00 67.02 C
-ATOM 10351 C ALA K 54 11.085 65.398 29.706 1.00 67.66 C
-ATOM 10352 O ALA K 54 11.554 66.493 30.027 1.00 66.00 O
-ATOM 10353 CB ALA K 54 11.960 63.367 30.876 1.00 58.48 C
-ATOM 10354 H ALA K 54 13.738 65.390 29.481 1.00 0.00 H
-ATOM 10355 HA ALA K 54 11.535 63.541 28.798 1.00 0.00 H
-ATOM 10356 1HB ALA K 54 10.936 63.091 31.123 1.00 0.00 H
-ATOM 10357 2HB ALA K 54 12.558 62.470 30.740 1.00 0.00 H
-ATOM 10358 3HB ALA K 54 12.370 63.941 31.671 1.00 0.00 H
-ATOM 10359 N ILE K 55 9.794 65.186 29.471 1.00 69.38 N
-ATOM 10360 CA ILE K 55 8.779 66.215 29.580 1.00 70.47 C
-ATOM 10361 C ILE K 55 7.737 65.849 30.634 1.00 71.82 C
-ATOM 10362 O ILE K 55 7.138 64.775 30.602 1.00 71.26 O
-ATOM 10363 CB ILE K 55 8.111 66.457 28.203 1.00 58.82 C
-ATOM 10364 CG1 ILE K 55 9.192 66.933 27.164 1.00 64.27 C
-ATOM 10365 CG2 ILE K 55 6.996 67.471 28.335 1.00 63.12 C
-ATOM 10366 CD1 ILE K 55 8.707 66.984 25.716 1.00 62.43 C
-ATOM 10367 H ILE K 55 9.504 64.246 29.217 1.00 0.00 H
-ATOM 10368 HA ILE K 55 9.257 67.145 29.889 1.00 0.00 H
-ATOM 10369 HB ILE K 55 7.698 65.518 27.835 1.00 0.00 H
-ATOM 10370 1HG1 ILE K 55 9.534 67.930 27.448 1.00 0.00 H
-ATOM 10371 2HG1 ILE K 55 10.037 66.256 27.199 1.00 0.00 H
-ATOM 10372 1HG2 ILE K 55 6.530 67.626 27.366 1.00 0.00 H
-ATOM 10373 2HG2 ILE K 55 6.247 67.112 29.044 1.00 0.00 H
-ATOM 10374 3HG2 ILE K 55 7.417 68.408 28.696 1.00 0.00 H
-ATOM 10375 1HD1 ILE K 55 9.521 67.320 25.066 1.00 0.00 H
-ATOM 10376 2HD1 ILE K 55 8.384 65.991 25.405 1.00 0.00 H
-ATOM 10377 3HD1 ILE K 55 7.873 67.680 25.634 1.00 0.00 H
-ATOM 10378 N LYS K 56 7.543 66.737 31.591 1.00 72.53 N
-ATOM 10379 CA LYS K 56 6.596 66.536 32.687 1.00 72.51 C
-ATOM 10380 C LYS K 56 5.416 67.486 32.550 1.00 72.10 C
-ATOM 10381 O LYS K 56 5.611 68.681 32.379 1.00 72.88 O
-ATOM 10382 CB LYS K 56 7.347 66.754 33.999 1.00 74.37 C
-ATOM 10383 CG LYS K 56 6.583 66.604 35.295 1.00 77.58 C
-ATOM 10384 CD LYS K 56 7.517 67.031 36.442 1.00 73.01 C
-ATOM 10385 CE LYS K 56 6.887 66.906 37.812 1.00 74.87 C
-ATOM 10386 NZ LYS K 56 6.870 65.516 38.264 1.00 71.21 N
-ATOM 10387 H LYS K 56 8.080 67.600 31.565 1.00 0.00 H
-ATOM 10388 HA LYS K 56 6.221 65.510 32.654 1.00 0.00 H
-ATOM 10389 1HB LYS K 56 8.156 66.027 34.045 1.00 0.00 H
-ATOM 10390 2HB LYS K 56 7.798 67.710 33.980 1.00 0.00 H
-ATOM 10391 1HG LYS K 56 5.702 67.253 35.286 1.00 0.00 H
-ATOM 10392 2HG LYS K 56 6.257 65.568 35.438 1.00 0.00 H
-ATOM 10393 1HD LYS K 56 8.415 66.401 36.426 1.00 0.00 H
-ATOM 10394 2HD LYS K 56 7.826 68.067 36.296 1.00 0.00 H
-ATOM 10395 1HE LYS K 56 7.463 67.502 38.518 1.00 0.00 H
-ATOM 10396 2HE LYS K 56 5.858 67.282 37.784 1.00 0.00 H
-ATOM 10397 1HZ LYS K 56 6.460 65.452 39.198 1.00 0.00 H
-ATOM 10398 2HZ LYS K 56 6.336 64.951 37.621 1.00 0.00 H
-ATOM 10399 3HZ LYS K 56 7.843 65.177 38.296 1.00 0.00 H
-ATOM 10400 N VAL K 57 4.196 66.969 32.583 1.00 71.29 N
-ATOM 10401 CA VAL K 57 3.045 67.843 32.412 1.00 72.49 C
-ATOM 10402 C VAL K 57 2.158 67.882 33.648 1.00 72.87 C
-ATOM 10403 O VAL K 57 1.690 66.844 34.140 1.00 70.08 O
-ATOM 10404 CB VAL K 57 2.205 67.397 31.206 1.00 73.75 C
-ATOM 10405 CG1 VAL K 57 1.022 68.355 31.020 1.00 79.46 C
-ATOM 10406 CG2 VAL K 57 3.100 67.318 29.983 1.00 74.58 C
-ATOM 10407 H VAL K 57 4.063 65.972 32.708 1.00 0.00 H
-ATOM 10408 HA VAL K 57 3.400 68.859 32.223 1.00 0.00 H
-ATOM 10409 HB VAL K 57 1.789 66.412 31.409 1.00 0.00 H
-ATOM 10410 1HG1 VAL K 57 0.409 68.041 30.183 1.00 0.00 H
-ATOM 10411 2HG1 VAL K 57 0.409 68.367 31.925 1.00 0.00 H
-ATOM 10412 3HG1 VAL K 57 1.399 69.361 30.831 1.00 0.00 H
-ATOM 10413 1HG2 VAL K 57 2.519 66.988 29.126 1.00 0.00 H
-ATOM 10414 2HG2 VAL K 57 3.513 68.297 29.793 1.00 0.00 H
-ATOM 10415 3HG2 VAL K 57 3.907 66.607 30.165 1.00 0.00 H
-ATOM 10416 N ARG K 58 1.936 69.094 34.147 1.00 73.11 N
-ATOM 10417 CA ARG K 58 1.126 69.352 35.327 1.00 72.69 C
-ATOM 10418 C ARG K 58 -0.095 70.208 35.009 1.00 72.91 C
-ATOM 10419 O ARG K 58 0.008 71.293 34.437 1.00 72.21 O
-ATOM 10420 CB ARG K 58 1.982 70.039 36.371 1.00 74.70 C
-ATOM 10421 CG ARG K 58 1.272 70.515 37.614 1.00 79.65 C
-ATOM 10422 CD ARG K 58 2.253 71.128 38.547 1.00 84.46 C
-ATOM 10423 NE ARG K 58 3.157 70.142 39.083 1.00 84.81 N
-ATOM 10424 CZ ARG K 58 4.317 70.404 39.707 1.00 82.14 C
-ATOM 10425 NH1 ARG K 58 4.730 71.651 39.873 1.00 81.13 N
-ATOM 10426 NH2 ARG K 58 5.024 69.381 40.139 1.00 72.27 N
-ATOM 10427 H ARG K 58 2.384 69.890 33.690 1.00 0.00 H
-ATOM 10428 HA ARG K 58 0.782 68.395 35.727 1.00 0.00 H
-ATOM 10429 1HB ARG K 58 2.752 69.333 36.705 1.00 0.00 H
-ATOM 10430 2HB ARG K 58 2.493 70.888 35.929 1.00 0.00 H
-ATOM 10431 1HG ARG K 58 0.539 71.280 37.336 1.00 0.00 H
-ATOM 10432 2HG ARG K 58 0.769 69.679 38.105 1.00 0.00 H
-ATOM 10433 1HD ARG K 58 2.845 71.862 38.005 1.00 0.00 H
-ATOM 10434 2HD ARG K 58 1.737 71.609 39.375 1.00 0.00 H
-ATOM 10435 HE ARG K 58 2.907 69.154 38.981 1.00 0.00 H
-ATOM 10436 1HH1 ARG K 58 4.165 72.416 39.527 1.00 0.00 H
-ATOM 10437 2HH1 ARG K 58 5.605 71.843 40.338 1.00 0.00 H
-ATOM 10438 1HH2 ARG K 58 4.641 68.434 39.970 1.00 0.00 H
-ATOM 10439 2HH2 ARG K 58 5.903 69.521 40.618 1.00 0.00 H
-ATOM 10440 N GLY K 59 -1.260 69.724 35.412 1.00 73.86 N
-ATOM 10441 CA GLY K 59 -2.510 70.415 35.118 1.00 73.78 C
-ATOM 10442 C GLY K 59 -3.179 69.683 33.972 1.00 74.31 C
-ATOM 10443 O GLY K 59 -2.499 69.007 33.191 1.00 72.03 O
-ATOM 10444 H GLY K 59 -1.304 68.838 35.898 1.00 0.00 H
-ATOM 10445 1HA GLY K 59 -3.160 70.411 35.991 1.00 0.00 H
-ATOM 10446 2HA GLY K 59 -2.326 71.452 34.855 1.00 0.00 H
-ATOM 10447 N LYS K 60 -4.496 69.767 33.893 1.00 75.28 N
-ATOM 10448 CA LYS K 60 -5.258 69.034 32.897 1.00 76.89 C
-ATOM 10449 C LYS K 60 -4.877 69.422 31.478 1.00 77.83 C
-ATOM 10450 O LYS K 60 -4.843 70.620 31.154 1.00 77.22 O
-ATOM 10451 CB LYS K 60 -6.753 69.211 33.161 1.00 69.81 C
-ATOM 10452 CG LYS K 60 -7.694 68.325 32.365 1.00 79.47 C
-ATOM 10453 CD LYS K 60 -9.135 68.561 32.799 1.00 81.41 C
-ATOM 10454 CE LYS K 60 -10.093 67.645 32.073 1.00 78.56 C
-ATOM 10455 NZ LYS K 60 -11.504 67.818 32.548 1.00 88.74 N
-ATOM 10456 H LYS K 60 -4.993 70.369 34.556 1.00 0.00 H
-ATOM 10457 HA LYS K 60 -5.012 67.990 33.005 1.00 0.00 H
-ATOM 10458 1HB LYS K 60 -6.948 69.047 34.218 1.00 0.00 H
-ATOM 10459 2HB LYS K 60 -7.032 70.231 32.935 1.00 0.00 H
-ATOM 10460 1HG LYS K 60 -7.597 68.518 31.315 1.00 0.00 H
-ATOM 10461 2HG LYS K 60 -7.444 67.275 32.545 1.00 0.00 H
-ATOM 10462 1HD LYS K 60 -9.222 68.382 33.872 1.00 0.00 H
-ATOM 10463 2HD LYS K 60 -9.410 69.606 32.597 1.00 0.00 H
-ATOM 10464 1HE LYS K 60 -10.057 67.862 31.012 1.00 0.00 H
-ATOM 10465 2HE LYS K 60 -9.785 66.610 32.240 1.00 0.00 H
-ATOM 10466 1HZ LYS K 60 -12.120 67.184 32.040 1.00 0.00 H
-ATOM 10467 2HZ LYS K 60 -11.550 67.610 33.541 1.00 0.00 H
-ATOM 10468 3HZ LYS K 60 -11.800 68.775 32.387 1.00 0.00 H
-ATOM 10469 N ALA K 61 -4.578 68.435 30.643 1.00 78.17 N
-ATOM 10470 CA ALA K 61 -4.165 68.712 29.268 1.00 78.29 C
-ATOM 10471 C ALA K 61 -4.338 67.510 28.345 1.00 77.67 C
-ATOM 10472 O ALA K 61 -4.177 66.359 28.751 1.00 78.05 O
-ATOM 10473 CB ALA K 61 -2.706 69.158 29.237 1.00 72.26 C
-ATOM 10474 H ALA K 61 -4.651 67.475 30.985 1.00 0.00 H
-ATOM 10475 HA ALA K 61 -4.790 69.519 28.897 1.00 0.00 H
-ATOM 10476 1HB ALA K 61 -2.415 69.403 28.221 1.00 0.00 H
-ATOM 10477 2HB ALA K 61 -2.579 70.030 29.870 1.00 0.00 H
-ATOM 10478 3HB ALA K 61 -2.078 68.356 29.599 1.00 0.00 H
-ATOM 10479 N TYR K 62 -4.621 67.777 27.080 1.00 75.65 N
-ATOM 10480 CA TYR K 62 -4.719 66.737 26.069 1.00 74.72 C
-ATOM 10481 C TYR K 62 -3.377 66.552 25.407 1.00 71.76 C
-ATOM 10482 O TYR K 62 -2.808 67.505 24.878 1.00 69.85 O
-ATOM 10483 CB TYR K 62 -5.807 67.076 25.058 1.00 76.88 C
-ATOM 10484 CG TYR K 62 -5.886 66.153 23.868 1.00 81.56 C
-ATOM 10485 CD1 TYR K 62 -6.311 64.839 24.009 1.00 82.81 C
-ATOM 10486 CD2 TYR K 62 -5.574 66.644 22.620 1.00 83.59 C
-ATOM 10487 CE1 TYR K 62 -6.411 64.022 22.897 1.00 84.06 C
-ATOM 10488 CE2 TYR K 62 -5.677 65.841 21.512 1.00 84.19 C
-ATOM 10489 CZ TYR K 62 -6.096 64.533 21.645 1.00 84.71 C
-ATOM 10490 OH TYR K 62 -6.215 63.740 20.529 1.00 84.74 O
-ATOM 10491 H TYR K 62 -4.723 68.751 26.807 1.00 0.00 H
-ATOM 10492 HA TYR K 62 -4.981 65.797 26.556 1.00 0.00 H
-ATOM 10493 1HB TYR K 62 -6.772 67.056 25.558 1.00 0.00 H
-ATOM 10494 2HB TYR K 62 -5.650 68.087 24.692 1.00 0.00 H
-ATOM 10495 HD1 TYR K 62 -6.567 64.454 24.991 1.00 0.00 H
-ATOM 10496 HD2 TYR K 62 -5.254 67.674 22.518 1.00 0.00 H
-ATOM 10497 HE1 TYR K 62 -6.746 62.990 23.002 1.00 0.00 H
-ATOM 10498 HE2 TYR K 62 -5.436 66.243 20.526 1.00 0.00 H
-ATOM 10499 HH TYR K 62 -6.028 64.263 19.749 1.00 0.00 H
-ATOM 10500 N ILE K 63 -2.851 65.339 25.448 1.00 68.17 N
-ATOM 10501 CA ILE K 63 -1.531 65.121 24.898 1.00 66.67 C
-ATOM 10502 C ILE K 63 -1.526 64.062 23.783 1.00 65.04 C
-ATOM 10503 O ILE K 63 -2.084 62.971 23.938 1.00 62.33 O
-ATOM 10504 CB ILE K 63 -0.580 64.677 26.015 1.00 70.94 C
-ATOM 10505 CG1 ILE K 63 -0.546 65.711 27.151 1.00 73.32 C
-ATOM 10506 CG2 ILE K 63 0.806 64.473 25.443 1.00 79.45 C
-ATOM 10507 CD1 ILE K 63 0.194 65.221 28.388 1.00 62.19 C
-ATOM 10508 H ILE K 63 -3.327 64.568 25.908 1.00 0.00 H
-ATOM 10509 HA ILE K 63 -1.175 66.054 24.490 1.00 0.00 H
-ATOM 10510 HB ILE K 63 -0.939 63.774 26.425 1.00 0.00 H
-ATOM 10511 1HG1 ILE K 63 -0.089 66.607 26.793 1.00 0.00 H
-ATOM 10512 2HG1 ILE K 63 -1.566 65.948 27.454 1.00 0.00 H
-ATOM 10513 1HG2 ILE K 63 1.467 64.145 26.225 1.00 0.00 H
-ATOM 10514 2HG2 ILE K 63 0.760 63.728 24.669 1.00 0.00 H
-ATOM 10515 3HG2 ILE K 63 1.171 65.408 25.023 1.00 0.00 H
-ATOM 10516 1HD1 ILE K 63 0.174 65.986 29.155 1.00 0.00 H
-ATOM 10517 2HD1 ILE K 63 -0.292 64.321 28.770 1.00 0.00 H
-ATOM 10518 3HD1 ILE K 63 1.228 64.991 28.132 1.00 0.00 H
-ATOM 10519 N GLN K 64 -0.899 64.394 22.643 1.00 64.99 N
-ATOM 10520 CA GLN K 64 -0.751 63.438 21.543 1.00 64.59 C
-ATOM 10521 C GLN K 64 0.722 63.061 21.437 1.00 63.72 C
-ATOM 10522 O GLN K 64 1.594 63.934 21.371 1.00 63.29 O
-ATOM 10523 CB GLN K 64 -1.218 64.014 20.190 1.00 65.44 C
-ATOM 10524 CG GLN K 64 -2.672 64.444 20.123 1.00 59.81 C
-ATOM 10525 CD GLN K 64 -3.076 65.025 18.750 1.00 56.23 C
-ATOM 10526 OE1 GLN K 64 -2.260 65.605 18.025 1.00 55.69 O
-ATOM 10527 NE2 GLN K 64 -4.359 64.859 18.410 1.00 49.99 N
-ATOM 10528 H GLN K 64 -0.482 65.317 22.576 1.00 0.00 H
-ATOM 10529 HA GLN K 64 -1.316 62.536 21.762 1.00 0.00 H
-ATOM 10530 1HB GLN K 64 -0.602 64.834 19.906 1.00 0.00 H
-ATOM 10531 2HB GLN K 64 -1.089 63.249 19.427 1.00 0.00 H
-ATOM 10532 1HG GLN K 64 -3.314 63.596 20.329 1.00 0.00 H
-ATOM 10533 2HG GLN K 64 -2.832 65.215 20.875 1.00 0.00 H
-ATOM 10534 1HE2 GLN K 64 -4.730 65.224 17.536 1.00 0.00 H
-ATOM 10535 2HE2 GLN K 64 -4.978 64.381 19.031 1.00 0.00 H
-ATOM 10536 N THR K 65 1.013 61.764 21.451 1.00 63.12 N
-ATOM 10537 CA THR K 65 2.398 61.310 21.348 1.00 60.48 C
-ATOM 10538 C THR K 65 2.488 60.189 20.325 1.00 59.79 C
-ATOM 10539 O THR K 65 1.492 59.724 19.774 1.00 59.41 O
-ATOM 10540 CB THR K 65 2.971 60.752 22.674 1.00 62.30 C
-ATOM 10541 OG1 THR K 65 2.407 59.471 22.935 1.00 59.79 O
-ATOM 10542 CG2 THR K 65 2.659 61.663 23.848 1.00 53.95 C
-ATOM 10543 H THR K 65 0.270 61.073 21.520 1.00 0.00 H
-ATOM 10544 HA THR K 65 3.026 62.132 21.001 1.00 0.00 H
-ATOM 10545 HB THR K 65 4.042 60.659 22.586 1.00 0.00 H
-ATOM 10546 HG1 THR K 65 2.321 58.999 22.107 1.00 0.00 H
-ATOM 10547 1HG2 THR K 65 3.075 61.236 24.758 1.00 0.00 H
-ATOM 10548 2HG2 THR K 65 3.089 62.646 23.677 1.00 0.00 H
-ATOM 10549 3HG2 THR K 65 1.578 61.749 23.957 1.00 0.00 H
-ATOM 10550 N ARG K 66 3.695 59.694 20.138 1.00 58.76 N
-ATOM 10551 CA ARG K 66 3.957 58.559 19.273 1.00 57.33 C
-ATOM 10552 C ARG K 66 3.187 57.310 19.681 1.00 57.17 C
-ATOM 10553 O ARG K 66 2.985 56.412 18.861 1.00 55.21 O
-ATOM 10554 CB ARG K 66 5.441 58.259 19.252 1.00 67.71 C
-ATOM 10555 CG ARG K 66 5.875 57.167 18.318 1.00 73.28 C
-ATOM 10556 CD ARG K 66 7.332 57.202 18.178 1.00 80.80 C
-ATOM 10557 NE ARG K 66 7.875 56.058 17.495 1.00 84.36 N
-ATOM 10558 CZ ARG K 66 9.181 55.918 17.220 1.00 45.00 C
-ATOM 10559 NH1 ARG K 66 10.021 56.880 17.558 1.00 45.00 N
-ATOM 10560 NH2 ARG K 66 9.622 54.826 16.614 1.00 45.00 N
-ATOM 10561 H ARG K 66 4.477 60.131 20.610 1.00 0.00 H
-ATOM 10562 HA ARG K 66 3.651 58.828 18.259 1.00 0.00 H
-ATOM 10563 1HB ARG K 66 6.003 59.163 18.999 1.00 0.00 H
-ATOM 10564 2HB ARG K 66 5.749 57.949 20.248 1.00 0.00 H
-ATOM 10565 1HG ARG K 66 5.575 56.193 18.712 1.00 0.00 H
-ATOM 10566 2HG ARG K 66 5.430 57.328 17.338 1.00 0.00 H
-ATOM 10567 1HD ARG K 66 7.575 58.074 17.586 1.00 0.00 H
-ATOM 10568 2HD ARG K 66 7.807 57.281 19.157 1.00 0.00 H
-ATOM 10569 HE ARG K 66 7.244 55.318 17.228 1.00 0.00 H
-ATOM 10570 1HH1 ARG K 66 9.672 57.744 18.013 1.00 0.00 H
-ATOM 10571 2HH1 ARG K 66 11.003 56.781 17.359 1.00 0.00 H
-ATOM 10572 1HH2 ARG K 66 8.976 54.095 16.358 1.00 0.00 H
-ATOM 10573 2HH2 ARG K 66 10.607 54.724 16.412 1.00 0.00 H
-ATOM 10574 N HIS K 67 2.774 57.228 20.949 1.00 57.65 N
-ATOM 10575 CA HIS K 67 2.130 56.024 21.423 1.00 57.13 C
-ATOM 10576 C HIS K 67 0.610 56.166 21.530 1.00 57.80 C
-ATOM 10577 O HIS K 67 -0.054 55.380 22.209 1.00 58.24 O
-ATOM 10578 CB HIS K 67 2.701 55.631 22.779 1.00 61.41 C
-ATOM 10579 CG HIS K 67 4.184 55.482 22.749 1.00 65.59 C
-ATOM 10580 ND1 HIS K 67 4.870 54.903 21.699 1.00 65.39 N
-ATOM 10581 CD2 HIS K 67 5.108 55.817 23.661 1.00 72.92 C
-ATOM 10582 CE1 HIS K 67 6.164 54.920 21.972 1.00 73.59 C
-ATOM 10583 NE2 HIS K 67 6.320 55.458 23.162 1.00 74.91 N
-ATOM 10584 H HIS K 67 2.907 58.000 21.594 1.00 0.00 H
-ATOM 10585 HA HIS K 67 2.317 55.213 20.727 1.00 0.00 H
-ATOM 10586 1HB HIS K 67 2.458 56.386 23.534 1.00 0.00 H
-ATOM 10587 2HB HIS K 67 2.272 54.685 23.099 1.00 0.00 H
-ATOM 10588 HD2 HIS K 67 4.918 56.277 24.621 1.00 0.00 H
-ATOM 10589 HE1 HIS K 67 6.964 54.542 21.338 1.00 0.00 H
-ATOM 10590 HE2 HIS K 67 7.202 55.584 23.655 1.00 0.00 H
-ATOM 10591 N GLY K 68 0.043 57.176 20.852 1.00 57.61 N
-ATOM 10592 CA GLY K 68 -1.395 57.404 20.920 1.00 58.61 C
-ATOM 10593 C GLY K 68 -1.646 58.645 21.755 1.00 60.44 C
-ATOM 10594 O GLY K 68 -0.922 59.634 21.648 1.00 57.76 O
-ATOM 10595 H GLY K 68 0.619 57.814 20.313 1.00 0.00 H
-ATOM 10596 1HA GLY K 68 -1.790 57.534 19.902 1.00 0.00 H
-ATOM 10597 2HA GLY K 68 -1.885 56.543 21.359 1.00 0.00 H
-ATOM 10598 N VAL K 69 -2.731 58.651 22.544 1.00 60.80 N
-ATOM 10599 CA VAL K 69 -3.058 59.866 23.292 1.00 64.25 C
-ATOM 10600 C VAL K 69 -3.214 59.554 24.774 1.00 65.93 C
-ATOM 10601 O VAL K 69 -3.496 58.432 25.166 1.00 65.17 O
-ATOM 10602 CB VAL K 69 -4.359 60.483 22.773 1.00 69.82 C
-ATOM 10603 CG1 VAL K 69 -4.207 60.881 21.323 1.00 66.08 C
-ATOM 10604 CG2 VAL K 69 -5.539 59.508 22.970 1.00 63.87 C
-ATOM 10605 H VAL K 69 -3.320 57.849 22.595 1.00 0.00 H
-ATOM 10606 HA VAL K 69 -2.260 60.584 23.169 1.00 0.00 H
-ATOM 10607 HB VAL K 69 -4.557 61.391 23.358 1.00 0.00 H
-ATOM 10608 1HG1 VAL K 69 -5.113 61.373 20.978 1.00 0.00 H
-ATOM 10609 2HG1 VAL K 69 -3.377 61.561 21.243 1.00 0.00 H
-ATOM 10610 3HG1 VAL K 69 -4.017 59.996 20.715 1.00 0.00 H
-ATOM 10611 1HG2 VAL K 69 -6.475 59.959 22.630 1.00 0.00 H
-ATOM 10612 2HG2 VAL K 69 -5.366 58.586 22.405 1.00 0.00 H
-ATOM 10613 3HG2 VAL K 69 -5.629 59.256 24.035 1.00 0.00 H
-ATOM 10614 N ILE K 70 -2.976 60.608 25.572 1.00 66.46 N
-ATOM 10615 CA ILE K 70 -3.089 60.546 27.030 1.00 65.32 C
-ATOM 10616 C ILE K 70 -3.602 61.892 27.530 1.00 68.44 C
-ATOM 10617 O ILE K 70 -3.323 62.923 26.932 1.00 68.86 O
-ATOM 10618 CB ILE K 70 -1.698 60.204 27.686 1.00 56.61 C
-ATOM 10619 CG1 ILE K 70 -1.820 59.869 29.206 1.00 52.82 C
-ATOM 10620 CG2 ILE K 70 -0.753 61.349 27.522 1.00 47.17 C
-ATOM 10621 CD1 ILE K 70 -2.473 58.515 29.450 1.00 45.00 C
-ATOM 10622 H ILE K 70 -2.733 61.483 25.142 1.00 0.00 H
-ATOM 10623 HA ILE K 70 -3.814 59.786 27.316 1.00 0.00 H
-ATOM 10624 HB ILE K 70 -1.256 59.341 27.189 1.00 0.00 H
-ATOM 10625 1HG1 ILE K 70 -0.817 59.845 29.647 1.00 0.00 H
-ATOM 10626 2HG1 ILE K 70 -2.388 60.639 29.711 1.00 0.00 H
-ATOM 10627 1HG2 ILE K 70 0.201 61.111 27.970 1.00 0.00 H
-ATOM 10628 2HG2 ILE K 70 -0.616 61.556 26.461 1.00 0.00 H
-ATOM 10629 3HG2 ILE K 70 -1.181 62.209 28.025 1.00 0.00 H
-ATOM 10630 1HD1 ILE K 70 -2.523 58.310 30.522 1.00 0.00 H
-ATOM 10631 2HD1 ILE K 70 -3.481 58.512 29.036 1.00 0.00 H
-ATOM 10632 3HD1 ILE K 70 -1.880 57.738 28.967 1.00 0.00 H
-ATOM 10633 N GLU K 71 -4.368 61.882 28.605 1.00 70.82 N
-ATOM 10634 CA GLU K 71 -4.802 63.154 29.163 1.00 72.17 C
-ATOM 10635 C GLU K 71 -4.300 63.326 30.582 1.00 73.47 C
-ATOM 10636 O GLU K 71 -4.497 62.458 31.436 1.00 72.49 O
-ATOM 10637 CB GLU K 71 -6.321 63.295 29.148 1.00 79.17 C
-ATOM 10638 CG GLU K 71 -6.928 63.349 27.772 1.00 79.40 C
-ATOM 10639 CD GLU K 71 -8.410 63.603 27.758 1.00 85.81 C
-ATOM 10640 OE1 GLU K 71 -8.994 63.765 28.807 1.00 82.39 O
-ATOM 10641 OE2 GLU K 71 -8.960 63.640 26.691 1.00 93.76 O
-ATOM 10642 H GLU K 71 -4.628 61.007 29.037 1.00 0.00 H
-ATOM 10643 HA GLU K 71 -4.384 63.961 28.562 1.00 0.00 H
-ATOM 10644 1HB GLU K 71 -6.760 62.441 29.660 1.00 0.00 H
-ATOM 10645 2HB GLU K 71 -6.600 64.190 29.691 1.00 0.00 H
-ATOM 10646 1HG GLU K 71 -6.436 64.142 27.235 1.00 0.00 H
-ATOM 10647 2HG GLU K 71 -6.717 62.413 27.260 1.00 0.00 H
-ATOM 10648 N SER K 72 -3.638 64.455 30.826 1.00 74.43 N
-ATOM 10649 CA SER K 72 -3.145 64.767 32.159 1.00 74.53 C
-ATOM 10650 C SER K 72 -4.305 65.356 32.920 1.00 76.47 C
-ATOM 10651 O SER K 72 -5.278 65.787 32.290 1.00 75.66 O
-ATOM 10652 CB SER K 72 -1.960 65.733 32.068 1.00 66.96 C
-ATOM 10653 OG SER K 72 -2.352 66.972 31.579 1.00 67.77 O
-ATOM 10654 H SER K 72 -3.527 65.120 30.067 1.00 0.00 H
-ATOM 10655 HA SER K 72 -2.826 63.859 32.668 1.00 0.00 H
-ATOM 10656 1HB SER K 72 -1.488 65.847 33.034 1.00 0.00 H
-ATOM 10657 2HB SER K 72 -1.225 65.304 31.393 1.00 0.00 H
-ATOM 10658 HG SER K 72 -2.513 67.540 32.359 1.00 0.00 H
-ATOM 10659 N GLU K 73 -4.202 65.404 34.242 1.00 77.63 N
-ATOM 10660 CA GLU K 73 -5.273 65.956 35.070 1.00 78.57 C
-ATOM 10661 C GLU K 73 -4.736 66.903 36.142 1.00 79.15 C
-ATOM 10662 O GLU K 73 -3.527 66.972 36.387 1.00 78.97 O
-ATOM 10663 CB GLU K 73 -6.104 64.832 35.711 1.00 75.68 C
-ATOM 10664 CG GLU K 73 -6.835 63.915 34.715 1.00 81.91 C
-ATOM 10665 CD GLU K 73 -7.682 62.868 35.396 1.00 84.12 C
-ATOM 10666 OE1 GLU K 73 -8.445 63.216 36.264 1.00 93.72 O
-ATOM 10667 OE2 GLU K 73 -7.548 61.711 35.051 1.00 77.59 O
-ATOM 10668 H GLU K 73 -3.361 65.039 34.673 1.00 0.00 H
-ATOM 10669 HA GLU K 73 -5.945 66.520 34.439 1.00 0.00 H
-ATOM 10670 1HB GLU K 73 -5.471 64.205 36.313 1.00 0.00 H
-ATOM 10671 2HB GLU K 73 -6.854 65.270 36.371 1.00 0.00 H
-ATOM 10672 1HG GLU K 73 -7.474 64.517 34.062 1.00 0.00 H
-ATOM 10673 2HG GLU K 73 -6.100 63.413 34.090 1.00 0.00 H
-ATOM 10674 N GLY K 74 -5.641 67.671 36.743 1.00 80.48 N
-ATOM 10675 CA GLY K 74 -5.296 68.596 37.816 1.00 80.15 C
-ATOM 10676 C GLY K 74 -6.127 68.323 39.069 1.00 80.36 C
-ATOM 10677 O GLY K 74 -7.244 67.808 38.974 1.00 80.35 O
-ATOM 10678 OXT GLY K 74 -5.751 68.778 40.153 1.00 0.00 O
-ATOM 10679 H GLY K 74 -6.609 67.583 36.466 1.00 0.00 H
-ATOM 10680 1HA GLY K 74 -4.236 68.501 38.055 1.00 0.00 H
-ATOM 10681 2HA GLY K 74 -5.462 69.619 37.482 1.00 0.00 H
-TER
-ATOM 10683 N SER Z 7 16.668 60.526 -4.114 1.00 68.86 N
-ATOM 10684 CA SER Z 7 15.839 61.724 -4.152 1.00 68.49 C
-ATOM 10685 C SER Z 7 14.468 61.465 -4.764 1.00 67.58 C
-ATOM 10686 O SER Z 7 14.322 60.749 -5.766 1.00 66.56 O
-ATOM 10687 CB SER Z 7 16.542 62.831 -4.910 1.00 75.84 C
-ATOM 10688 OG SER Z 7 17.699 63.245 -4.229 1.00 79.83 O
-ATOM 10689 1H SER Z 7 17.483 60.699 -3.544 1.00 0.00 H
-ATOM 10690 2H SER Z 7 16.137 59.764 -3.719 1.00 0.00 H
-ATOM 10691 3H SER Z 7 16.961 60.284 -5.049 1.00 0.00 H
-ATOM 10692 HA SER Z 7 15.685 62.061 -3.124 1.00 0.00 H
-ATOM 10693 1HB SER Z 7 16.807 62.479 -5.906 1.00 0.00 H
-ATOM 10694 2HB SER Z 7 15.862 63.676 -5.037 1.00 0.00 H
-ATOM 10695 HG SER Z 7 18.247 62.467 -4.141 1.00 0.00 H
-ATOM 10696 N ASP Z 8 13.457 62.076 -4.155 1.00 66.74 N
-ATOM 10697 CA ASP Z 8 12.070 61.960 -4.589 1.00 66.83 C
-ATOM 10698 C ASP Z 8 11.860 62.461 -6.001 1.00 67.24 C
-ATOM 10699 O ASP Z 8 12.616 63.310 -6.488 1.00 66.67 O
-ATOM 10700 CB ASP Z 8 11.135 62.724 -3.648 1.00 70.76 C
-ATOM 10701 CG ASP Z 8 10.915 62.018 -2.331 1.00 72.82 C
-ATOM 10702 OD1 ASP Z 8 11.303 60.876 -2.226 1.00 63.18 O
-ATOM 10703 OD2 ASP Z 8 10.339 62.600 -1.450 1.00 70.96 O
-ATOM 10704 H ASP Z 8 13.655 62.648 -3.346 1.00 0.00 H
-ATOM 10705 HA ASP Z 8 11.790 60.906 -4.566 1.00 0.00 H
-ATOM 10706 1HB ASP Z 8 11.545 63.714 -3.452 1.00 0.00 H
-ATOM 10707 2HB ASP Z 8 10.175 62.860 -4.136 1.00 0.00 H
-ATOM 10708 N PHE Z 9 10.819 61.933 -6.638 1.00 66.27 N
-ATOM 10709 CA PHE Z 9 10.461 62.305 -7.995 1.00 66.38 C
-ATOM 10710 C PHE Z 9 8.968 62.420 -8.182 1.00 66.70 C
-ATOM 10711 O PHE Z 9 8.181 61.946 -7.354 1.00 67.01 O
-ATOM 10712 CB PHE Z 9 10.978 61.271 -9.007 1.00 55.66 C
-ATOM 10713 CG PHE Z 9 10.364 59.912 -8.893 1.00 56.48 C
-ATOM 10714 CD1 PHE Z 9 9.235 59.591 -9.630 1.00 51.24 C
-ATOM 10715 CD2 PHE Z 9 10.919 58.943 -8.074 1.00 58.47 C
-ATOM 10716 CE1 PHE Z 9 8.670 58.340 -9.557 1.00 60.71 C
-ATOM 10717 CE2 PHE Z 9 10.351 57.688 -7.995 1.00 59.12 C
-ATOM 10718 CZ PHE Z 9 9.225 57.391 -8.744 1.00 58.38 C
-ATOM 10719 H PHE Z 9 10.263 61.239 -6.159 1.00 0.00 H
-ATOM 10720 HA PHE Z 9 10.893 63.280 -8.204 1.00 0.00 H
-ATOM 10721 1HB PHE Z 9 10.777 61.623 -10.009 1.00 0.00 H
-ATOM 10722 2HB PHE Z 9 12.039 61.169 -8.911 1.00 0.00 H
-ATOM 10723 HD1 PHE Z 9 8.794 60.349 -10.275 1.00 0.00 H
-ATOM 10724 HD2 PHE Z 9 11.811 59.179 -7.489 1.00 0.00 H
-ATOM 10725 HE1 PHE Z 9 7.782 58.108 -10.144 1.00 0.00 H
-ATOM 10726 HE2 PHE Z 9 10.794 56.931 -7.342 1.00 0.00 H
-ATOM 10727 HZ PHE Z 9 8.787 56.415 -8.685 1.00 0.00 H
-ATOM 10728 N VAL Z 10 8.590 63.053 -9.286 1.00 65.47 N
-ATOM 10729 CA VAL Z 10 7.192 63.207 -9.649 1.00 63.81 C
-ATOM 10730 C VAL Z 10 6.964 62.627 -11.040 1.00 61.86 C
-ATOM 10731 O VAL Z 10 7.874 62.625 -11.874 1.00 61.21 O
-ATOM 10732 CB VAL Z 10 6.834 64.709 -9.670 1.00 61.90 C
-ATOM 10733 CG1 VAL Z 10 7.103 65.334 -8.291 1.00 52.20 C
-ATOM 10734 CG2 VAL Z 10 7.645 65.408 -10.753 1.00 65.96 C
-ATOM 10735 H VAL Z 10 9.318 63.438 -9.884 1.00 0.00 H
-ATOM 10736 HA VAL Z 10 6.565 62.679 -8.931 1.00 0.00 H
-ATOM 10737 HB VAL Z 10 5.766 64.819 -9.884 1.00 0.00 H
-ATOM 10738 1HG1 VAL Z 10 6.846 66.382 -8.311 1.00 0.00 H
-ATOM 10739 2HG1 VAL Z 10 6.513 64.823 -7.533 1.00 0.00 H
-ATOM 10740 3HG1 VAL Z 10 8.160 65.234 -8.054 1.00 0.00 H
-ATOM 10741 1HG2 VAL Z 10 7.384 66.464 -10.777 1.00 0.00 H
-ATOM 10742 2HG2 VAL Z 10 8.710 65.300 -10.538 1.00 0.00 H
-ATOM 10743 3HG2 VAL Z 10 7.423 64.957 -11.721 1.00 0.00 H
-ATOM 10744 N VAL Z 11 5.746 62.159 -11.302 1.00 60.89 N
-ATOM 10745 CA VAL Z 11 5.389 61.652 -12.631 1.00 62.75 C
-ATOM 10746 C VAL Z 11 4.378 62.579 -13.264 1.00 64.58 C
-ATOM 10747 O VAL Z 11 3.286 62.741 -12.730 1.00 63.81 O
-ATOM 10748 CB VAL Z 11 4.736 60.263 -12.536 1.00 65.50 C
-ATOM 10749 CG1 VAL Z 11 4.347 59.770 -13.912 1.00 61.90 C
-ATOM 10750 CG2 VAL Z 11 5.664 59.283 -11.834 1.00 65.87 C
-ATOM 10751 H VAL Z 11 5.046 62.163 -10.561 1.00 0.00 H
-ATOM 10752 HA VAL Z 11 6.277 61.608 -13.258 1.00 0.00 H
-ATOM 10753 HB VAL Z 11 3.836 60.357 -11.988 1.00 0.00 H
-ATOM 10754 1HG1 VAL Z 11 3.854 58.807 -13.802 1.00 0.00 H
-ATOM 10755 2HG1 VAL Z 11 3.659 60.483 -14.373 1.00 0.00 H
-ATOM 10756 3HG1 VAL Z 11 5.220 59.666 -14.535 1.00 0.00 H
-ATOM 10757 1HG2 VAL Z 11 5.168 58.313 -11.750 1.00 0.00 H
-ATOM 10758 2HG2 VAL Z 11 6.568 59.167 -12.387 1.00 0.00 H
-ATOM 10759 3HG2 VAL Z 11 5.896 59.654 -10.851 1.00 0.00 H
-ATOM 10760 N ILE Z 12 4.723 63.184 -14.396 1.00 64.87 N
-ATOM 10761 CA ILE Z 12 3.823 64.139 -15.028 1.00 66.01 C
-ATOM 10762 C ILE Z 12 3.406 63.698 -16.435 1.00 65.12 C
-ATOM 10763 O ILE Z 12 4.250 63.486 -17.308 1.00 63.57 O
-ATOM 10764 CB ILE Z 12 4.503 65.523 -15.093 1.00 62.08 C
-ATOM 10765 CG1 ILE Z 12 4.866 65.984 -13.659 1.00 60.24 C
-ATOM 10766 CG2 ILE Z 12 3.552 66.537 -15.754 1.00 65.25 C
-ATOM 10767 CD1 ILE Z 12 5.760 67.171 -13.605 1.00 58.56 C
-ATOM 10768 H ILE Z 12 5.637 63.013 -14.800 1.00 0.00 H
-ATOM 10769 HA ILE Z 12 2.926 64.228 -14.422 1.00 0.00 H
-ATOM 10770 HB ILE Z 12 5.428 65.453 -15.668 1.00 0.00 H
-ATOM 10771 1HG1 ILE Z 12 3.958 66.222 -13.138 1.00 0.00 H
-ATOM 10772 2HG1 ILE Z 12 5.366 65.174 -13.137 1.00 0.00 H
-ATOM 10773 1HG2 ILE Z 12 4.024 67.510 -15.796 1.00 0.00 H
-ATOM 10774 2HG2 ILE Z 12 3.312 66.206 -16.764 1.00 0.00 H
-ATOM 10775 3HG2 ILE Z 12 2.638 66.607 -15.174 1.00 0.00 H
-ATOM 10776 1HD1 ILE Z 12 5.962 67.435 -12.567 1.00 0.00 H
-ATOM 10777 2HD1 ILE Z 12 6.697 66.940 -14.109 1.00 0.00 H
-ATOM 10778 3HD1 ILE Z 12 5.277 67.993 -14.098 1.00 0.00 H
-ATOM 10779 N LYS Z 13 2.093 63.575 -16.650 1.00 64.97 N
-ATOM 10780 CA LYS Z 13 1.552 63.192 -17.954 1.00 67.43 C
-ATOM 10781 C LYS Z 13 0.826 64.332 -18.638 1.00 70.53 C
-ATOM 10782 O LYS Z 13 -0.097 64.934 -18.084 1.00 70.29 O
-ATOM 10783 CB LYS Z 13 0.586 62.016 -17.856 1.00 59.77 C
-ATOM 10784 CG LYS Z 13 -0.000 61.645 -19.219 1.00 49.10 C
-ATOM 10785 CD LYS Z 13 -0.884 60.438 -19.168 1.00 49.26 C
-ATOM 10786 CE LYS Z 13 -1.513 60.191 -20.541 1.00 42.93 C
-ATOM 10787 NZ LYS Z 13 -2.255 58.926 -20.578 1.00 53.88 N
-ATOM 10788 H LYS Z 13 1.453 63.739 -15.877 1.00 0.00 H
-ATOM 10789 HA LYS Z 13 2.376 62.898 -18.600 1.00 0.00 H
-ATOM 10790 1HB LYS Z 13 1.093 61.146 -17.441 1.00 0.00 H
-ATOM 10791 2HB LYS Z 13 -0.232 62.269 -17.197 1.00 0.00 H
-ATOM 10792 1HG LYS Z 13 -0.593 62.480 -19.601 1.00 0.00 H
-ATOM 10793 2HG LYS Z 13 0.815 61.460 -19.923 1.00 0.00 H
-ATOM 10794 1HD LYS Z 13 -0.293 59.565 -18.881 1.00 0.00 H
-ATOM 10795 2HD LYS Z 13 -1.672 60.585 -18.430 1.00 0.00 H
-ATOM 10796 1HE LYS Z 13 -2.197 61.009 -20.773 1.00 0.00 H
-ATOM 10797 2HE LYS Z 13 -0.727 60.158 -21.300 1.00 0.00 H
-ATOM 10798 1HZ LYS Z 13 -2.662 58.781 -21.516 1.00 0.00 H
-ATOM 10799 2HZ LYS Z 13 -1.571 58.184 -20.373 1.00 0.00 H
-ATOM 10800 3HZ LYS Z 13 -2.986 58.927 -19.890 1.00 0.00 H
-ATOM 10801 N ALA Z 14 1.226 64.637 -19.865 1.00 72.45 N
-ATOM 10802 CA ALA Z 14 0.563 65.725 -20.568 1.00 74.90 C
-ATOM 10803 C ALA Z 14 -0.819 65.310 -21.040 1.00 76.39 C
-ATOM 10804 O ALA Z 14 -0.969 64.328 -21.771 1.00 76.13 O
-ATOM 10805 CB ALA Z 14 1.385 66.155 -21.753 1.00 73.01 C
-ATOM 10806 H ALA Z 14 1.994 64.120 -20.301 1.00 0.00 H
-ATOM 10807 HA ALA Z 14 0.452 66.552 -19.874 1.00 0.00 H
-ATOM 10808 1HB ALA Z 14 0.903 66.986 -22.265 1.00 0.00 H
-ATOM 10809 2HB ALA Z 14 2.334 66.456 -21.399 1.00 0.00 H
-ATOM 10810 3HB ALA Z 14 1.496 65.322 -22.431 1.00 0.00 H
-ATOM 10811 N LEU Z 15 -1.837 66.086 -20.675 1.00 78.37 N
-ATOM 10812 CA LEU Z 15 -3.189 65.773 -21.117 1.00 80.25 C
-ATOM 10813 C LEU Z 15 -3.557 66.624 -22.334 1.00 81.00 C
-ATOM 10814 O LEU Z 15 -4.632 66.475 -22.924 1.00 80.94 O
-ATOM 10815 CB LEU Z 15 -4.148 65.962 -19.947 1.00 78.45 C
-ATOM 10816 CG LEU Z 15 -3.835 65.037 -18.726 1.00 77.27 C
-ATOM 10817 CD1 LEU Z 15 -4.775 65.359 -17.565 1.00 76.39 C
-ATOM 10818 CD2 LEU Z 15 -3.953 63.596 -19.150 1.00 68.32 C
-ATOM 10819 H LEU Z 15 -1.700 66.900 -20.072 1.00 0.00 H
-ATOM 10820 HA LEU Z 15 -3.223 64.726 -21.414 1.00 0.00 H
-ATOM 10821 1HB LEU Z 15 -4.076 66.987 -19.625 1.00 0.00 H
-ATOM 10822 2HB LEU Z 15 -5.165 65.766 -20.280 1.00 0.00 H
-ATOM 10823 HG LEU Z 15 -2.825 65.203 -18.399 1.00 0.00 H
-ATOM 10824 1HD1 LEU Z 15 -4.549 64.722 -16.723 1.00 0.00 H
-ATOM 10825 2HD1 LEU Z 15 -4.648 66.388 -17.263 1.00 0.00 H
-ATOM 10826 3HD1 LEU Z 15 -5.805 65.193 -17.870 1.00 0.00 H
-ATOM 10827 1HD2 LEU Z 15 -3.714 62.946 -18.307 1.00 0.00 H
-ATOM 10828 2HD2 LEU Z 15 -4.969 63.400 -19.487 1.00 0.00 H
-ATOM 10829 3HD2 LEU Z 15 -3.253 63.404 -19.965 1.00 0.00 H
-ATOM 10830 N GLU Z 16 -2.625 67.498 -22.715 1.00 81.36 N
-ATOM 10831 CA GLU Z 16 -2.756 68.380 -23.871 1.00 81.67 C
-ATOM 10832 C GLU Z 16 -1.380 68.784 -24.398 1.00 81.60 C
-ATOM 10833 O GLU Z 16 -0.382 68.695 -23.688 1.00 80.68 O
-ATOM 10834 CB GLU Z 16 -3.577 69.628 -23.529 1.00 76.16 C
-ATOM 10835 CG GLU Z 16 -2.970 70.556 -22.482 1.00 78.26 C
-ATOM 10836 CD GLU Z 16 -3.876 71.729 -22.167 1.00 86.94 C
-ATOM 10837 OE1 GLU Z 16 -4.903 71.850 -22.793 1.00 90.43 O
-ATOM 10838 OE2 GLU Z 16 -3.562 72.478 -21.272 1.00 86.49 O
-ATOM 10839 H GLU Z 16 -1.782 67.542 -22.164 1.00 0.00 H
-ATOM 10840 HA GLU Z 16 -3.273 67.841 -24.662 1.00 0.00 H
-ATOM 10841 1HB GLU Z 16 -3.729 70.214 -24.436 1.00 0.00 H
-ATOM 10842 2HB GLU Z 16 -4.559 69.327 -23.167 1.00 0.00 H
-ATOM 10843 1HG GLU Z 16 -2.765 69.995 -21.570 1.00 0.00 H
-ATOM 10844 2HG GLU Z 16 -2.019 70.935 -22.862 1.00 0.00 H
-ATOM 10845 N ASP Z 17 -1.308 69.206 -25.654 1.00 80.54 N
-ATOM 10846 CA ASP Z 17 -0.044 69.722 -26.167 1.00 79.49 C
-ATOM 10847 C ASP Z 17 0.316 71.005 -25.433 1.00 78.01 C
-ATOM 10848 O ASP Z 17 -0.542 71.874 -25.275 1.00 78.86 O
-ATOM 10849 CB ASP Z 17 -0.154 70.032 -27.666 1.00 84.27 C
-ATOM 10850 CG ASP Z 17 -0.272 68.805 -28.589 1.00 90.58 C
-ATOM 10851 OD1 ASP Z 17 -0.017 67.699 -28.160 1.00 92.65 O
-ATOM 10852 OD2 ASP Z 17 -0.628 68.999 -29.724 1.00 93.60 O
-ATOM 10853 H ASP Z 17 -2.140 69.231 -26.228 1.00 0.00 H
-ATOM 10854 HA ASP Z 17 0.741 68.992 -25.986 1.00 0.00 H
-ATOM 10855 1HB ASP Z 17 -1.014 70.675 -27.833 1.00 0.00 H
-ATOM 10856 2HB ASP Z 17 0.732 70.596 -27.968 1.00 0.00 H
-ATOM 10857 N GLY Z 18 1.587 71.192 -25.083 1.00 76.71 N
-ATOM 10858 CA GLY Z 18 1.981 72.464 -24.482 1.00 76.09 C
-ATOM 10859 C GLY Z 18 2.105 72.426 -22.963 1.00 78.92 C
-ATOM 10860 O GLY Z 18 2.080 73.470 -22.310 1.00 79.60 O
-ATOM 10861 H GLY Z 18 2.269 70.441 -25.182 1.00 0.00 H
-ATOM 10862 1HA GLY Z 18 2.936 72.774 -24.907 1.00 0.00 H
-ATOM 10863 2HA GLY Z 18 1.258 73.228 -24.761 1.00 0.00 H
-ATOM 10864 N VAL Z 19 2.204 71.236 -22.392 1.00 78.08 N
-ATOM 10865 CA VAL Z 19 2.377 71.141 -20.948 1.00 76.28 C
-ATOM 10866 C VAL Z 19 3.811 71.473 -20.622 1.00 74.87 C
-ATOM 10867 O VAL Z 19 4.727 71.017 -21.299 1.00 72.79 O
-ATOM 10868 CB VAL Z 19 1.972 69.767 -20.411 1.00 75.09 C
-ATOM 10869 CG1 VAL Z 19 2.350 69.632 -18.931 1.00 73.56 C
-ATOM 10870 CG2 VAL Z 19 0.483 69.630 -20.574 1.00 73.28 C
-ATOM 10871 H VAL Z 19 2.232 70.401 -22.974 1.00 0.00 H
-ATOM 10872 HA VAL Z 19 1.734 71.879 -20.469 1.00 0.00 H
-ATOM 10873 HB VAL Z 19 2.466 69.014 -20.957 1.00 0.00 H
-ATOM 10874 1HG1 VAL Z 19 2.060 68.652 -18.571 1.00 0.00 H
-ATOM 10875 2HG1 VAL Z 19 3.431 69.746 -18.817 1.00 0.00 H
-ATOM 10876 3HG1 VAL Z 19 1.841 70.399 -18.351 1.00 0.00 H
-ATOM 10877 1HG2 VAL Z 19 0.154 68.678 -20.217 1.00 0.00 H
-ATOM 10878 2HG2 VAL Z 19 -0.016 70.412 -20.010 1.00 0.00 H
-ATOM 10879 3HG2 VAL Z 19 0.228 69.729 -21.621 1.00 0.00 H
-ATOM 10880 N ASN Z 20 4.010 72.316 -19.628 1.00 75.20 N
-ATOM 10881 CA ASN Z 20 5.356 72.753 -19.293 1.00 76.35 C
-ATOM 10882 C ASN Z 20 5.719 72.478 -17.854 1.00 77.34 C
-ATOM 10883 O ASN Z 20 5.016 72.886 -16.924 1.00 78.47 O
-ATOM 10884 CB ASN Z 20 5.544 74.220 -19.636 1.00 79.28 C
-ATOM 10885 CG ASN Z 20 5.526 74.485 -21.140 1.00 89.07 C
-ATOM 10886 OD1 ASN Z 20 6.523 74.274 -21.837 1.00 94.49 O
-ATOM 10887 ND2 ASN Z 20 4.411 74.944 -21.646 1.00 91.31 N
-ATOM 10888 H ASN Z 20 3.209 72.646 -19.094 1.00 0.00 H
-ATOM 10889 HA ASN Z 20 6.062 72.183 -19.895 1.00 0.00 H
-ATOM 10890 1HB ASN Z 20 4.760 74.805 -19.171 1.00 0.00 H
-ATOM 10891 2HB ASN Z 20 6.497 74.562 -19.225 1.00 0.00 H
-ATOM 10892 1HD2 ASN Z 20 4.343 75.130 -22.627 1.00 0.00 H
-ATOM 10893 2HD2 ASN Z 20 3.615 75.100 -21.062 1.00 0.00 H
-ATOM 10894 N VAL Z 21 6.809 71.744 -17.682 1.00 75.13 N
-ATOM 10895 CA VAL Z 21 7.309 71.407 -16.365 1.00 74.02 C
-ATOM 10896 C VAL Z 21 8.572 72.230 -16.123 1.00 73.34 C
-ATOM 10897 O VAL Z 21 9.545 72.137 -16.878 1.00 74.07 O
-ATOM 10898 CB VAL Z 21 7.593 69.905 -16.291 1.00 69.64 C
-ATOM 10899 CG1 VAL Z 21 8.116 69.556 -14.923 1.00 66.58 C
-ATOM 10900 CG2 VAL Z 21 6.303 69.146 -16.626 1.00 61.67 C
-ATOM 10901 H VAL Z 21 7.322 71.420 -18.501 1.00 0.00 H
-ATOM 10902 HA VAL Z 21 6.562 71.667 -15.613 1.00 0.00 H
-ATOM 10903 HB VAL Z 21 8.366 69.647 -17.015 1.00 0.00 H
-ATOM 10904 1HG1 VAL Z 21 8.333 68.493 -14.873 1.00 0.00 H
-ATOM 10905 2HG1 VAL Z 21 9.029 70.120 -14.725 1.00 0.00 H
-ATOM 10906 3HG1 VAL Z 21 7.362 69.811 -14.185 1.00 0.00 H
-ATOM 10907 1HG2 VAL Z 21 6.483 68.074 -16.587 1.00 0.00 H
-ATOM 10908 2HG2 VAL Z 21 5.537 69.416 -15.906 1.00 0.00 H
-ATOM 10909 3HG2 VAL Z 21 5.967 69.417 -17.629 1.00 0.00 H
-ATOM 10910 N ILE Z 22 8.537 73.073 -15.100 1.00 72.16 N
-ATOM 10911 CA ILE Z 22 9.602 74.032 -14.869 1.00 71.22 C
-ATOM 10912 C ILE Z 22 10.426 73.744 -13.626 1.00 69.95 C
-ATOM 10913 O ILE Z 22 9.896 73.561 -12.528 1.00 69.76 O
-ATOM 10914 CB ILE Z 22 9.024 75.460 -14.782 1.00 74.57 C
-ATOM 10915 CG1 ILE Z 22 8.290 75.799 -16.082 1.00 71.78 C
-ATOM 10916 CG2 ILE Z 22 10.121 76.476 -14.502 1.00 66.14 C
-ATOM 10917 CD1 ILE Z 22 6.804 75.500 -16.023 1.00 71.68 C
-ATOM 10918 H ILE Z 22 7.727 73.083 -14.499 1.00 0.00 H
-ATOM 10919 HA ILE Z 22 10.265 73.998 -15.720 1.00 0.00 H
-ATOM 10920 HB ILE Z 22 8.300 75.492 -14.000 1.00 0.00 H
-ATOM 10921 1HG1 ILE Z 22 8.425 76.855 -16.306 1.00 0.00 H
-ATOM 10922 2HG1 ILE Z 22 8.725 75.214 -16.893 1.00 0.00 H
-ATOM 10923 1HG2 ILE Z 22 9.685 77.472 -14.440 1.00 0.00 H
-ATOM 10924 2HG2 ILE Z 22 10.617 76.242 -13.564 1.00 0.00 H
-ATOM 10925 3HG2 ILE Z 22 10.850 76.445 -15.314 1.00 0.00 H
-ATOM 10926 1HD1 ILE Z 22 6.347 75.749 -16.974 1.00 0.00 H
-ATOM 10927 2HD1 ILE Z 22 6.652 74.449 -15.817 1.00 0.00 H
-ATOM 10928 3HD1 ILE Z 22 6.344 76.088 -15.231 1.00 0.00 H
-ATOM 10929 N GLY Z 23 11.741 73.673 -13.812 1.00 68.71 N
-ATOM 10930 CA GLY Z 23 12.650 73.450 -12.700 1.00 67.52 C
-ATOM 10931 C GLY Z 23 13.063 74.784 -12.090 1.00 67.48 C
-ATOM 10932 O GLY Z 23 13.557 75.679 -12.799 1.00 66.25 O
-ATOM 10933 H GLY Z 23 12.110 73.826 -14.744 1.00 0.00 H
-ATOM 10934 1HA GLY Z 23 12.166 72.832 -11.943 1.00 0.00 H
-ATOM 10935 2HA GLY Z 23 13.532 72.913 -13.048 1.00 0.00 H
-ATOM 10936 N LEU Z 24 12.890 74.880 -10.763 1.00 69.58 N
-ATOM 10937 CA LEU Z 24 13.223 76.053 -9.950 1.00 68.49 C
-ATOM 10938 C LEU Z 24 14.470 75.780 -9.118 1.00 68.94 C
-ATOM 10939 O LEU Z 24 14.578 74.733 -8.458 1.00 66.69 O
-ATOM 10940 CB LEU Z 24 12.070 76.411 -9.019 1.00 63.79 C
-ATOM 10941 CG LEU Z 24 10.847 77.122 -9.644 1.00 69.14 C
-ATOM 10942 CD1 LEU Z 24 10.041 76.122 -10.467 1.00 69.90 C
-ATOM 10943 CD2 LEU Z 24 9.981 77.714 -8.535 1.00 73.28 C
-ATOM 10944 H LEU Z 24 12.459 74.094 -10.280 1.00 0.00 H
-ATOM 10945 HA LEU Z 24 13.419 76.890 -10.606 1.00 0.00 H
-ATOM 10946 1HB LEU Z 24 11.726 75.495 -8.609 1.00 0.00 H
-ATOM 10947 2HB LEU Z 24 12.457 77.034 -8.211 1.00 0.00 H
-ATOM 10948 HG LEU Z 24 11.190 77.919 -10.307 1.00 0.00 H
-ATOM 10949 1HD1 LEU Z 24 9.189 76.625 -10.910 1.00 0.00 H
-ATOM 10950 2HD1 LEU Z 24 10.653 75.714 -11.246 1.00 0.00 H
-ATOM 10951 3HD1 LEU Z 24 9.692 75.312 -9.824 1.00 0.00 H
-ATOM 10952 1HD2 LEU Z 24 9.120 78.223 -8.977 1.00 0.00 H
-ATOM 10953 2HD2 LEU Z 24 9.633 76.922 -7.880 1.00 0.00 H
-ATOM 10954 3HD2 LEU Z 24 10.565 78.434 -7.959 1.00 0.00 H
-ATOM 10955 N THR Z 25 15.400 76.732 -9.156 1.00 71.22 N
-ATOM 10956 CA THR Z 25 16.722 76.558 -8.571 1.00 71.81 C
-ATOM 10957 C THR Z 25 16.780 76.395 -7.069 1.00 72.21 C
-ATOM 10958 O THR Z 25 16.049 77.041 -6.318 1.00 72.78 O
-ATOM 10959 CB THR Z 25 17.635 77.749 -8.939 1.00 76.13 C
-ATOM 10960 OG1 THR Z 25 17.057 78.998 -8.464 1.00 83.05 O
-ATOM 10961 CG2 THR Z 25 17.807 77.796 -10.447 1.00 76.92 C
-ATOM 10962 H THR Z 25 15.197 77.579 -9.677 1.00 0.00 H
-ATOM 10963 HA THR Z 25 17.146 75.670 -9.021 1.00 0.00 H
-ATOM 10964 HB THR Z 25 18.616 77.620 -8.485 1.00 0.00 H
-ATOM 10965 HG1 THR Z 25 17.510 79.310 -7.639 1.00 0.00 H
-ATOM 10966 1HG2 THR Z 25 18.455 78.625 -10.712 1.00 0.00 H
-ATOM 10967 2HG2 THR Z 25 18.258 76.863 -10.780 1.00 0.00 H
-ATOM 10968 3HG2 THR Z 25 16.838 77.917 -10.932 1.00 0.00 H
-ATOM 10969 N ARG Z 26 17.721 75.547 -6.660 1.00 71.56 N
-ATOM 10970 CA ARG Z 26 18.062 75.312 -5.266 1.00 70.46 C
-ATOM 10971 C ARG Z 26 19.075 76.342 -4.788 1.00 69.20 C
-ATOM 10972 O ARG Z 26 20.069 76.603 -5.465 1.00 67.76 O
-ATOM 10973 CB ARG Z 26 18.641 73.916 -5.071 1.00 64.50 C
-ATOM 10974 CG ARG Z 26 18.932 73.552 -3.617 1.00 58.10 C
-ATOM 10975 CD ARG Z 26 19.523 72.191 -3.481 1.00 63.26 C
-ATOM 10976 NE ARG Z 26 18.653 71.153 -4.001 1.00 61.46 N
-ATOM 10977 CZ ARG Z 26 17.624 70.598 -3.343 1.00 60.61 C
-ATOM 10978 NH1 ARG Z 26 17.320 70.979 -2.125 1.00 57.93 N
-ATOM 10979 NH2 ARG Z 26 16.937 69.664 -3.956 1.00 58.21 N
-ATOM 10980 H ARG Z 26 18.218 75.027 -7.380 1.00 0.00 H
-ATOM 10981 HA ARG Z 26 17.158 75.409 -4.666 1.00 0.00 H
-ATOM 10982 1HB ARG Z 26 17.946 73.173 -5.466 1.00 0.00 H
-ATOM 10983 2HB ARG Z 26 19.568 73.818 -5.636 1.00 0.00 H
-ATOM 10984 1HG ARG Z 26 19.656 74.263 -3.220 1.00 0.00 H
-ATOM 10985 2HG ARG Z 26 18.016 73.601 -3.030 1.00 0.00 H
-ATOM 10986 1HD ARG Z 26 20.463 72.151 -4.023 1.00 0.00 H
-ATOM 10987 2HD ARG Z 26 19.708 71.983 -2.429 1.00 0.00 H
-ATOM 10988 HE ARG Z 26 18.832 70.788 -4.944 1.00 0.00 H
-ATOM 10989 1HH1 ARG Z 26 17.869 71.693 -1.679 1.00 0.00 H
-ATOM 10990 2HH1 ARG Z 26 16.552 70.546 -1.630 1.00 0.00 H
-ATOM 10991 1HH2 ARG Z 26 17.230 69.401 -4.899 1.00 0.00 H
-ATOM 10992 2HH2 ARG Z 26 16.136 69.220 -3.515 1.00 0.00 H
-ATOM 10993 N GLY Z 27 18.837 76.919 -3.616 1.00 68.81 N
-ATOM 10994 CA GLY Z 27 19.759 77.900 -3.056 1.00 68.77 C
-ATOM 10995 C GLY Z 27 19.051 79.190 -2.682 1.00 69.85 C
-ATOM 10996 O GLY Z 27 17.826 79.290 -2.773 1.00 69.21 O
-ATOM 10997 H GLY Z 27 17.999 76.678 -3.105 1.00 0.00 H
-ATOM 10998 1HA GLY Z 27 20.241 77.478 -2.175 1.00 0.00 H
-ATOM 10999 2HA GLY Z 27 20.548 78.116 -3.775 1.00 0.00 H
-ATOM 11000 N ALA Z 28 19.819 80.177 -2.232 1.00 71.48 N
-ATOM 11001 CA ALA Z 28 19.276 81.462 -1.803 1.00 72.94 C
-ATOM 11002 C ALA Z 28 18.512 82.162 -2.924 1.00 73.37 C
-ATOM 11003 O ALA Z 28 17.505 82.819 -2.694 1.00 72.84 O
-ATOM 11004 CB ALA Z 28 20.389 82.366 -1.315 1.00 65.55 C
-ATOM 11005 H ALA Z 28 20.819 80.030 -2.185 1.00 0.00 H
-ATOM 11006 HA ALA Z 28 18.573 81.275 -0.983 1.00 0.00 H
-ATOM 11007 1HB ALA Z 28 19.968 83.310 -0.975 1.00 0.00 H
-ATOM 11008 2HB ALA Z 28 20.920 81.890 -0.499 1.00 0.00 H
-ATOM 11009 3HB ALA Z 28 21.083 82.557 -2.139 1.00 0.00 H
-ATOM 11010 N ASP Z 29 19.027 82.030 -4.145 1.00 75.46 N
-ATOM 11011 CA ASP Z 29 18.398 82.672 -5.287 1.00 77.29 C
-ATOM 11012 C ASP Z 29 17.474 81.695 -6.009 1.00 78.34 C
-ATOM 11013 O ASP Z 29 17.933 80.706 -6.598 1.00 78.34 O
-ATOM 11014 CB ASP Z 29 19.465 83.210 -6.246 1.00 84.16 C
-ATOM 11015 CG ASP Z 29 20.283 84.384 -5.654 1.00 87.97 C
-ATOM 11016 OD1 ASP Z 29 19.812 85.028 -4.747 1.00 92.12 O
-ATOM 11017 OD2 ASP Z 29 21.374 84.604 -6.116 1.00 87.48 O
-ATOM 11018 H ASP Z 29 19.852 81.469 -4.277 1.00 0.00 H
-ATOM 11019 HA ASP Z 29 17.797 83.508 -4.937 1.00 0.00 H
-ATOM 11020 1HB ASP Z 29 20.154 82.406 -6.518 1.00 0.00 H
-ATOM 11021 2HB ASP Z 29 18.980 83.546 -7.164 1.00 0.00 H
-ATOM 11022 N THR Z 30 16.176 81.986 -5.976 1.00 79.18 N
-ATOM 11023 CA THR Z 30 15.204 81.106 -6.608 1.00 80.41 C
-ATOM 11024 C THR Z 30 14.731 81.707 -7.924 1.00 82.92 C
-ATOM 11025 O THR Z 30 14.198 82.815 -7.969 1.00 83.65 O
-ATOM 11026 CB THR Z 30 13.993 80.827 -5.698 1.00 76.91 C
-ATOM 11027 OG1 THR Z 30 14.427 80.189 -4.487 1.00 78.62 O
-ATOM 11028 CG2 THR Z 30 13.003 79.907 -6.418 1.00 72.81 C
-ATOM 11029 H THR Z 30 15.863 82.811 -5.484 1.00 0.00 H
-ATOM 11030 HA THR Z 30 15.680 80.152 -6.817 1.00 0.00 H
-ATOM 11031 HB THR Z 30 13.508 81.758 -5.450 1.00 0.00 H
-ATOM 11032 HG1 THR Z 30 15.001 80.781 -3.994 1.00 0.00 H
-ATOM 11033 1HG2 THR Z 30 12.151 79.713 -5.769 1.00 0.00 H
-ATOM 11034 2HG2 THR Z 30 12.660 80.388 -7.333 1.00 0.00 H
-ATOM 11035 3HG2 THR Z 30 13.496 78.964 -6.665 1.00 0.00 H
-ATOM 11036 N ARG Z 31 14.945 80.956 -8.988 1.00 83.13 N
-ATOM 11037 CA ARG Z 31 14.603 81.330 -10.351 1.00 83.71 C
-ATOM 11038 C ARG Z 31 14.345 80.071 -11.144 1.00 83.79 C
-ATOM 11039 O ARG Z 31 14.606 78.977 -10.656 1.00 85.08 O
-ATOM 11040 CB ARG Z 31 15.749 82.113 -10.986 1.00 89.44 C
-ATOM 11041 CG ARG Z 31 17.068 81.352 -10.955 1.00 96.86 C
-ATOM 11042 CD ARG Z 31 18.069 81.782 -11.964 1.00 96.40 C
-ATOM 11043 NE ARG Z 31 17.713 81.325 -13.284 1.00 97.43 N
-ATOM 11044 CZ ARG Z 31 18.429 81.510 -14.398 1.00 96.58 C
-ATOM 11045 NH1 ARG Z 31 19.567 82.173 -14.372 1.00 97.23 N
-ATOM 11046 NH2 ARG Z 31 17.962 80.997 -15.514 1.00 96.73 N
-ATOM 11047 H ARG Z 31 15.437 80.079 -8.842 1.00 0.00 H
-ATOM 11048 HA ARG Z 31 13.701 81.943 -10.341 1.00 0.00 H
-ATOM 11049 1HB ARG Z 31 15.514 82.338 -12.027 1.00 0.00 H
-ATOM 11050 2HB ARG Z 31 15.891 83.057 -10.460 1.00 0.00 H
-ATOM 11051 1HG ARG Z 31 17.517 81.430 -9.962 1.00 0.00 H
-ATOM 11052 2HG ARG Z 31 16.839 80.318 -11.163 1.00 0.00 H
-ATOM 11053 1HD ARG Z 31 18.138 82.869 -11.984 1.00 0.00 H
-ATOM 11054 2HD ARG Z 31 19.041 81.361 -11.711 1.00 0.00 H
-ATOM 11055 HE ARG Z 31 16.842 80.794 -13.393 1.00 0.00 H
-ATOM 11056 1HH1 ARG Z 31 19.910 82.554 -13.501 1.00 0.00 H
-ATOM 11057 2HH1 ARG Z 31 20.097 82.296 -15.221 1.00 0.00 H
-ATOM 11058 1HH2 ARG Z 31 17.079 80.474 -15.461 1.00 0.00 H
-ATOM 11059 2HH2 ARG Z 31 18.465 81.101 -16.382 1.00 0.00 H
-ATOM 11060 N PHE Z 32 13.821 80.183 -12.349 1.00 81.47 N
-ATOM 11061 CA PHE Z 32 13.693 78.954 -13.110 1.00 79.61 C
-ATOM 11062 C PHE Z 32 14.985 78.749 -13.872 1.00 78.31 C
-ATOM 11063 O PHE Z 32 15.659 79.728 -14.211 1.00 79.99 O
-ATOM 11064 CB PHE Z 32 12.513 79.005 -14.068 1.00 85.70 C
-ATOM 11065 CG PHE Z 32 12.605 80.066 -15.108 1.00 96.52 C
-ATOM 11066 CD1 PHE Z 32 12.069 81.328 -14.888 1.00 98.62 C
-ATOM 11067 CD2 PHE Z 32 13.220 79.804 -16.322 1.00 99.55 C
-ATOM 11068 CE1 PHE Z 32 12.147 82.305 -15.865 1.00 95.02 C
-ATOM 11069 CE2 PHE Z 32 13.299 80.778 -17.300 1.00 98.18 C
-ATOM 11070 CZ PHE Z 32 12.764 82.032 -17.069 1.00 97.66 C
-ATOM 11071 H PHE Z 32 13.558 81.076 -12.741 1.00 0.00 H
-ATOM 11072 HA PHE Z 32 13.549 78.119 -12.433 1.00 0.00 H
-ATOM 11073 1HB PHE Z 32 12.449 78.050 -14.577 1.00 0.00 H
-ATOM 11074 2HB PHE Z 32 11.589 79.144 -13.508 1.00 0.00 H
-ATOM 11075 HD1 PHE Z 32 11.581 81.543 -13.938 1.00 0.00 H
-ATOM 11076 HD2 PHE Z 32 13.640 78.811 -16.502 1.00 0.00 H
-ATOM 11077 HE1 PHE Z 32 11.723 83.293 -15.682 1.00 0.00 H
-ATOM 11078 HE2 PHE Z 32 13.783 80.560 -18.251 1.00 0.00 H
-ATOM 11079 HZ PHE Z 32 12.824 82.801 -17.838 1.00 0.00 H
-ATOM 11080 N HIS Z 33 15.317 77.503 -14.167 1.00 74.57 N
-ATOM 11081 CA HIS Z 33 16.511 77.241 -14.958 1.00 69.97 C
-ATOM 11082 C HIS Z 33 16.189 76.383 -16.171 1.00 67.05 C
-ATOM 11083 O HIS Z 33 16.955 76.347 -17.134 1.00 65.58 O
-ATOM 11084 CB HIS Z 33 17.582 76.573 -14.085 1.00 71.21 C
-ATOM 11085 CG HIS Z 33 17.234 75.190 -13.606 1.00 72.81 C
-ATOM 11086 ND1 HIS Z 33 17.425 74.079 -14.393 1.00 71.05 N
-ATOM 11087 CD2 HIS Z 33 16.702 74.735 -12.441 1.00 73.72 C
-ATOM 11088 CE1 HIS Z 33 17.034 73.006 -13.741 1.00 74.58 C
-ATOM 11089 NE2 HIS Z 33 16.594 73.374 -12.556 1.00 71.27 N
-ATOM 11090 H HIS Z 33 14.737 76.742 -13.825 1.00 0.00 H
-ATOM 11091 HA HIS Z 33 16.920 78.179 -15.325 1.00 0.00 H
-ATOM 11092 1HB HIS Z 33 18.513 76.504 -14.651 1.00 0.00 H
-ATOM 11093 2HB HIS Z 33 17.777 77.195 -13.222 1.00 0.00 H
-ATOM 11094 HD2 HIS Z 33 16.411 75.329 -11.576 1.00 0.00 H
-ATOM 11095 HE1 HIS Z 33 17.071 71.985 -14.121 1.00 0.00 H
-ATOM 11096 HE2 HIS Z 33 16.236 72.739 -11.857 1.00 0.00 H
-ATOM 11097 N HIS Z 34 15.032 75.726 -16.145 1.00 66.06 N
-ATOM 11098 CA HIS Z 34 14.658 74.857 -17.262 1.00 66.21 C
-ATOM 11099 C HIS Z 34 13.162 74.650 -17.389 1.00 67.22 C
-ATOM 11100 O HIS Z 34 12.458 74.469 -16.401 1.00 66.30 O
-ATOM 11101 CB HIS Z 34 15.335 73.485 -17.165 1.00 65.21 C
-ATOM 11102 CG HIS Z 34 15.046 72.586 -18.348 1.00 66.45 C
-ATOM 11103 ND1 HIS Z 34 15.581 72.804 -19.602 1.00 65.62 N
-ATOM 11104 CD2 HIS Z 34 14.286 71.467 -18.452 1.00 69.54 C
-ATOM 11105 CE1 HIS Z 34 15.156 71.855 -20.429 1.00 69.97 C
-ATOM 11106 NE2 HIS Z 34 14.374 71.033 -19.755 1.00 69.77 N
-ATOM 11107 H HIS Z 34 14.446 75.790 -15.314 1.00 0.00 H
-ATOM 11108 HA HIS Z 34 14.993 75.317 -18.190 1.00 0.00 H
-ATOM 11109 1HB HIS Z 34 16.418 73.614 -17.094 1.00 0.00 H
-ATOM 11110 2HB HIS Z 34 15.008 72.978 -16.259 1.00 0.00 H
-ATOM 11111 HD2 HIS Z 34 13.714 70.997 -17.654 1.00 0.00 H
-ATOM 11112 HE1 HIS Z 34 15.411 71.764 -21.485 1.00 0.00 H
-ATOM 11113 HE2 HIS Z 34 13.904 70.198 -20.142 1.00 0.00 H
-ATOM 11114 N SER Z 35 12.679 74.642 -18.627 1.00 68.43 N
-ATOM 11115 CA SER Z 35 11.268 74.384 -18.890 1.00 70.13 C
-ATOM 11116 C SER Z 35 11.133 73.278 -19.932 1.00 70.57 C
-ATOM 11117 O SER Z 35 11.455 73.468 -21.106 1.00 72.35 O
-ATOM 11118 CB SER Z 35 10.586 75.658 -19.368 1.00 73.21 C
-ATOM 11119 OG SER Z 35 9.241 75.429 -19.681 1.00 75.09 O
-ATOM 11120 H SER Z 35 13.308 74.797 -19.403 1.00 0.00 H
-ATOM 11121 HA SER Z 35 10.789 74.046 -17.976 1.00 0.00 H
-ATOM 11122 1HB SER Z 35 10.657 76.420 -18.590 1.00 0.00 H
-ATOM 11123 2HB SER Z 35 11.106 76.039 -20.245 1.00 0.00 H
-ATOM 11124 HG SER Z 35 9.236 74.722 -20.331 1.00 0.00 H
-ATOM 11125 N GLU Z 36 10.693 72.109 -19.474 1.00 69.75 N
-ATOM 11126 CA GLU Z 36 10.571 70.934 -20.326 1.00 70.41 C
-ATOM 11127 C GLU Z 36 9.158 70.858 -20.879 1.00 71.53 C
-ATOM 11128 O GLU Z 36 8.191 70.761 -20.116 1.00 72.50 O
-ATOM 11129 CB GLU Z 36 10.915 69.658 -19.536 1.00 63.50 C
-ATOM 11130 CG GLU Z 36 10.947 68.349 -20.351 1.00 73.15 C
-ATOM 11131 CD GLU Z 36 12.111 68.238 -21.332 1.00 68.26 C
-ATOM 11132 OE1 GLU Z 36 13.162 68.795 -21.088 1.00 62.66 O
-ATOM 11133 OE2 GLU Z 36 11.939 67.566 -22.328 1.00 59.79 O
-ATOM 11134 H GLU Z 36 10.423 72.039 -18.497 1.00 0.00 H
-ATOM 11135 HA GLU Z 36 11.263 71.029 -21.163 1.00 0.00 H
-ATOM 11136 1HB GLU Z 36 11.881 69.776 -19.059 1.00 0.00 H
-ATOM 11137 2HB GLU Z 36 10.181 69.522 -18.740 1.00 0.00 H
-ATOM 11138 1HG GLU Z 36 11.017 67.511 -19.665 1.00 0.00 H
-ATOM 11139 2HG GLU Z 36 10.006 68.258 -20.897 1.00 0.00 H
-ATOM 11140 N LYS Z 37 9.014 70.955 -22.195 1.00 70.76 N
-ATOM 11141 CA LYS Z 37 7.670 70.929 -22.745 1.00 70.04 C
-ATOM 11142 C LYS Z 37 7.254 69.506 -23.058 1.00 70.08 C
-ATOM 11143 O LYS Z 37 8.089 68.680 -23.450 1.00 69.58 O
-ATOM 11144 CB LYS Z 37 7.568 71.783 -24.007 1.00 72.60 C
-ATOM 11145 CG LYS Z 37 8.379 71.269 -25.194 1.00 49.86 C
-ATOM 11146 CD LYS Z 37 8.235 72.190 -26.408 1.00 45.00 C
-ATOM 11147 CE LYS Z 37 8.967 71.633 -27.628 1.00 45.00 C
-ATOM 11148 NZ LYS Z 37 8.817 72.516 -28.817 1.00 45.00 N
-ATOM 11149 H LYS Z 37 9.822 71.042 -22.796 1.00 0.00 H
-ATOM 11150 HA LYS Z 37 6.983 71.331 -22.004 1.00 0.00 H
-ATOM 11151 1HB LYS Z 37 6.522 71.846 -24.311 1.00 0.00 H
-ATOM 11152 2HB LYS Z 37 7.903 72.798 -23.784 1.00 0.00 H
-ATOM 11153 1HG LYS Z 37 9.432 71.208 -24.913 1.00 0.00 H
-ATOM 11154 2HG LYS Z 37 8.031 70.268 -25.462 1.00 0.00 H
-ATOM 11155 1HD LYS Z 37 7.177 72.310 -26.651 1.00 0.00 H
-ATOM 11156 2HD LYS Z 37 8.648 73.171 -26.168 1.00 0.00 H
-ATOM 11157 1HE LYS Z 37 10.026 71.535 -27.393 1.00 0.00 H
-ATOM 11158 2HE LYS Z 37 8.564 70.647 -27.867 1.00 0.00 H
-ATOM 11159 1HZ LYS Z 37 9.313 72.115 -29.601 1.00 0.00 H
-ATOM 11160 2HZ LYS Z 37 7.836 72.602 -29.048 1.00 0.00 H
-ATOM 11161 3HZ LYS Z 37 9.196 73.429 -28.610 1.00 0.00 H
-ATOM 11162 N LEU Z 38 5.963 69.233 -22.939 1.00 72.61 N
-ATOM 11163 CA LEU Z 38 5.418 67.942 -23.293 1.00 75.12 C
-ATOM 11164 C LEU Z 38 4.333 68.079 -24.366 1.00 75.83 C
-ATOM 11165 O LEU Z 38 3.487 68.994 -24.311 1.00 76.18 O
-ATOM 11166 CB LEU Z 38 4.797 67.287 -22.056 1.00 74.29 C
-ATOM 11167 CG LEU Z 38 5.681 67.115 -20.795 1.00 76.98 C
-ATOM 11168 CD1 LEU Z 38 4.819 66.558 -19.643 1.00 65.02 C
-ATOM 11169 CD2 LEU Z 38 6.811 66.202 -21.088 1.00 75.65 C
-ATOM 11170 H LEU Z 38 5.346 69.950 -22.569 1.00 0.00 H
-ATOM 11171 HA LEU Z 38 6.215 67.312 -23.686 1.00 0.00 H
-ATOM 11172 1HB LEU Z 38 3.985 67.882 -21.778 1.00 0.00 H
-ATOM 11173 2HB LEU Z 38 4.424 66.311 -22.336 1.00 0.00 H
-ATOM 11174 HG LEU Z 38 6.072 68.091 -20.494 1.00 0.00 H
-ATOM 11175 1HD1 LEU Z 38 5.431 66.449 -18.744 1.00 0.00 H
-ATOM 11176 2HD1 LEU Z 38 4.001 67.243 -19.438 1.00 0.00 H
-ATOM 11177 3HD1 LEU Z 38 4.413 65.582 -19.924 1.00 0.00 H
-ATOM 11178 1HD2 LEU Z 38 7.424 66.112 -20.206 1.00 0.00 H
-ATOM 11179 2HD2 LEU Z 38 6.431 65.222 -21.380 1.00 0.00 H
-ATOM 11180 3HD2 LEU Z 38 7.398 66.621 -21.896 1.00 0.00 H
-ATOM 11181 N ASP Z 39 4.306 67.123 -25.288 1.00 75.64 N
-ATOM 11182 CA ASP Z 39 3.214 67.006 -26.246 1.00 77.35 C
-ATOM 11183 C ASP Z 39 2.157 66.138 -25.583 1.00 76.51 C
-ATOM 11184 O ASP Z 39 2.486 65.396 -24.654 1.00 76.90 O
-ATOM 11185 CB ASP Z 39 3.670 66.369 -27.559 1.00 85.95 C
-ATOM 11186 CG ASP Z 39 4.676 67.222 -28.349 1.00 90.46 C
-ATOM 11187 OD1 ASP Z 39 4.856 68.374 -28.020 1.00 86.79 O
-ATOM 11188 OD2 ASP Z 39 5.253 66.707 -29.274 1.00 94.97 O
-ATOM 11189 H ASP Z 39 5.053 66.432 -25.292 1.00 0.00 H
-ATOM 11190 HA ASP Z 39 2.790 67.990 -26.451 1.00 0.00 H
-ATOM 11191 1HB ASP Z 39 4.106 65.391 -27.356 1.00 0.00 H
-ATOM 11192 2HB ASP Z 39 2.791 66.206 -28.196 1.00 0.00 H
-ATOM 11193 N LYS Z 40 0.915 66.195 -26.040 1.00 76.11 N
-ATOM 11194 CA LYS Z 40 -0.109 65.356 -25.431 1.00 76.13 C
-ATOM 11195 C LYS Z 40 0.335 63.907 -25.445 1.00 76.38 C
-ATOM 11196 O LYS Z 40 0.754 63.393 -26.482 1.00 74.71 O
-ATOM 11197 CB LYS Z 40 -1.445 65.495 -26.158 1.00 80.90 C
-ATOM 11198 CG LYS Z 40 -2.591 64.701 -25.530 1.00 76.56 C
-ATOM 11199 CD LYS Z 40 -3.924 65.017 -26.208 1.00 79.58 C
-ATOM 11200 CE LYS Z 40 -5.078 64.261 -25.563 1.00 83.69 C
-ATOM 11201 NZ LYS Z 40 -6.389 64.629 -26.166 1.00 86.89 N
-ATOM 11202 H LYS Z 40 0.664 66.820 -26.807 1.00 0.00 H
-ATOM 11203 HA LYS Z 40 -0.242 65.664 -24.393 1.00 0.00 H
-ATOM 11204 1HB LYS Z 40 -1.732 66.533 -26.198 1.00 0.00 H
-ATOM 11205 2HB LYS Z 40 -1.327 65.162 -27.190 1.00 0.00 H
-ATOM 11206 1HG LYS Z 40 -2.385 63.634 -25.627 1.00 0.00 H
-ATOM 11207 2HG LYS Z 40 -2.659 64.939 -24.472 1.00 0.00 H
-ATOM 11208 1HD LYS Z 40 -4.124 66.085 -26.127 1.00 0.00 H
-ATOM 11209 2HD LYS Z 40 -3.867 64.755 -27.265 1.00 0.00 H
-ATOM 11210 1HE LYS Z 40 -4.920 63.190 -25.693 1.00 0.00 H
-ATOM 11211 2HE LYS Z 40 -5.103 64.490 -24.498 1.00 0.00 H
-ATOM 11212 1HZ LYS Z 40 -7.125 64.109 -25.708 1.00 0.00 H
-ATOM 11213 2HZ LYS Z 40 -6.548 65.622 -26.039 1.00 0.00 H
-ATOM 11214 3HZ LYS Z 40 -6.385 64.412 -27.153 1.00 0.00 H
-ATOM 11215 N GLY Z 41 0.245 63.248 -24.295 1.00 76.21 N
-ATOM 11216 CA GLY Z 41 0.628 61.850 -24.189 1.00 76.11 C
-ATOM 11217 C GLY Z 41 2.044 61.616 -23.663 1.00 74.33 C
-ATOM 11218 O GLY Z 41 2.378 60.497 -23.266 1.00 73.66 O
-ATOM 11219 H GLY Z 41 -0.105 63.720 -23.463 1.00 0.00 H
-ATOM 11220 1HA GLY Z 41 -0.089 61.330 -23.554 1.00 0.00 H
-ATOM 11221 2HA GLY Z 41 0.553 61.404 -25.178 1.00 0.00 H
-ATOM 11222 N GLU Z 42 2.894 62.636 -23.640 1.00 72.42 N
-ATOM 11223 CA GLU Z 42 4.231 62.363 -23.124 1.00 71.89 C
-ATOM 11224 C GLU Z 42 4.225 62.259 -21.609 1.00 70.88 C
-ATOM 11225 O GLU Z 42 3.509 62.989 -20.912 1.00 73.08 O
-ATOM 11226 CB GLU Z 42 5.269 63.405 -23.566 1.00 67.54 C
-ATOM 11227 CG GLU Z 42 5.627 63.380 -25.048 1.00 70.70 C
-ATOM 11228 CD GLU Z 42 6.808 64.292 -25.392 1.00 71.34 C
-ATOM 11229 OE1 GLU Z 42 7.065 65.223 -24.667 1.00 62.04 O
-ATOM 11230 OE2 GLU Z 42 7.473 64.028 -26.360 1.00 74.90 O
-ATOM 11231 H GLU Z 42 2.629 63.560 -23.980 1.00 0.00 H
-ATOM 11232 HA GLU Z 42 4.557 61.397 -23.516 1.00 0.00 H
-ATOM 11233 1HB GLU Z 42 4.899 64.395 -23.340 1.00 0.00 H
-ATOM 11234 2HB GLU Z 42 6.191 63.259 -23.004 1.00 0.00 H
-ATOM 11235 1HG GLU Z 42 5.880 62.357 -25.327 1.00 0.00 H
-ATOM 11236 2HG GLU Z 42 4.751 63.681 -25.624 1.00 0.00 H
-ATOM 11237 N VAL Z 43 5.050 61.347 -21.101 1.00 68.25 N
-ATOM 11238 CA VAL Z 43 5.211 61.193 -19.659 1.00 66.06 C
-ATOM 11239 C VAL Z 43 6.626 61.517 -19.229 1.00 64.93 C
-ATOM 11240 O VAL Z 43 7.596 60.999 -19.784 1.00 63.95 O
-ATOM 11241 CB VAL Z 43 4.828 59.766 -19.193 1.00 65.08 C
-ATOM 11242 CG1 VAL Z 43 5.113 59.612 -17.698 1.00 53.78 C
-ATOM 11243 CG2 VAL Z 43 3.332 59.534 -19.436 1.00 56.05 C
-ATOM 11244 H VAL Z 43 5.591 60.758 -21.736 1.00 0.00 H
-ATOM 11245 HA VAL Z 43 4.539 61.890 -19.165 1.00 0.00 H
-ATOM 11246 HB VAL Z 43 5.419 59.032 -19.741 1.00 0.00 H
-ATOM 11247 1HG1 VAL Z 43 4.842 58.611 -17.375 1.00 0.00 H
-ATOM 11248 2HG1 VAL Z 43 6.173 59.774 -17.512 1.00 0.00 H
-ATOM 11249 3HG1 VAL Z 43 4.528 60.347 -17.142 1.00 0.00 H
-ATOM 11250 1HG2 VAL Z 43 3.050 58.533 -19.107 1.00 0.00 H
-ATOM 11251 2HG2 VAL Z 43 2.768 60.266 -18.874 1.00 0.00 H
-ATOM 11252 3HG2 VAL Z 43 3.114 59.646 -20.495 1.00 0.00 H
-ATOM 11253 N LEU Z 44 6.737 62.403 -18.249 1.00 62.89 N
-ATOM 11254 CA LEU Z 44 8.025 62.807 -17.713 1.00 62.43 C
-ATOM 11255 C LEU Z 44 8.146 62.436 -16.251 1.00 63.36 C
-ATOM 11256 O LEU Z 44 7.323 62.836 -15.428 1.00 62.06 O
-ATOM 11257 CB LEU Z 44 8.208 64.318 -17.864 1.00 52.77 C
-ATOM 11258 CG LEU Z 44 9.495 64.913 -17.266 1.00 56.20 C
-ATOM 11259 CD1 LEU Z 44 10.717 64.374 -18.033 1.00 59.83 C
-ATOM 11260 CD2 LEU Z 44 9.407 66.437 -17.330 1.00 56.52 C
-ATOM 11261 H LEU Z 44 5.888 62.807 -17.859 1.00 0.00 H
-ATOM 11262 HA LEU Z 44 8.813 62.297 -18.261 1.00 0.00 H
-ATOM 11263 1HB LEU Z 44 8.220 64.533 -18.918 1.00 0.00 H
-ATOM 11264 2HB LEU Z 44 7.351 64.823 -17.413 1.00 0.00 H
-ATOM 11265 HG LEU Z 44 9.595 64.601 -16.223 1.00 0.00 H
-ATOM 11266 1HD1 LEU Z 44 11.625 64.785 -17.604 1.00 0.00 H
-ATOM 11267 2HD1 LEU Z 44 10.741 63.286 -17.956 1.00 0.00 H
-ATOM 11268 3HD1 LEU Z 44 10.647 64.663 -19.081 1.00 0.00 H
-ATOM 11269 1HD2 LEU Z 44 10.309 66.879 -16.904 1.00 0.00 H
-ATOM 11270 2HD2 LEU Z 44 9.302 66.753 -18.364 1.00 0.00 H
-ATOM 11271 3HD2 LEU Z 44 8.540 66.770 -16.766 1.00 0.00 H
-ATOM 11272 N ILE Z 45 9.164 61.662 -15.925 1.00 61.33 N
-ATOM 11273 CA ILE Z 45 9.380 61.277 -14.548 1.00 57.32 C
-ATOM 11274 C ILE Z 45 10.654 61.972 -14.089 1.00 54.26 C
-ATOM 11275 O ILE Z 45 11.712 61.774 -14.683 1.00 52.20 O
-ATOM 11276 CB ILE Z 45 9.494 59.757 -14.429 1.00 60.79 C
-ATOM 11277 CG1 ILE Z 45 8.217 59.128 -15.013 1.00 50.37 C
-ATOM 11278 CG2 ILE Z 45 9.601 59.418 -12.961 1.00 53.36 C
-ATOM 11279 CD1 ILE Z 45 8.241 57.650 -15.166 1.00 60.66 C
-ATOM 11280 H ILE Z 45 9.797 61.330 -16.644 1.00 0.00 H
-ATOM 11281 HA ILE Z 45 8.553 61.618 -13.938 1.00 0.00 H
-ATOM 11282 HB ILE Z 45 10.360 59.390 -14.981 1.00 0.00 H
-ATOM 11283 1HG1 ILE Z 45 7.405 59.390 -14.379 1.00 0.00 H
-ATOM 11284 2HG1 ILE Z 45 8.035 59.557 -15.995 1.00 0.00 H
-ATOM 11285 1HG2 ILE Z 45 9.665 58.340 -12.821 1.00 0.00 H
-ATOM 11286 2HG2 ILE Z 45 10.477 59.896 -12.538 1.00 0.00 H
-ATOM 11287 3HG2 ILE Z 45 8.726 59.800 -12.464 1.00 0.00 H
-ATOM 11288 1HD1 ILE Z 45 7.288 57.328 -15.576 1.00 0.00 H
-ATOM 11289 2HD1 ILE Z 45 9.049 57.358 -15.841 1.00 0.00 H
-ATOM 11290 3HD1 ILE Z 45 8.393 57.196 -14.201 1.00 0.00 H
-ATOM 11291 N ALA Z 46 10.569 62.819 -13.066 1.00 54.12 N
-ATOM 11292 CA ALA Z 46 11.761 63.609 -12.750 1.00 55.26 C
-ATOM 11293 C ALA Z 46 12.009 63.805 -11.271 1.00 58.80 C
-ATOM 11294 O ALA Z 46 11.090 64.037 -10.484 1.00 61.18 O
-ATOM 11295 CB ALA Z 46 11.630 64.977 -13.408 1.00 53.18 C
-ATOM 11296 H ALA Z 46 9.691 62.929 -12.565 1.00 0.00 H
-ATOM 11297 HA ALA Z 46 12.626 63.093 -13.153 1.00 0.00 H
-ATOM 11298 1HB ALA Z 46 12.534 65.559 -13.212 1.00 0.00 H
-ATOM 11299 2HB ALA Z 46 11.502 64.855 -14.483 1.00 0.00 H
-ATOM 11300 3HB ALA Z 46 10.768 65.498 -12.997 1.00 0.00 H
-ATOM 11301 N GLN Z 47 13.294 63.730 -10.915 1.00 60.48 N
-ATOM 11302 CA GLN Z 47 13.772 63.901 -9.551 1.00 62.46 C
-ATOM 11303 C GLN Z 47 14.079 65.328 -9.166 1.00 63.55 C
-ATOM 11304 O GLN Z 47 14.418 66.164 -10.006 1.00 64.47 O
-ATOM 11305 CB GLN Z 47 15.050 63.091 -9.308 1.00 63.28 C
-ATOM 11306 CG GLN Z 47 14.899 61.605 -9.337 1.00 57.46 C
-ATOM 11307 CD GLN Z 47 16.200 60.927 -9.046 1.00 57.13 C
-ATOM 11308 OE1 GLN Z 47 17.179 61.089 -9.783 1.00 59.48 O
-ATOM 11309 NE2 GLN Z 47 16.240 60.175 -7.951 1.00 58.97 N
-ATOM 11310 H GLN Z 47 13.991 63.525 -11.631 1.00 0.00 H
-ATOM 11311 HA GLN Z 47 13.008 63.540 -8.878 1.00 0.00 H
-ATOM 11312 1HB GLN Z 47 15.788 63.359 -10.063 1.00 0.00 H
-ATOM 11313 2HB GLN Z 47 15.467 63.363 -8.334 1.00 0.00 H
-ATOM 11314 1HG GLN Z 47 14.204 61.311 -8.558 1.00 0.00 H
-ATOM 11315 2HG GLN Z 47 14.542 61.289 -10.319 1.00 0.00 H
-ATOM 11316 1HE2 GLN Z 47 17.080 59.698 -7.703 1.00 0.00 H
-ATOM 11317 2HE2 GLN Z 47 15.417 60.112 -7.353 1.00 0.00 H
-ATOM 11318 N PHE Z 48 14.051 65.565 -7.862 1.00 62.01 N
-ATOM 11319 CA PHE Z 48 14.557 66.808 -7.301 1.00 62.86 C
-ATOM 11320 C PHE Z 48 16.060 66.596 -7.179 1.00 64.44 C
-ATOM 11321 O PHE Z 48 16.508 65.477 -6.925 1.00 66.84 O
-ATOM 11322 CB PHE Z 48 13.914 67.102 -5.962 1.00 59.63 C
-ATOM 11323 CG PHE Z 48 12.468 67.431 -6.084 1.00 61.39 C
-ATOM 11324 CD1 PHE Z 48 12.053 68.716 -6.366 1.00 60.19 C
-ATOM 11325 CD2 PHE Z 48 11.510 66.440 -5.922 1.00 60.45 C
-ATOM 11326 CE1 PHE Z 48 10.714 68.993 -6.489 1.00 59.31 C
-ATOM 11327 CE2 PHE Z 48 10.176 66.721 -6.047 1.00 62.15 C
-ATOM 11328 CZ PHE Z 48 9.786 68.001 -6.336 1.00 64.66 C
-ATOM 11329 H PHE Z 48 13.686 64.836 -7.250 1.00 0.00 H
-ATOM 11330 HA PHE Z 48 14.367 67.636 -7.988 1.00 0.00 H
-ATOM 11331 1HB PHE Z 48 14.021 66.241 -5.307 1.00 0.00 H
-ATOM 11332 2HB PHE Z 48 14.422 67.948 -5.500 1.00 0.00 H
-ATOM 11333 HD1 PHE Z 48 12.797 69.505 -6.497 1.00 0.00 H
-ATOM 11334 HD2 PHE Z 48 11.833 65.430 -5.699 1.00 0.00 H
-ATOM 11335 HE1 PHE Z 48 10.387 69.987 -6.718 1.00 0.00 H
-ATOM 11336 HE2 PHE Z 48 9.433 65.932 -5.926 1.00 0.00 H
-ATOM 11337 HZ PHE Z 48 8.752 68.228 -6.453 1.00 0.00 H
-ATOM 11338 N THR Z 49 16.841 67.632 -7.461 1.00 63.27 N
-ATOM 11339 CA THR Z 49 18.293 67.473 -7.535 1.00 63.46 C
-ATOM 11340 C THR Z 49 19.080 68.525 -6.784 1.00 64.26 C
-ATOM 11341 O THR Z 49 18.532 69.416 -6.146 1.00 65.74 O
-ATOM 11342 CB THR Z 49 18.792 67.509 -8.993 1.00 58.02 C
-ATOM 11343 OG1 THR Z 49 18.663 68.844 -9.518 1.00 59.86 O
-ATOM 11344 CG2 THR Z 49 17.980 66.548 -9.868 1.00 49.01 C
-ATOM 11345 H THR Z 49 16.415 68.543 -7.601 1.00 0.00 H
-ATOM 11346 HA THR Z 49 18.552 66.506 -7.107 1.00 0.00 H
-ATOM 11347 HB THR Z 49 19.837 67.214 -9.027 1.00 0.00 H
-ATOM 11348 HG1 THR Z 49 17.762 68.950 -9.849 1.00 0.00 H
-ATOM 11349 1HG2 THR Z 49 18.352 66.590 -10.888 1.00 0.00 H
-ATOM 11350 2HG2 THR Z 49 18.069 65.533 -9.488 1.00 0.00 H
-ATOM 11351 3HG2 THR Z 49 16.934 66.841 -9.859 1.00 0.00 H
-ATOM 11352 N GLU Z 50 20.395 68.434 -6.933 1.00 64.19 N
-ATOM 11353 CA GLU Z 50 21.335 69.412 -6.408 1.00 66.78 C
-ATOM 11354 C GLU Z 50 21.031 70.811 -6.947 1.00 69.06 C
-ATOM 11355 O GLU Z 50 21.391 71.807 -6.313 1.00 70.94 O
-ATOM 11356 CB GLU Z 50 22.771 69.006 -6.768 1.00 59.96 C
-ATOM 11357 CG GLU Z 50 23.848 69.928 -6.221 1.00 64.48 C
-ATOM 11358 CD GLU Z 50 25.253 69.426 -6.497 1.00 74.07 C
-ATOM 11359 OE1 GLU Z 50 25.385 68.360 -7.051 1.00 78.04 O
-ATOM 11360 OE2 GLU Z 50 26.188 70.113 -6.155 1.00 72.69 O
-ATOM 11361 H GLU Z 50 20.766 67.660 -7.456 1.00 0.00 H
-ATOM 11362 HA GLU Z 50 21.240 69.436 -5.325 1.00 0.00 H
-ATOM 11363 1HB GLU Z 50 22.971 68.006 -6.383 1.00 0.00 H
-ATOM 11364 2HB GLU Z 50 22.882 68.972 -7.852 1.00 0.00 H
-ATOM 11365 1HG GLU Z 50 23.726 70.912 -6.680 1.00 0.00 H
-ATOM 11366 2HG GLU Z 50 23.708 70.033 -5.148 1.00 0.00 H
-ATOM 11367 N HIS Z 51 20.434 70.901 -8.143 1.00 67.96 N
-ATOM 11368 CA HIS Z 51 20.151 72.195 -8.736 1.00 70.59 C
-ATOM 11369 C HIS Z 51 18.656 72.542 -8.750 1.00 71.12 C
-ATOM 11370 O HIS Z 51 18.318 73.720 -8.818 1.00 72.23 O
-ATOM 11371 CB HIS Z 51 20.724 72.262 -10.157 1.00 65.65 C
-ATOM 11372 CG HIS Z 51 22.229 72.156 -10.195 1.00 70.66 C
-ATOM 11373 ND1 HIS Z 51 22.893 70.951 -10.147 1.00 70.08 N
-ATOM 11374 CD2 HIS Z 51 23.190 73.109 -10.273 1.00 69.19 C
-ATOM 11375 CE1 HIS Z 51 24.198 71.164 -10.185 1.00 64.58 C
-ATOM 11376 NE2 HIS Z 51 24.404 72.464 -10.268 1.00 64.06 N
-ATOM 11377 H HIS Z 51 20.122 70.064 -8.630 1.00 0.00 H
-ATOM 11378 HA HIS Z 51 20.651 72.967 -8.150 1.00 0.00 H
-ATOM 11379 1HB HIS Z 51 20.306 71.452 -10.758 1.00 0.00 H
-ATOM 11380 2HB HIS Z 51 20.428 73.202 -10.624 1.00 0.00 H
-ATOM 11381 HD2 HIS Z 51 23.032 74.186 -10.329 1.00 0.00 H
-ATOM 11382 HE1 HIS Z 51 24.971 70.394 -10.155 1.00 0.00 H
-ATOM 11383 HE2 HIS Z 51 25.308 72.918 -10.312 1.00 0.00 H
-ATOM 11384 N THR Z 52 17.765 71.536 -8.644 1.00 71.24 N
-ATOM 11385 CA THR Z 52 16.307 71.797 -8.654 1.00 71.62 C
-ATOM 11386 C THR Z 52 15.653 71.486 -7.303 1.00 71.79 C
-ATOM 11387 O THR Z 52 15.657 70.336 -6.854 1.00 71.58 O
-ATOM 11388 CB THR Z 52 15.568 70.936 -9.708 1.00 69.97 C
-ATOM 11389 OG1 THR Z 52 16.073 71.213 -11.021 1.00 71.73 O
-ATOM 11390 CG2 THR Z 52 14.044 71.225 -9.671 1.00 74.60 C
-ATOM 11391 H THR Z 52 18.107 70.585 -8.606 1.00 0.00 H
-ATOM 11392 HA THR Z 52 16.143 72.849 -8.876 1.00 0.00 H
-ATOM 11393 HB THR Z 52 15.728 69.881 -9.488 1.00 0.00 H
-ATOM 11394 HG1 THR Z 52 16.959 70.853 -11.106 1.00 0.00 H
-ATOM 11395 1HG2 THR Z 52 13.534 70.609 -10.412 1.00 0.00 H
-ATOM 11396 2HG2 THR Z 52 13.643 70.997 -8.682 1.00 0.00 H
-ATOM 11397 3HG2 THR Z 52 13.866 72.276 -9.894 1.00 0.00 H
-ATOM 11398 N SER Z 53 15.033 72.500 -6.686 1.00 71.18 N
-ATOM 11399 CA SER Z 53 14.373 72.313 -5.389 1.00 70.03 C
-ATOM 11400 C SER Z 53 12.858 72.350 -5.501 1.00 67.83 C
-ATOM 11401 O SER Z 53 12.141 71.945 -4.580 1.00 66.45 O
-ATOM 11402 CB SER Z 53 14.817 73.348 -4.389 1.00 75.16 C
-ATOM 11403 OG SER Z 53 14.484 74.635 -4.803 1.00 69.69 O
-ATOM 11404 H SER Z 53 15.034 73.416 -7.135 1.00 0.00 H
-ATOM 11405 HA SER Z 53 14.652 71.331 -5.000 1.00 0.00 H
-ATOM 11406 1HB SER Z 53 14.328 73.142 -3.444 1.00 0.00 H
-ATOM 11407 2HB SER Z 53 15.880 73.271 -4.227 1.00 0.00 H
-ATOM 11408 HG SER Z 53 13.612 74.568 -5.205 1.00 0.00 H
-ATOM 11409 N ALA Z 54 12.365 72.832 -6.637 1.00 66.15 N
-ATOM 11410 CA ALA Z 54 10.921 72.870 -6.821 1.00 63.92 C
-ATOM 11411 C ALA Z 54 10.567 72.654 -8.287 1.00 62.95 C
-ATOM 11412 O ALA Z 54 11.308 73.036 -9.193 1.00 61.66 O
-ATOM 11413 CB ALA Z 54 10.338 74.178 -6.302 1.00 62.74 C
-ATOM 11414 H ALA Z 54 12.994 73.186 -7.354 1.00 0.00 H
-ATOM 11415 HA ALA Z 54 10.486 72.063 -6.250 1.00 0.00 H
-ATOM 11416 1HB ALA Z 54 9.257 74.154 -6.429 1.00 0.00 H
-ATOM 11417 2HB ALA Z 54 10.579 74.282 -5.247 1.00 0.00 H
-ATOM 11418 3HB ALA Z 54 10.735 75.009 -6.827 1.00 0.00 H
-ATOM 11419 N ILE Z 55 9.401 72.045 -8.495 1.00 63.55 N
-ATOM 11420 CA ILE Z 55 8.863 71.796 -9.825 1.00 65.81 C
-ATOM 11421 C ILE Z 55 7.519 72.479 -10.015 1.00 67.72 C
-ATOM 11422 O ILE Z 55 6.589 72.296 -9.229 1.00 69.31 O
-ATOM 11423 CB ILE Z 55 8.730 70.282 -10.102 1.00 68.85 C
-ATOM 11424 CG1 ILE Z 55 10.127 69.610 -10.050 1.00 70.90 C
-ATOM 11425 CG2 ILE Z 55 8.062 70.060 -11.443 1.00 65.89 C
-ATOM 11426 CD1 ILE Z 55 10.092 68.089 -10.072 1.00 60.82 C
-ATOM 11427 H ILE Z 55 8.856 71.766 -7.686 1.00 0.00 H
-ATOM 11428 HA ILE Z 55 9.554 72.208 -10.555 1.00 0.00 H
-ATOM 11429 HB ILE Z 55 8.120 69.827 -9.324 1.00 0.00 H
-ATOM 11430 1HG1 ILE Z 55 10.714 69.955 -10.903 1.00 0.00 H
-ATOM 11431 2HG1 ILE Z 55 10.630 69.921 -9.147 1.00 0.00 H
-ATOM 11432 1HG2 ILE Z 55 7.962 68.994 -11.627 1.00 0.00 H
-ATOM 11433 2HG2 ILE Z 55 7.075 70.521 -11.445 1.00 0.00 H
-ATOM 11434 3HG2 ILE Z 55 8.676 70.514 -12.221 1.00 0.00 H
-ATOM 11435 1HD1 ILE Z 55 11.113 67.697 -10.026 1.00 0.00 H
-ATOM 11436 2HD1 ILE Z 55 9.528 67.724 -9.215 1.00 0.00 H
-ATOM 11437 3HD1 ILE Z 55 9.617 67.747 -10.987 1.00 0.00 H
-ATOM 11438 N LYS Z 56 7.417 73.279 -11.054 1.00 68.87 N
-ATOM 11439 CA LYS Z 56 6.185 73.992 -11.346 1.00 70.08 C
-ATOM 11440 C LYS Z 56 5.551 73.432 -12.608 1.00 70.21 C
-ATOM 11441 O LYS Z 56 6.243 73.219 -13.604 1.00 69.86 O
-ATOM 11442 CB LYS Z 56 6.480 75.480 -11.429 1.00 71.50 C
-ATOM 11443 CG LYS Z 56 5.328 76.379 -11.705 1.00 69.77 C
-ATOM 11444 CD LYS Z 56 5.808 77.819 -11.619 1.00 73.45 C
-ATOM 11445 CE LYS Z 56 4.717 78.813 -11.931 1.00 75.23 C
-ATOM 11446 NZ LYS Z 56 5.188 80.217 -11.736 1.00 58.03 N
-ATOM 11447 H LYS Z 56 8.231 73.403 -11.660 1.00 0.00 H
-ATOM 11448 HA LYS Z 56 5.484 73.833 -10.529 1.00 0.00 H
-ATOM 11449 1HB LYS Z 56 6.911 75.806 -10.486 1.00 0.00 H
-ATOM 11450 2HB LYS Z 56 7.217 75.654 -12.182 1.00 0.00 H
-ATOM 11451 1HG LYS Z 56 4.929 76.181 -12.706 1.00 0.00 H
-ATOM 11452 2HG LYS Z 56 4.537 76.203 -10.970 1.00 0.00 H
-ATOM 11453 1HD LYS Z 56 6.179 78.017 -10.605 1.00 0.00 H
-ATOM 11454 2HD LYS Z 56 6.629 77.969 -12.321 1.00 0.00 H
-ATOM 11455 1HE LYS Z 56 4.400 78.690 -12.969 1.00 0.00 H
-ATOM 11456 2HE LYS Z 56 3.871 78.628 -11.288 1.00 0.00 H
-ATOM 11457 1HZ LYS Z 56 4.430 80.853 -11.956 1.00 0.00 H
-ATOM 11458 2HZ LYS Z 56 5.493 80.368 -10.767 1.00 0.00 H
-ATOM 11459 3HZ LYS Z 56 5.968 80.403 -12.340 1.00 0.00 H
-ATOM 11460 N VAL Z 57 4.263 73.129 -12.569 1.00 70.72 N
-ATOM 11461 CA VAL Z 57 3.619 72.541 -13.730 1.00 73.56 C
-ATOM 11462 C VAL Z 57 2.505 73.429 -14.281 1.00 75.86 C
-ATOM 11463 O VAL Z 57 1.594 73.853 -13.551 1.00 77.09 O
-ATOM 11464 CB VAL Z 57 3.060 71.143 -13.389 1.00 67.69 C
-ATOM 11465 CG1 VAL Z 57 2.423 70.509 -14.648 1.00 67.16 C
-ATOM 11466 CG2 VAL Z 57 4.175 70.287 -12.820 1.00 69.87 C
-ATOM 11467 H VAL Z 57 3.730 73.297 -11.719 1.00 0.00 H
-ATOM 11468 HA VAL Z 57 4.369 72.418 -14.514 1.00 0.00 H
-ATOM 11469 HB VAL Z 57 2.270 71.244 -12.648 1.00 0.00 H
-ATOM 11470 1HG1 VAL Z 57 2.019 69.530 -14.402 1.00 0.00 H
-ATOM 11471 2HG1 VAL Z 57 1.617 71.144 -15.022 1.00 0.00 H
-ATOM 11472 3HG1 VAL Z 57 3.185 70.400 -15.422 1.00 0.00 H
-ATOM 11473 1HG2 VAL Z 57 3.787 69.305 -12.565 1.00 0.00 H
-ATOM 11474 2HG2 VAL Z 57 4.959 70.197 -13.563 1.00 0.00 H
-ATOM 11475 3HG2 VAL Z 57 4.574 70.760 -11.922 1.00 0.00 H
-ATOM 11476 N ARG Z 58 2.599 73.705 -15.581 1.00 76.96 N
-ATOM 11477 CA ARG Z 58 1.649 74.512 -16.341 1.00 76.26 C
-ATOM 11478 C ARG Z 58 0.941 73.693 -17.413 1.00 75.09 C
-ATOM 11479 O ARG Z 58 1.548 72.841 -18.059 1.00 74.07 O
-ATOM 11480 CB ARG Z 58 2.366 75.654 -17.033 1.00 81.28 C
-ATOM 11481 CG ARG Z 58 2.853 76.758 -16.157 1.00 93.23 C
-ATOM 11482 CD ARG Z 58 3.639 77.743 -16.938 1.00 98.64 C
-ATOM 11483 NE ARG Z 58 3.912 78.938 -16.185 1.00100.26 N
-ATOM 11484 CZ ARG Z 58 4.856 79.845 -16.511 1.00 98.15 C
-ATOM 11485 NH1 ARG Z 58 5.638 79.637 -17.550 1.00 95.68 N
-ATOM 11486 NH2 ARG Z 58 4.994 80.944 -15.789 1.00 96.59 N
-ATOM 11487 H ARG Z 58 3.404 73.332 -16.083 1.00 0.00 H
-ATOM 11488 HA ARG Z 58 0.902 74.914 -15.653 1.00 0.00 H
-ATOM 11489 1HB ARG Z 58 3.230 75.259 -17.550 1.00 0.00 H
-ATOM 11490 2HB ARG Z 58 1.710 76.095 -17.784 1.00 0.00 H
-ATOM 11491 1HG ARG Z 58 2.001 77.267 -15.716 1.00 0.00 H
-ATOM 11492 2HG ARG Z 58 3.487 76.353 -15.365 1.00 0.00 H
-ATOM 11493 1HD ARG Z 58 4.588 77.304 -17.226 1.00 0.00 H
-ATOM 11494 2HD ARG Z 58 3.086 78.024 -17.831 1.00 0.00 H
-ATOM 11495 HE ARG Z 58 3.306 79.123 -15.375 1.00 0.00 H
-ATOM 11496 1HH1 ARG Z 58 5.533 78.797 -18.103 1.00 0.00 H
-ATOM 11497 2HH1 ARG Z 58 6.343 80.316 -17.796 1.00 0.00 H
-ATOM 11498 1HH2 ARG Z 58 4.374 81.116 -15.011 1.00 0.00 H
-ATOM 11499 2HH2 ARG Z 58 5.698 81.625 -16.039 1.00 0.00 H
-ATOM 11500 N GLY Z 59 -0.328 74.001 -17.661 1.00 73.43 N
-ATOM 11501 CA GLY Z 59 -1.076 73.286 -18.693 1.00 72.89 C
-ATOM 11502 C GLY Z 59 -1.813 72.126 -18.054 1.00 74.21 C
-ATOM 11503 O GLY Z 59 -1.577 71.807 -16.889 1.00 73.76 O
-ATOM 11504 H GLY Z 59 -0.792 74.714 -17.110 1.00 0.00 H
-ATOM 11505 1HA GLY Z 59 -1.783 73.954 -19.183 1.00 0.00 H
-ATOM 11506 2HA GLY Z 59 -0.397 72.918 -19.461 1.00 0.00 H
-ATOM 11507 N LYS Z 60 -2.717 71.507 -18.798 1.00 75.05 N
-ATOM 11508 CA LYS Z 60 -3.494 70.424 -18.214 1.00 76.54 C
-ATOM 11509 C LYS Z 60 -2.640 69.169 -18.137 1.00 77.40 C
-ATOM 11510 O LYS Z 60 -2.153 68.681 -19.162 1.00 77.62 O
-ATOM 11511 CB LYS Z 60 -4.750 70.165 -19.040 1.00 81.46 C
-ATOM 11512 CG LYS Z 60 -5.725 69.204 -18.420 1.00 87.11 C
-ATOM 11513 CD LYS Z 60 -6.931 68.990 -19.330 1.00 89.33 C
-ATOM 11514 CE LYS Z 60 -7.898 67.966 -18.760 1.00 91.19 C
-ATOM 11515 NZ LYS Z 60 -9.097 67.800 -19.634 1.00 93.69 N
-ATOM 11516 H LYS Z 60 -2.884 71.801 -19.759 1.00 0.00 H
-ATOM 11517 HA LYS Z 60 -3.780 70.705 -17.215 1.00 0.00 H
-ATOM 11518 1HB LYS Z 60 -5.258 71.108 -19.244 1.00 0.00 H
-ATOM 11519 2HB LYS Z 60 -4.464 69.736 -19.993 1.00 0.00 H
-ATOM 11520 1HG LYS Z 60 -5.240 68.275 -18.223 1.00 0.00 H
-ATOM 11521 2HG LYS Z 60 -6.067 69.619 -17.468 1.00 0.00 H
-ATOM 11522 1HD LYS Z 60 -7.455 69.935 -19.477 1.00 0.00 H
-ATOM 11523 2HD LYS Z 60 -6.579 68.635 -20.301 1.00 0.00 H
-ATOM 11524 1HE LYS Z 60 -7.386 67.006 -18.678 1.00 0.00 H
-ATOM 11525 2HE LYS Z 60 -8.218 68.283 -17.765 1.00 0.00 H
-ATOM 11526 1HZ LYS Z 60 -9.719 67.109 -19.235 1.00 0.00 H
-ATOM 11527 2HZ LYS Z 60 -9.582 68.686 -19.710 1.00 0.00 H
-ATOM 11528 3HZ LYS Z 60 -8.801 67.497 -20.555 1.00 0.00 H
-ATOM 11529 N ALA Z 61 -2.470 68.641 -16.931 1.00 76.36 N
-ATOM 11530 CA ALA Z 61 -1.600 67.480 -16.769 1.00 76.10 C
-ATOM 11531 C ALA Z 61 -1.974 66.634 -15.561 1.00 75.42 C
-ATOM 11532 O ALA Z 61 -2.537 67.134 -14.584 1.00 74.97 O
-ATOM 11533 CB ALA Z 61 -0.157 67.926 -16.653 1.00 67.03 C
-ATOM 11534 H ALA Z 61 -2.933 69.081 -16.135 1.00 0.00 H
-ATOM 11535 HA ALA Z 61 -1.694 66.868 -17.657 1.00 0.00 H
-ATOM 11536 1HB ALA Z 61 0.487 67.053 -16.582 1.00 0.00 H
-ATOM 11537 2HB ALA Z 61 0.093 68.498 -17.532 1.00 0.00 H
-ATOM 11538 3HB ALA Z 61 -0.031 68.541 -15.773 1.00 0.00 H
-ATOM 11539 N TYR Z 62 -1.627 65.353 -15.616 1.00 73.66 N
-ATOM 11540 CA TYR Z 62 -1.864 64.468 -14.479 1.00 72.97 C
-ATOM 11541 C TYR Z 62 -0.541 64.267 -13.751 1.00 71.22 C
-ATOM 11542 O TYR Z 62 0.446 63.870 -14.367 1.00 70.70 O
-ATOM 11543 CB TYR Z 62 -2.427 63.124 -14.945 1.00 76.90 C
-ATOM 11544 CG TYR Z 62 -2.905 62.224 -13.828 1.00 83.10 C
-ATOM 11545 CD1 TYR Z 62 -4.236 62.301 -13.460 1.00 86.94 C
-ATOM 11546 CD2 TYR Z 62 -2.057 61.337 -13.173 1.00 84.63 C
-ATOM 11547 CE1 TYR Z 62 -4.734 61.509 -12.458 1.00 89.00 C
-ATOM 11548 CE2 TYR Z 62 -2.568 60.533 -12.158 1.00 87.65 C
-ATOM 11549 CZ TYR Z 62 -3.904 60.623 -11.809 1.00 89.96 C
-ATOM 11550 OH TYR Z 62 -4.425 59.827 -10.817 1.00 90.49 O
-ATOM 11551 H TYR Z 62 -1.170 65.005 -16.456 1.00 0.00 H
-ATOM 11552 HA TYR Z 62 -2.561 64.938 -13.788 1.00 0.00 H
-ATOM 11553 1HB TYR Z 62 -3.256 63.288 -15.618 1.00 0.00 H
-ATOM 11554 2HB TYR Z 62 -1.669 62.589 -15.497 1.00 0.00 H
-ATOM 11555 HD1 TYR Z 62 -4.900 62.994 -13.976 1.00 0.00 H
-ATOM 11556 HD2 TYR Z 62 -1.005 61.269 -13.454 1.00 0.00 H
-ATOM 11557 HE1 TYR Z 62 -5.788 61.580 -12.187 1.00 0.00 H
-ATOM 11558 HE2 TYR Z 62 -1.928 59.833 -11.642 1.00 0.00 H
-ATOM 11559 HH TYR Z 62 -3.746 59.234 -10.493 1.00 0.00 H
-ATOM 11560 N ILE Z 63 -0.510 64.561 -12.451 1.00 69.10 N
-ATOM 11561 CA ILE Z 63 0.736 64.441 -11.703 1.00 67.65 C
-ATOM 11562 C ILE Z 63 0.641 63.446 -10.536 1.00 67.67 C
-ATOM 11563 O ILE Z 63 -0.254 63.522 -9.695 1.00 68.74 O
-ATOM 11564 CB ILE Z 63 1.178 65.808 -11.137 1.00 63.66 C
-ATOM 11565 CG1 ILE Z 63 1.307 66.843 -12.262 1.00 68.13 C
-ATOM 11566 CG2 ILE Z 63 2.518 65.642 -10.418 1.00 59.76 C
-ATOM 11567 CD1 ILE Z 63 0.065 67.707 -12.440 1.00 66.79 C
-ATOM 11568 H ILE Z 63 -1.339 64.897 -11.974 1.00 0.00 H
-ATOM 11569 HA ILE Z 63 1.498 64.105 -12.378 1.00 0.00 H
-ATOM 11570 HB ILE Z 63 0.437 66.167 -10.455 1.00 0.00 H
-ATOM 11571 1HG1 ILE Z 63 2.148 67.497 -12.047 1.00 0.00 H
-ATOM 11572 2HG1 ILE Z 63 1.497 66.324 -13.192 1.00 0.00 H
-ATOM 11573 1HG2 ILE Z 63 2.830 66.589 -10.014 1.00 0.00 H
-ATOM 11574 2HG2 ILE Z 63 2.406 64.928 -9.614 1.00 0.00 H
-ATOM 11575 3HG2 ILE Z 63 3.268 65.277 -11.114 1.00 0.00 H
-ATOM 11576 1HD1 ILE Z 63 0.221 68.411 -13.255 1.00 0.00 H
-ATOM 11577 2HD1 ILE Z 63 -0.790 67.075 -12.676 1.00 0.00 H
-ATOM 11578 3HD1 ILE Z 63 -0.141 68.257 -11.525 1.00 0.00 H
-ATOM 11579 N GLN Z 64 1.587 62.500 -10.487 1.00 66.33 N
-ATOM 11580 CA GLN Z 64 1.630 61.559 -9.370 1.00 61.89 C
-ATOM 11581 C GLN Z 64 2.812 61.935 -8.491 1.00 61.02 C
-ATOM 11582 O GLN Z 64 3.923 62.142 -8.993 1.00 60.35 O
-ATOM 11583 CB GLN Z 64 1.838 60.114 -9.840 1.00 46.59 C
-ATOM 11584 CG GLN Z 64 0.814 59.595 -10.817 1.00 47.85 C
-ATOM 11585 CD GLN Z 64 1.128 58.198 -11.348 1.00 44.64 C
-ATOM 11586 OE1 GLN Z 64 2.286 57.772 -11.398 1.00 51.63 O
-ATOM 11587 NE2 GLN Z 64 0.071 57.495 -11.753 1.00 45.21 N
-ATOM 11588 H GLN Z 64 2.280 62.462 -11.225 1.00 0.00 H
-ATOM 11589 HA GLN Z 64 0.721 61.641 -8.780 1.00 0.00 H
-ATOM 11590 1HB GLN Z 64 2.821 59.983 -10.217 1.00 0.00 H
-ATOM 11591 2HB GLN Z 64 1.764 59.468 -8.966 1.00 0.00 H
-ATOM 11592 1HG GLN Z 64 -0.142 59.546 -10.321 1.00 0.00 H
-ATOM 11593 2HG GLN Z 64 0.763 60.275 -11.667 1.00 0.00 H
-ATOM 11594 1HE2 GLN Z 64 0.158 56.560 -12.138 1.00 0.00 H
-ATOM 11595 2HE2 GLN Z 64 -0.840 57.884 -11.686 1.00 0.00 H
-ATOM 11596 N THR Z 65 2.587 62.030 -7.186 1.00 60.63 N
-ATOM 11597 CA THR Z 65 3.664 62.356 -6.262 1.00 60.60 C
-ATOM 11598 C THR Z 65 3.618 61.429 -5.057 1.00 61.44 C
-ATOM 11599 O THR Z 65 2.698 60.629 -4.882 1.00 62.09 O
-ATOM 11600 CB THR Z 65 3.594 63.800 -5.713 1.00 64.94 C
-ATOM 11601 OG1 THR Z 65 2.521 63.898 -4.768 1.00 60.39 O
-ATOM 11602 CG2 THR Z 65 3.359 64.811 -6.833 1.00 63.16 C
-ATOM 11603 H THR Z 65 1.653 61.872 -6.812 1.00 0.00 H
-ATOM 11604 HA THR Z 65 4.620 62.214 -6.766 1.00 0.00 H
-ATOM 11605 HB THR Z 65 4.521 64.033 -5.224 1.00 0.00 H
-ATOM 11606 HG1 THR Z 65 2.442 63.063 -4.292 1.00 0.00 H
-ATOM 11607 1HG2 THR Z 65 3.320 65.812 -6.416 1.00 0.00 H
-ATOM 11608 2HG2 THR Z 65 4.170 64.755 -7.557 1.00 0.00 H
-ATOM 11609 3HG2 THR Z 65 2.418 64.592 -7.325 1.00 0.00 H
-ATOM 11610 N ARG Z 66 4.581 61.605 -4.176 1.00 61.47 N
-ATOM 11611 CA ARG Z 66 4.653 60.888 -2.911 1.00 63.65 C
-ATOM 11612 C ARG Z 66 3.440 61.109 -2.008 1.00 64.80 C
-ATOM 11613 O ARG Z 66 3.223 60.328 -1.079 1.00 63.09 O
-ATOM 11614 CB ARG Z 66 5.953 61.249 -2.202 1.00 68.23 C
-ATOM 11615 CG ARG Z 66 6.208 60.657 -0.833 1.00 69.69 C
-ATOM 11616 CD ARG Z 66 7.670 60.809 -0.514 1.00 68.94 C
-ATOM 11617 NE ARG Z 66 8.041 60.454 0.845 1.00 74.84 N
-ATOM 11618 CZ ARG Z 66 8.282 61.379 1.795 1.00 77.09 C
-ATOM 11619 NH1 ARG Z 66 8.640 61.066 3.016 1.00 75.97 N
-ATOM 11620 NH2 ARG Z 66 8.195 62.646 1.499 1.00 71.10 N
-ATOM 11621 H ARG Z 66 5.308 62.271 -4.395 1.00 0.00 H
-ATOM 11622 HA ARG Z 66 4.698 59.824 -3.143 1.00 0.00 H
-ATOM 11623 1HB ARG Z 66 6.801 60.983 -2.832 1.00 0.00 H
-ATOM 11624 2HB ARG Z 66 5.976 62.314 -2.048 1.00 0.00 H
-ATOM 11625 1HG ARG Z 66 5.624 61.210 -0.094 1.00 0.00 H
-ATOM 11626 2HG ARG Z 66 5.932 59.598 -0.811 1.00 0.00 H
-ATOM 11627 1HD ARG Z 66 8.254 60.195 -1.190 1.00 0.00 H
-ATOM 11628 2HD ARG Z 66 7.948 61.858 -0.666 1.00 0.00 H
-ATOM 11629 HE ARG Z 66 8.128 59.475 1.083 1.00 0.00 H
-ATOM 11630 1HH1 ARG Z 66 8.743 60.105 3.303 1.00 0.00 H
-ATOM 11631 2HH1 ARG Z 66 8.851 61.855 3.651 1.00 0.00 H
-ATOM 11632 1HH2 ARG Z 66 7.954 62.943 0.563 1.00 0.00 H
-ATOM 11633 2HH2 ARG Z 66 8.429 63.328 2.224 1.00 0.00 H
-ATOM 11634 N HIS Z 67 2.665 62.178 -2.234 1.00 64.54 N
-ATOM 11635 CA HIS Z 67 1.538 62.448 -1.351 1.00 66.67 C
-ATOM 11636 C HIS Z 67 0.193 62.100 -1.985 1.00 67.38 C
-ATOM 11637 O HIS Z 67 -0.856 62.498 -1.476 1.00 68.17 O
-ATOM 11638 CB HIS Z 67 1.521 63.918 -0.950 1.00 61.99 C
-ATOM 11639 CG HIS Z 67 2.763 64.347 -0.290 1.00 56.21 C
-ATOM 11640 ND1 HIS Z 67 3.389 63.601 0.684 1.00 58.86 N
-ATOM 11641 CD2 HIS Z 67 3.493 65.467 -0.431 1.00 53.38 C
-ATOM 11642 CE1 HIS Z 67 4.463 64.242 1.092 1.00 49.06 C
-ATOM 11643 NE2 HIS Z 67 4.537 65.376 0.437 1.00 59.72 N
-ATOM 11644 H HIS Z 67 2.825 62.794 -3.033 1.00 0.00 H
-ATOM 11645 HA HIS Z 67 1.638 61.851 -0.446 1.00 0.00 H
-ATOM 11646 1HB HIS Z 67 1.370 64.539 -1.835 1.00 0.00 H
-ATOM 11647 2HB HIS Z 67 0.691 64.105 -0.266 1.00 0.00 H
-ATOM 11648 HD2 HIS Z 67 3.289 66.298 -1.100 1.00 0.00 H
-ATOM 11649 HE1 HIS Z 67 5.162 63.899 1.857 1.00 0.00 H
-ATOM 11650 HE2 HIS Z 67 5.241 66.094 0.549 1.00 0.00 H
-ATOM 11651 N GLY Z 68 0.212 61.375 -3.102 1.00 67.66 N
-ATOM 11652 CA GLY Z 68 -1.029 61.056 -3.799 1.00 69.34 C
-ATOM 11653 C GLY Z 68 -0.980 61.605 -5.210 1.00 70.60 C
-ATOM 11654 O GLY Z 68 0.099 61.734 -5.792 1.00 70.16 O
-ATOM 11655 H GLY Z 68 1.096 61.051 -3.496 1.00 0.00 H
-ATOM 11656 1HA GLY Z 68 -1.173 59.972 -3.825 1.00 0.00 H
-ATOM 11657 2HA GLY Z 68 -1.875 61.487 -3.267 1.00 0.00 H
-ATOM 11658 N VAL Z 69 -2.131 61.900 -5.787 1.00 70.64 N
-ATOM 11659 CA VAL Z 69 -2.161 62.413 -7.148 1.00 73.07 C
-ATOM 11660 C VAL Z 69 -2.868 63.750 -7.196 1.00 75.91 C
-ATOM 11661 O VAL Z 69 -3.656 64.078 -6.303 1.00 75.46 O
-ATOM 11662 CB VAL Z 69 -2.869 61.442 -8.094 1.00 74.98 C
-ATOM 11663 CG1 VAL Z 69 -2.144 60.116 -8.116 1.00 71.96 C
-ATOM 11664 CG2 VAL Z 69 -4.298 61.283 -7.633 1.00 76.35 C
-ATOM 11665 H VAL Z 69 -2.998 61.762 -5.281 1.00 0.00 H
-ATOM 11666 HA VAL Z 69 -1.134 62.557 -7.493 1.00 0.00 H
-ATOM 11667 HB VAL Z 69 -2.850 61.849 -9.107 1.00 0.00 H
-ATOM 11668 1HG1 VAL Z 69 -2.643 59.437 -8.798 1.00 0.00 H
-ATOM 11669 2HG1 VAL Z 69 -1.128 60.277 -8.441 1.00 0.00 H
-ATOM 11670 3HG1 VAL Z 69 -2.137 59.683 -7.119 1.00 0.00 H
-ATOM 11671 1HG2 VAL Z 69 -4.828 60.608 -8.299 1.00 0.00 H
-ATOM 11672 2HG2 VAL Z 69 -4.309 60.879 -6.621 1.00 0.00 H
-ATOM 11673 3HG2 VAL Z 69 -4.782 62.262 -7.641 1.00 0.00 H
-ATOM 11674 N ILE Z 70 -2.578 64.521 -8.232 1.00 76.75 N
-ATOM 11675 CA ILE Z 70 -3.190 65.819 -8.422 1.00 79.00 C
-ATOM 11676 C ILE Z 70 -3.241 66.165 -9.914 1.00 80.84 C
-ATOM 11677 O ILE Z 70 -2.399 65.707 -10.681 1.00 81.64 O
-ATOM 11678 CB ILE Z 70 -2.387 66.879 -7.648 1.00 76.50 C
-ATOM 11679 CG1 ILE Z 70 -3.162 68.161 -7.522 1.00 75.60 C
-ATOM 11680 CG2 ILE Z 70 -1.066 67.120 -8.337 1.00 72.67 C
-ATOM 11681 CD1 ILE Z 70 -2.561 69.092 -6.532 1.00 71.29 C
-ATOM 11682 H ILE Z 70 -1.880 64.194 -8.903 1.00 0.00 H
-ATOM 11683 HA ILE Z 70 -4.212 65.785 -8.039 1.00 0.00 H
-ATOM 11684 HB ILE Z 70 -2.195 66.520 -6.640 1.00 0.00 H
-ATOM 11685 1HG1 ILE Z 70 -3.221 68.670 -8.483 1.00 0.00 H
-ATOM 11686 2HG1 ILE Z 70 -4.171 67.919 -7.187 1.00 0.00 H
-ATOM 11687 1HG2 ILE Z 70 -0.492 67.852 -7.785 1.00 0.00 H
-ATOM 11688 2HG2 ILE Z 70 -0.518 66.178 -8.380 1.00 0.00 H
-ATOM 11689 3HG2 ILE Z 70 -1.252 67.489 -9.346 1.00 0.00 H
-ATOM 11690 1HD1 ILE Z 70 -3.182 69.955 -6.465 1.00 0.00 H
-ATOM 11691 2HD1 ILE Z 70 -2.505 68.609 -5.555 1.00 0.00 H
-ATOM 11692 3HD1 ILE Z 70 -1.561 69.372 -6.859 1.00 0.00 H
-ATOM 11693 N GLU Z 71 -4.210 66.970 -10.330 1.00 81.74 N
-ATOM 11694 CA GLU Z 71 -4.198 67.429 -11.715 1.00 80.70 C
-ATOM 11695 C GLU Z 71 -3.995 68.934 -11.793 1.00 80.42 C
-ATOM 11696 O GLU Z 71 -4.530 69.685 -10.965 1.00 79.38 O
-ATOM 11697 CB GLU Z 71 -5.495 67.063 -12.448 1.00 74.85 C
-ATOM 11698 CG GLU Z 71 -5.734 65.579 -12.622 1.00 81.11 C
-ATOM 11699 CD GLU Z 71 -7.008 65.261 -13.378 1.00 85.13 C
-ATOM 11700 OE1 GLU Z 71 -7.721 66.174 -13.726 1.00 87.23 O
-ATOM 11701 OE2 GLU Z 71 -7.263 64.104 -13.605 1.00 75.28 O
-ATOM 11702 H GLU Z 71 -4.919 67.290 -9.685 1.00 0.00 H
-ATOM 11703 HA GLU Z 71 -3.369 66.954 -12.236 1.00 0.00 H
-ATOM 11704 1HB GLU Z 71 -6.347 67.493 -11.926 1.00 0.00 H
-ATOM 11705 2HB GLU Z 71 -5.466 67.503 -13.447 1.00 0.00 H
-ATOM 11706 1HG GLU Z 71 -4.892 65.174 -13.172 1.00 0.00 H
-ATOM 11707 2HG GLU Z 71 -5.760 65.102 -11.645 1.00 0.00 H
-ATOM 11708 N SER Z 72 -3.235 69.367 -12.804 1.00 81.54 N
-ATOM 11709 CA SER Z 72 -2.993 70.788 -13.071 1.00 82.48 C
-ATOM 11710 C SER Z 72 -3.872 71.254 -14.217 1.00 82.41 C
-ATOM 11711 O SER Z 72 -4.341 70.423 -15.001 1.00 79.69 O
-ATOM 11712 CB SER Z 72 -1.536 71.025 -13.424 1.00 80.35 C
-ATOM 11713 OG SER Z 72 -1.204 70.401 -14.629 1.00 78.03 O
-ATOM 11714 H SER Z 72 -2.840 68.668 -13.427 1.00 0.00 H
-ATOM 11715 HA SER Z 72 -3.246 71.370 -12.185 1.00 0.00 H
-ATOM 11716 1HB SER Z 72 -1.332 72.099 -13.492 1.00 0.00 H
-ATOM 11717 2HB SER Z 72 -0.911 70.626 -12.633 1.00 0.00 H
-ATOM 11718 HG SER Z 72 -1.477 71.011 -15.353 1.00 0.00 H
-ATOM 11719 N GLU Z 73 -4.058 72.572 -14.322 1.00 84.04 N
-ATOM 11720 CA GLU Z 73 -4.844 73.187 -15.396 1.00 87.55 C
-ATOM 11721 C GLU Z 73 -4.134 74.414 -15.978 1.00 88.53 C
-ATOM 11722 O GLU Z 73 -3.269 75.008 -15.331 1.00 89.47 O
-ATOM 11723 CB GLU Z 73 -6.243 73.572 -14.885 1.00 93.55 C
-ATOM 11724 CG GLU Z 73 -7.082 72.406 -14.360 1.00 94.59 C
-ATOM 11725 CD GLU Z 73 -8.459 72.815 -13.897 1.00 96.15 C
-ATOM 11726 OE1 GLU Z 73 -9.183 71.967 -13.433 1.00 97.84 O
-ATOM 11727 OE2 GLU Z 73 -8.778 73.974 -13.994 1.00 98.71 O
-ATOM 11728 H GLU Z 73 -3.632 73.179 -13.622 1.00 0.00 H
-ATOM 11729 HA GLU Z 73 -4.962 72.461 -16.199 1.00 0.00 H
-ATOM 11730 1HB GLU Z 73 -6.157 74.283 -14.085 1.00 0.00 H
-ATOM 11731 2HB GLU Z 73 -6.802 74.051 -15.688 1.00 0.00 H
-ATOM 11732 1HG GLU Z 73 -7.173 71.651 -15.143 1.00 0.00 H
-ATOM 11733 2HG GLU Z 73 -6.561 71.954 -13.519 1.00 0.00 H
-ATOM 11734 N GLY Z 74 -4.487 74.790 -17.203 1.00 90.20 N
-ATOM 11735 CA GLY Z 74 -3.928 75.987 -17.820 1.00 91.65 C
-ATOM 11736 C GLY Z 74 -4.911 76.617 -18.794 1.00 93.23 C
-ATOM 11737 O GLY Z 74 -4.532 77.462 -19.606 1.00 93.88 O
-ATOM 11738 OXT GLY Z 74 -6.112 76.367 -18.689 1.00 0.00 O
-ATOM 11739 H GLY Z 74 -5.180 74.249 -17.704 1.00 0.00 H
-ATOM 11740 1HA GLY Z 74 -3.671 76.710 -17.043 1.00 0.00 H
-ATOM 11741 2HA GLY Z 74 -3.006 75.738 -18.339 1.00 0.00 H
-TER
-ATOM 11743 N GLU H 1 8.740 109.632 5.189 1.00 32.18 N
-ATOM 11744 CA GLU H 1 8.207 109.182 6.470 1.00 32.48 C
-ATOM 11745 C GLU H 1 6.809 108.616 6.312 1.00 31.92 C
-ATOM 11746 O GLU H 1 5.957 109.211 5.652 1.00 32.22 O
-ATOM 11747 CB GLU H 1 8.190 110.328 7.489 1.00 33.04 C
-ATOM 11748 CG GLU H 1 7.743 109.918 8.902 1.00 35.19 C
-ATOM 11749 CD GLU H 1 7.778 111.057 9.899 1.00 39.72 C
-ATOM 11750 OE1 GLU H 1 7.632 110.807 11.071 1.00 40.25 O
-ATOM 11751 OE2 GLU H 1 7.941 112.176 9.486 1.00 42.30 O
-ATOM 11752 1H GLU H 1 9.644 110.057 5.334 1.00 0.00 H
-ATOM 11753 2H GLU H 1 8.835 108.842 4.567 1.00 0.00 H
-ATOM 11754 3H GLU H 1 8.111 110.308 4.782 1.00 0.00 H
-ATOM 11755 HA GLU H 1 8.847 108.388 6.850 1.00 0.00 H
-ATOM 11756 1HB GLU H 1 9.188 110.757 7.568 1.00 0.00 H
-ATOM 11757 2HB GLU H 1 7.520 111.111 7.141 1.00 0.00 H
-ATOM 11758 1HG GLU H 1 6.719 109.543 8.852 1.00 0.00 H
-ATOM 11759 2HG GLU H 1 8.380 109.112 9.249 1.00 0.00 H
-ATOM 11760 N VAL H 2 6.582 107.462 6.912 1.00 30.85 N
-ATOM 11761 CA VAL H 2 5.287 106.802 6.850 1.00 30.21 C
-ATOM 11762 C VAL H 2 4.182 107.630 7.473 1.00 29.76 C
-ATOM 11763 O VAL H 2 4.320 108.153 8.576 1.00 30.01 O
-ATOM 11764 CB VAL H 2 5.353 105.444 7.532 1.00 30.36 C
-ATOM 11765 CG1 VAL H 2 3.966 104.843 7.657 1.00 30.19 C
-ATOM 11766 CG2 VAL H 2 6.255 104.564 6.724 1.00 30.21 C
-ATOM 11767 H VAL H 2 7.325 107.019 7.441 1.00 0.00 H
-ATOM 11768 HA VAL H 2 5.041 106.639 5.804 1.00 0.00 H
-ATOM 11769 HB VAL H 2 5.755 105.554 8.503 1.00 0.00 H
-ATOM 11770 1HG1 VAL H 2 4.026 103.880 8.137 1.00 0.00 H
-ATOM 11771 2HG1 VAL H 2 3.336 105.499 8.257 1.00 0.00 H
-ATOM 11772 3HG1 VAL H 2 3.545 104.743 6.680 1.00 0.00 H
-ATOM 11773 1HG2 VAL H 2 6.333 103.600 7.197 1.00 0.00 H
-ATOM 11774 2HG2 VAL H 2 5.844 104.449 5.718 1.00 0.00 H
-ATOM 11775 3HG2 VAL H 2 7.245 105.014 6.662 1.00 0.00 H
-ATOM 11776 N GLN H 3 3.073 107.727 6.740 1.00 28.62 N
-ATOM 11777 CA GLN H 3 1.947 108.525 7.197 1.00 27.16 C
-ATOM 11778 C GLN H 3 0.618 107.839 6.879 1.00 25.79 C
-ATOM 11779 O GLN H 3 0.367 107.382 5.773 1.00 24.79 O
-ATOM 11780 CB GLN H 3 1.992 109.893 6.491 1.00 27.74 C
-ATOM 11781 CG GLN H 3 0.916 110.885 6.925 1.00 29.34 C
-ATOM 11782 CD GLN H 3 1.238 111.550 8.258 1.00 31.63 C
-ATOM 11783 OE1 GLN H 3 0.448 111.537 9.206 1.00 32.01 O
-ATOM 11784 NE2 GLN H 3 2.423 112.153 8.331 1.00 30.72 N
-ATOM 11785 H GLN H 3 3.041 107.264 5.844 1.00 0.00 H
-ATOM 11786 HA GLN H 3 2.022 108.664 8.264 1.00 0.00 H
-ATOM 11787 1HB GLN H 3 2.965 110.353 6.674 1.00 0.00 H
-ATOM 11788 2HB GLN H 3 1.903 109.750 5.422 1.00 0.00 H
-ATOM 11789 1HG GLN H 3 0.807 111.658 6.165 1.00 0.00 H
-ATOM 11790 2HG GLN H 3 -0.019 110.348 7.041 1.00 0.00 H
-ATOM 11791 1HE2 GLN H 3 2.702 112.608 9.177 1.00 0.00 H
-ATOM 11792 2HE2 GLN H 3 3.041 112.146 7.542 1.00 0.00 H
-ATOM 11793 N LEU H 4 -0.215 107.766 7.916 1.00 24.41 N
-ATOM 11794 CA LEU H 4 -1.559 107.215 7.806 1.00 23.26 C
-ATOM 11795 C LEU H 4 -2.524 108.379 8.022 1.00 23.19 C
-ATOM 11796 O LEU H 4 -2.397 109.100 9.011 1.00 23.32 O
-ATOM 11797 CB LEU H 4 -1.760 106.129 8.871 1.00 22.89 C
-ATOM 11798 CG LEU H 4 -0.819 104.913 8.754 1.00 22.07 C
-ATOM 11799 CD1 LEU H 4 -1.028 103.998 9.925 1.00 23.31 C
-ATOM 11800 CD2 LEU H 4 -1.109 104.175 7.475 1.00 19.85 C
-ATOM 11801 H LEU H 4 0.084 108.128 8.802 1.00 0.00 H
-ATOM 11802 HA LEU H 4 -1.722 106.802 6.818 1.00 0.00 H
-ATOM 11803 1HB LEU H 4 -1.591 106.566 9.844 1.00 0.00 H
-ATOM 11804 2HB LEU H 4 -2.779 105.776 8.835 1.00 0.00 H
-ATOM 11805 HG LEU H 4 0.218 105.249 8.765 1.00 0.00 H
-ATOM 11806 1HD1 LEU H 4 -0.360 103.142 9.848 1.00 0.00 H
-ATOM 11807 2HD1 LEU H 4 -0.818 104.538 10.848 1.00 0.00 H
-ATOM 11808 3HD1 LEU H 4 -2.056 103.655 9.931 1.00 0.00 H
-ATOM 11809 1HD2 LEU H 4 -0.450 103.334 7.418 1.00 0.00 H
-ATOM 11810 2HD2 LEU H 4 -2.143 103.831 7.468 1.00 0.00 H
-ATOM 11811 3HD2 LEU H 4 -0.944 104.838 6.622 1.00 0.00 H
-ATOM 11812 N VAL H 5 -3.444 108.606 7.087 1.00 22.80 N
-ATOM 11813 CA VAL H 5 -4.317 109.769 7.234 1.00 22.27 C
-ATOM 11814 C VAL H 5 -5.782 109.410 7.314 1.00 21.60 C
-ATOM 11815 O VAL H 5 -6.382 108.967 6.327 1.00 20.95 O
-ATOM 11816 CB VAL H 5 -4.122 110.715 6.045 1.00 22.45 C
-ATOM 11817 CG1 VAL H 5 -5.025 111.931 6.210 1.00 22.87 C
-ATOM 11818 CG2 VAL H 5 -2.652 111.090 5.929 1.00 22.92 C
-ATOM 11819 H VAL H 5 -3.505 107.999 6.277 1.00 0.00 H
-ATOM 11820 HA VAL H 5 -4.050 110.293 8.152 1.00 0.00 H
-ATOM 11821 HB VAL H 5 -4.433 110.215 5.136 1.00 0.00 H
-ATOM 11822 1HG1 VAL H 5 -4.906 112.596 5.356 1.00 0.00 H
-ATOM 11823 2HG1 VAL H 5 -6.067 111.606 6.276 1.00 0.00 H
-ATOM 11824 3HG1 VAL H 5 -4.757 112.464 7.127 1.00 0.00 H
-ATOM 11825 1HG2 VAL H 5 -2.508 111.751 5.079 1.00 0.00 H
-ATOM 11826 2HG2 VAL H 5 -2.329 111.595 6.845 1.00 0.00 H
-ATOM 11827 3HG2 VAL H 5 -2.065 110.181 5.785 1.00 0.00 H
-ATOM 11828 N GLU H 6 -6.369 109.600 8.486 1.00 21.17 N
-ATOM 11829 CA GLU H 6 -7.767 109.262 8.669 1.00 20.70 C
-ATOM 11830 C GLU H 6 -8.683 110.385 8.175 1.00 20.16 C
-ATOM 11831 O GLU H 6 -8.357 111.572 8.312 1.00 19.81 O
-ATOM 11832 CB GLU H 6 -8.091 108.932 10.127 1.00 21.01 C
-ATOM 11833 CG GLU H 6 -7.343 107.764 10.731 1.00 22.63 C
-ATOM 11834 CD GLU H 6 -6.191 108.219 11.529 1.00 25.73 C
-ATOM 11835 OE1 GLU H 6 -5.605 107.438 12.220 1.00 22.91 O
-ATOM 11836 OE2 GLU H 6 -5.911 109.374 11.503 1.00 27.25 O
-ATOM 11837 H GLU H 6 -5.832 109.985 9.254 1.00 0.00 H
-ATOM 11838 HA GLU H 6 -7.972 108.373 8.089 1.00 0.00 H
-ATOM 11839 1HB GLU H 6 -7.829 109.791 10.732 1.00 0.00 H
-ATOM 11840 2HB GLU H 6 -9.159 108.743 10.238 1.00 0.00 H
-ATOM 11841 1HG GLU H 6 -8.015 107.183 11.367 1.00 0.00 H
-ATOM 11842 2HG GLU H 6 -6.998 107.122 9.923 1.00 0.00 H
-ATOM 11843 N SER H 7 -9.862 110.007 7.685 1.00 19.46 N
-ATOM 11844 CA SER H 7 -10.904 110.964 7.324 1.00 19.36 C
-ATOM 11845 C SER H 7 -12.294 110.319 7.351 1.00 18.64 C
-ATOM 11846 O SER H 7 -12.428 109.093 7.371 1.00 18.84 O
-ATOM 11847 CB SER H 7 -10.616 111.561 5.954 1.00 19.39 C
-ATOM 11848 OG SER H 7 -10.705 110.595 4.946 1.00 20.60 O
-ATOM 11849 H SER H 7 -10.016 109.017 7.535 1.00 0.00 H
-ATOM 11850 HA SER H 7 -10.891 111.772 8.055 1.00 0.00 H
-ATOM 11851 1HB SER H 7 -11.327 112.361 5.754 1.00 0.00 H
-ATOM 11852 2HB SER H 7 -9.619 112.006 5.952 1.00 0.00 H
-ATOM 11853 HG SER H 7 -10.024 109.940 5.148 1.00 0.00 H
-ATOM 11854 N GLY H 9 -13.342 111.148 7.319 1.00 18.00 N
-ATOM 11855 CA GLY H 9 -14.712 110.617 7.288 1.00 17.99 C
-ATOM 11856 C GLY H 9 -15.389 110.548 8.660 1.00 18.34 C
-ATOM 11857 O GLY H 9 -16.307 109.764 8.857 1.00 18.95 O
-ATOM 11858 H GLY H 9 -13.192 112.145 7.299 1.00 0.00 H
-ATOM 11859 1HA GLY H 9 -15.315 111.240 6.626 1.00 0.00 H
-ATOM 11860 2HA GLY H 9 -14.702 109.621 6.845 1.00 0.00 H
-ATOM 11861 N GLY H 10 -14.933 111.352 9.611 1.00 18.10 N
-ATOM 11862 CA GLY H 10 -15.545 111.356 10.942 1.00 17.45 C
-ATOM 11863 C GLY H 10 -16.767 112.255 10.968 1.00 17.13 C
-ATOM 11864 O GLY H 10 -17.293 112.629 9.917 1.00 17.74 O
-ATOM 11865 H GLY H 10 -14.166 111.972 9.415 1.00 0.00 H
-ATOM 11866 1HA GLY H 10 -15.809 110.344 11.236 1.00 0.00 H
-ATOM 11867 2HA GLY H 10 -14.837 111.725 11.675 1.00 0.00 H
-ATOM 11868 N GLY H 11 -17.212 112.620 12.167 1.00 16.81 N
-ATOM 11869 CA GLY H 11 -18.389 113.471 12.293 1.00 15.80 C
-ATOM 11870 C GLY H 11 -19.537 112.845 13.071 1.00 15.05 C
-ATOM 11871 O GLY H 11 -19.391 111.801 13.717 1.00 15.57 O
-ATOM 11872 H GLY H 11 -16.716 112.303 12.999 1.00 0.00 H
-ATOM 11873 1HA GLY H 11 -18.099 114.401 12.781 1.00 0.00 H
-ATOM 11874 2HA GLY H 11 -18.739 113.747 11.299 1.00 0.00 H
-ATOM 11875 N LEU H 12 -20.677 113.530 13.026 1.00 14.22 N
-ATOM 11876 CA LEU H 12 -21.876 113.167 13.764 1.00 13.40 C
-ATOM 11877 C LEU H 12 -22.782 112.186 13.044 1.00 13.79 C
-ATOM 11878 O LEU H 12 -23.166 112.392 11.891 1.00 14.37 O
-ATOM 11879 CB LEU H 12 -22.677 114.419 14.111 1.00 12.73 C
-ATOM 11880 CG LEU H 12 -24.007 114.159 14.827 1.00 10.89 C
-ATOM 11881 CD1 LEU H 12 -23.742 113.543 16.192 1.00 8.45 C
-ATOM 11882 CD2 LEU H 12 -24.768 115.465 14.957 1.00 8.53 C
-ATOM 11883 H LEU H 12 -20.706 114.362 12.447 1.00 0.00 H
-ATOM 11884 HA LEU H 12 -21.559 112.703 14.691 1.00 0.00 H
-ATOM 11885 1HB LEU H 12 -22.072 115.058 14.749 1.00 0.00 H
-ATOM 11886 2HB LEU H 12 -22.893 114.958 13.186 1.00 0.00 H
-ATOM 11887 HG LEU H 12 -24.602 113.448 14.252 1.00 0.00 H
-ATOM 11888 1HD1 LEU H 12 -24.691 113.347 16.683 1.00 0.00 H
-ATOM 11889 2HD1 LEU H 12 -23.204 112.606 16.075 1.00 0.00 H
-ATOM 11890 3HD1 LEU H 12 -23.147 114.226 16.795 1.00 0.00 H
-ATOM 11891 1HD2 LEU H 12 -25.716 115.277 15.465 1.00 0.00 H
-ATOM 11892 2HD2 LEU H 12 -24.177 116.171 15.537 1.00 0.00 H
-ATOM 11893 3HD2 LEU H 12 -24.957 115.869 13.965 1.00 0.00 H
-ATOM 11894 N VAL H 13 -23.116 111.118 13.757 1.00 13.34 N
-ATOM 11895 CA VAL H 13 -23.958 110.044 13.280 1.00 12.94 C
-ATOM 11896 C VAL H 13 -25.270 109.898 14.058 1.00 12.61 C
-ATOM 11897 O VAL H 13 -25.269 109.889 15.288 1.00 12.72 O
-ATOM 11898 CB VAL H 13 -23.161 108.742 13.424 1.00 12.98 C
-ATOM 11899 CG1 VAL H 13 -23.999 107.556 13.021 1.00 14.32 C
-ATOM 11900 CG2 VAL H 13 -21.893 108.828 12.608 1.00 13.81 C
-ATOM 11901 H VAL H 13 -22.727 111.033 14.689 1.00 0.00 H
-ATOM 11902 HA VAL H 13 -24.179 110.226 12.228 1.00 0.00 H
-ATOM 11903 HB VAL H 13 -22.896 108.617 14.455 1.00 0.00 H
-ATOM 11904 1HG1 VAL H 13 -23.437 106.678 13.159 1.00 0.00 H
-ATOM 11905 2HG1 VAL H 13 -24.873 107.501 13.645 1.00 0.00 H
-ATOM 11906 3HG1 VAL H 13 -24.293 107.636 11.975 1.00 0.00 H
-ATOM 11907 1HG2 VAL H 13 -21.325 107.914 12.741 1.00 0.00 H
-ATOM 11908 2HG2 VAL H 13 -22.150 108.956 11.561 1.00 0.00 H
-ATOM 11909 3HG2 VAL H 13 -21.291 109.676 12.948 1.00 0.00 H
-ATOM 11910 N GLN H 14 -26.387 109.784 13.342 1.00 12.95 N
-ATOM 11911 CA GLN H 14 -27.665 109.526 13.998 1.00 13.50 C
-ATOM 11912 C GLN H 14 -27.655 108.073 14.474 1.00 13.26 C
-ATOM 11913 O GLN H 14 -27.308 107.204 13.669 1.00 12.69 O
-ATOM 11914 CB GLN H 14 -28.830 109.727 13.015 1.00 13.60 C
-ATOM 11915 CG GLN H 14 -30.219 109.581 13.626 1.00 16.24 C
-ATOM 11916 CD GLN H 14 -31.319 109.824 12.611 1.00 19.23 C
-ATOM 11917 OE1 GLN H 14 -31.107 110.491 11.595 1.00 19.33 O
-ATOM 11918 NE2 GLN H 14 -32.505 109.276 12.873 1.00 19.16 N
-ATOM 11919 H GLN H 14 -26.344 109.843 12.332 1.00 0.00 H
-ATOM 11920 HA GLN H 14 -27.784 110.221 14.827 1.00 0.00 H
-ATOM 11921 1HB GLN H 14 -28.763 110.727 12.590 1.00 0.00 H
-ATOM 11922 2HB GLN H 14 -28.748 109.012 12.204 1.00 0.00 H
-ATOM 11923 1HG GLN H 14 -30.333 108.568 14.025 1.00 0.00 H
-ATOM 11924 2HG GLN H 14 -30.333 110.314 14.427 1.00 0.00 H
-ATOM 11925 1HE2 GLN H 14 -33.267 109.400 12.236 1.00 0.00 H
-ATOM 11926 2HE2 GLN H 14 -32.637 108.733 13.707 1.00 0.00 H
-ATOM 11927 N PRO H 15 -28.027 107.762 15.728 1.00 13.44 N
-ATOM 11928 CA PRO H 15 -28.090 106.408 16.268 1.00 13.45 C
-ATOM 11929 C PRO H 15 -28.808 105.478 15.331 1.00 12.95 C
-ATOM 11930 O PRO H 15 -29.879 105.790 14.826 1.00 12.99 O
-ATOM 11931 CB PRO H 15 -28.855 106.621 17.572 1.00 13.75 C
-ATOM 11932 CG PRO H 15 -28.508 108.035 17.991 1.00 13.80 C
-ATOM 11933 CD PRO H 15 -28.425 108.807 16.682 1.00 13.48 C
-ATOM 11934 HA PRO H 15 -27.058 106.048 16.473 1.00 0.00 H
-ATOM 11935 1HB PRO H 15 -29.941 106.459 17.394 1.00 0.00 H
-ATOM 11936 2HB PRO H 15 -28.547 105.873 18.308 1.00 0.00 H
-ATOM 11937 1HG PRO H 15 -29.312 108.437 18.629 1.00 0.00 H
-ATOM 11938 2HG PRO H 15 -27.602 108.070 18.593 1.00 0.00 H
-ATOM 11939 1HD PRO H 15 -29.362 109.289 16.431 1.00 0.00 H
-ATOM 11940 2HD PRO H 15 -27.594 109.521 16.802 1.00 0.00 H
-ATOM 11941 N GLY H 16 -28.219 104.297 15.110 1.00 12.59 N
-ATOM 11942 CA GLY H 16 -28.765 103.285 14.228 1.00 12.92 C
-ATOM 11943 C GLY H 16 -28.305 103.486 12.787 1.00 13.25 C
-ATOM 11944 O GLY H 16 -28.538 102.629 11.932 1.00 12.17 O
-ATOM 11945 H GLY H 16 -27.329 104.105 15.572 1.00 0.00 H
-ATOM 11946 1HA GLY H 16 -28.454 102.305 14.578 1.00 0.00 H
-ATOM 11947 2HA GLY H 16 -29.858 103.309 14.279 1.00 0.00 H
-ATOM 11948 N GLY H 17 -27.627 104.604 12.526 1.00 13.90 N
-ATOM 11949 CA GLY H 17 -27.143 104.935 11.196 1.00 15.12 C
-ATOM 11950 C GLY H 17 -25.755 104.365 10.910 1.00 15.83 C
-ATOM 11951 O GLY H 17 -25.260 103.489 11.634 1.00 16.05 O
-ATOM 11952 H GLY H 17 -27.481 105.290 13.264 1.00 0.00 H
-ATOM 11953 1HA GLY H 17 -27.849 104.571 10.457 1.00 0.00 H
-ATOM 11954 2HA GLY H 17 -27.110 106.019 11.100 1.00 0.00 H
-ATOM 11955 N SER H 18 -25.130 104.874 9.854 1.00 16.46 N
-ATOM 11956 CA SER H 18 -23.833 104.350 9.434 1.00 17.32 C
-ATOM 11957 C SER H 18 -22.805 105.436 9.140 1.00 17.55 C
-ATOM 11958 O SER H 18 -23.159 106.574 8.827 1.00 17.70 O
-ATOM 11959 CB SER H 18 -24.013 103.500 8.202 1.00 17.52 C
-ATOM 11960 OG SER H 18 -24.874 102.426 8.445 1.00 21.40 O
-ATOM 11961 H SER H 18 -25.563 105.611 9.318 1.00 0.00 H
-ATOM 11962 HA SER H 18 -23.443 103.730 10.243 1.00 0.00 H
-ATOM 11963 1HB SER H 18 -24.391 104.100 7.375 1.00 0.00 H
-ATOM 11964 2HB SER H 18 -23.037 103.108 7.899 1.00 0.00 H
-ATOM 11965 HG SER H 18 -24.516 101.677 7.934 1.00 0.00 H
-ATOM 11966 N LEU H 19 -21.527 105.059 9.221 1.00 17.74 N
-ATOM 11967 CA LEU H 19 -20.438 105.965 8.869 1.00 17.62 C
-ATOM 11968 C LEU H 19 -19.229 105.192 8.347 1.00 17.64 C
-ATOM 11969 O LEU H 19 -18.860 104.162 8.912 1.00 17.17 O
-ATOM 11970 CB LEU H 19 -20.004 106.787 10.078 1.00 17.98 C
-ATOM 11971 CG LEU H 19 -18.939 107.835 9.807 1.00 19.03 C
-ATOM 11972 CD1 LEU H 19 -19.551 108.932 8.949 1.00 18.91 C
-ATOM 11973 CD2 LEU H 19 -18.419 108.361 11.090 1.00 17.21 C
-ATOM 11974 H LEU H 19 -21.335 104.107 9.520 1.00 0.00 H
-ATOM 11975 HA LEU H 19 -20.782 106.637 8.085 1.00 0.00 H
-ATOM 11976 1HB LEU H 19 -20.875 107.296 10.461 1.00 0.00 H
-ATOM 11977 2HB LEU H 19 -19.627 106.124 10.843 1.00 0.00 H
-ATOM 11978 HG LEU H 19 -18.109 107.393 9.253 1.00 0.00 H
-ATOM 11979 1HD1 LEU H 19 -18.803 109.696 8.737 1.00 0.00 H
-ATOM 11980 2HD1 LEU H 19 -19.913 108.511 8.015 1.00 0.00 H
-ATOM 11981 3HD1 LEU H 19 -20.384 109.386 9.490 1.00 0.00 H
-ATOM 11982 1HD2 LEU H 19 -17.662 109.102 10.889 1.00 0.00 H
-ATOM 11983 2HD2 LEU H 19 -19.223 108.817 11.654 1.00 0.00 H
-ATOM 11984 3HD2 LEU H 19 -17.986 107.541 11.655 1.00 0.00 H
-ATOM 11985 N ARG H 20 -18.635 105.668 7.249 1.00 17.51 N
-ATOM 11986 CA ARG H 20 -17.455 105.003 6.698 1.00 17.31 C
-ATOM 11987 C ARG H 20 -16.197 105.847 6.912 1.00 16.58 C
-ATOM 11988 O ARG H 20 -16.166 107.017 6.556 1.00 16.78 O
-ATOM 11989 CB ARG H 20 -17.623 104.761 5.203 1.00 17.44 C
-ATOM 11990 CG ARG H 20 -16.559 103.860 4.545 1.00 18.83 C
-ATOM 11991 CD ARG H 20 -16.804 103.721 3.070 1.00 22.67 C
-ATOM 11992 NE ARG H 20 -15.976 102.689 2.449 1.00 26.25 N
-ATOM 11993 CZ ARG H 20 -15.731 102.600 1.122 1.00 26.34 C
-ATOM 11994 NH1 ARG H 20 -16.221 103.503 0.302 1.00 26.10 N
-ATOM 11995 NH2 ARG H 20 -15.002 101.608 0.641 1.00 26.09 N
-ATOM 11996 H ARG H 20 -18.983 106.511 6.821 1.00 0.00 H
-ATOM 11997 HA ARG H 20 -17.325 104.049 7.198 1.00 0.00 H
-ATOM 11998 1HB ARG H 20 -18.586 104.296 5.034 1.00 0.00 H
-ATOM 11999 2HB ARG H 20 -17.625 105.713 4.679 1.00 0.00 H
-ATOM 12000 1HG ARG H 20 -15.562 104.278 4.702 1.00 0.00 H
-ATOM 12001 2HG ARG H 20 -16.608 102.866 4.990 1.00 0.00 H
-ATOM 12002 1HD ARG H 20 -17.849 103.471 2.895 1.00 0.00 H
-ATOM 12003 2HD ARG H 20 -16.574 104.670 2.585 1.00 0.00 H
-ATOM 12004 HE ARG H 20 -15.584 101.978 3.050 1.00 0.00 H
-ATOM 12005 1HH1 ARG H 20 -16.782 104.262 0.664 1.00 0.00 H
-ATOM 12006 2HH1 ARG H 20 -16.038 103.436 -0.689 1.00 0.00 H
-ATOM 12007 1HH2 ARG H 20 -14.637 100.896 1.261 1.00 0.00 H
-ATOM 12008 2HH2 ARG H 20 -14.823 101.549 -0.349 1.00 0.00 H
-ATOM 12009 N LEU H 21 -15.163 105.229 7.475 1.00 16.15 N
-ATOM 12010 CA LEU H 21 -13.901 105.915 7.708 1.00 15.52 C
-ATOM 12011 C LEU H 21 -12.897 105.508 6.647 1.00 15.22 C
-ATOM 12012 O LEU H 21 -12.907 104.372 6.176 1.00 14.58 O
-ATOM 12013 CB LEU H 21 -13.340 105.574 9.086 1.00 15.52 C
-ATOM 12014 CG LEU H 21 -14.246 105.902 10.235 1.00 15.79 C
-ATOM 12015 CD1 LEU H 21 -13.595 105.445 11.525 1.00 15.22 C
-ATOM 12016 CD2 LEU H 21 -14.536 107.386 10.242 1.00 17.09 C
-ATOM 12017 H LEU H 21 -15.261 104.258 7.749 1.00 0.00 H
-ATOM 12018 HA LEU H 21 -14.062 106.991 7.645 1.00 0.00 H
-ATOM 12019 1HB LEU H 21 -13.120 104.516 9.128 1.00 0.00 H
-ATOM 12020 2HB LEU H 21 -12.414 106.128 9.228 1.00 0.00 H
-ATOM 12021 HG LEU H 21 -15.168 105.369 10.109 1.00 0.00 H
-ATOM 12022 1HD1 LEU H 21 -14.248 105.655 12.364 1.00 0.00 H
-ATOM 12023 2HD1 LEU H 21 -13.407 104.380 11.472 1.00 0.00 H
-ATOM 12024 3HD1 LEU H 21 -12.654 105.974 11.658 1.00 0.00 H
-ATOM 12025 1HD2 LEU H 21 -15.203 107.622 11.054 1.00 0.00 H
-ATOM 12026 2HD2 LEU H 21 -13.606 107.946 10.361 1.00 0.00 H
-ATOM 12027 3HD2 LEU H 21 -15.004 107.659 9.300 1.00 0.00 H
-ATOM 12028 N SER H 22 -12.007 106.427 6.308 1.00 15.36 N
-ATOM 12029 CA SER H 22 -10.964 106.156 5.323 1.00 16.27 C
-ATOM 12030 C SER H 22 -9.583 106.494 5.859 1.00 16.10 C
-ATOM 12031 O SER H 22 -9.381 107.511 6.495 1.00 17.07 O
-ATOM 12032 CB SER H 22 -11.236 106.983 4.081 1.00 16.02 C
-ATOM 12033 OG SER H 22 -10.211 106.832 3.153 1.00 18.88 O
-ATOM 12034 H SER H 22 -12.070 107.351 6.729 1.00 0.00 H
-ATOM 12035 HA SER H 22 -10.989 105.100 5.065 1.00 0.00 H
-ATOM 12036 1HB SER H 22 -12.179 106.676 3.639 1.00 0.00 H
-ATOM 12037 2HB SER H 22 -11.326 108.031 4.356 1.00 0.00 H
-ATOM 12038 HG SER H 22 -9.392 106.967 3.641 1.00 0.00 H
-ATOM 12039 N CYS H 23 -8.631 105.569 5.603 1.00 16.32 N
-ATOM 12040 CA CYS H 23 -7.252 105.762 6.009 1.00 16.78 C
-ATOM 12041 C CYS H 23 -6.306 105.760 4.816 1.00 16.53 C
-ATOM 12042 O CYS H 23 -6.031 104.663 4.226 1.00 16.37 O
-ATOM 12043 CB CYS H 23 -6.806 104.652 6.960 1.00 17.62 C
-ATOM 12044 SG CYS H 23 -5.072 104.741 7.443 1.00 22.12 S
-ATOM 12045 H CYS H 23 -8.896 104.751 5.120 1.00 0.00 H
-ATOM 12046 HA CYS H 23 -7.140 106.711 6.513 1.00 0.00 H
-ATOM 12047 1HB CYS H 23 -7.411 104.708 7.859 1.00 0.00 H
-ATOM 12048 2HB CYS H 23 -6.988 103.685 6.502 1.00 0.00 H
-ATOM 12049 N ALA H 24 -5.796 106.891 4.411 1.00 15.72 N
-ATOM 12050 CA ALA H 24 -4.927 106.902 3.249 1.00 14.70 C
-ATOM 12051 C ALA H 24 -3.527 106.576 3.706 1.00 14.88 C
-ATOM 12052 O ALA H 24 -3.108 107.049 4.764 1.00 15.80 O
-ATOM 12053 CB ALA H 24 -4.971 108.233 2.523 1.00 14.86 C
-ATOM 12054 H ALA H 24 -6.016 107.755 4.921 1.00 0.00 H
-ATOM 12055 HA ALA H 24 -5.251 106.116 2.565 1.00 0.00 H
-ATOM 12056 1HB ALA H 24 -4.315 108.194 1.652 1.00 0.00 H
-ATOM 12057 2HB ALA H 24 -5.993 108.435 2.199 1.00 0.00 H
-ATOM 12058 3HB ALA H 24 -4.642 109.022 3.187 1.00 0.00 H
-ATOM 12059 N ALA H 25 -2.789 105.789 2.941 1.00 14.43 N
-ATOM 12060 CA ALA H 25 -1.419 105.504 3.330 1.00 13.76 C
-ATOM 12061 C ALA H 25 -0.423 106.189 2.420 1.00 13.58 C
-ATOM 12062 O ALA H 25 -0.651 106.329 1.213 1.00 13.15 O
-ATOM 12063 CB ALA H 25 -1.174 104.015 3.327 1.00 13.82 C
-ATOM 12064 H ALA H 25 -3.166 105.364 2.089 1.00 0.00 H
-ATOM 12065 HA ALA H 25 -1.258 105.885 4.338 1.00 0.00 H
-ATOM 12066 1HB ALA H 25 -0.158 103.815 3.632 1.00 0.00 H
-ATOM 12067 2HB ALA H 25 -1.869 103.536 4.014 1.00 0.00 H
-ATOM 12068 3HB ALA H 25 -1.328 103.645 2.324 1.00 0.00 H
-ATOM 12069 N SER H 26 0.721 106.545 2.992 1.00 13.26 N
-ATOM 12070 CA SER H 26 1.834 107.101 2.247 1.00 13.90 C
-ATOM 12071 C SER H 26 3.171 106.653 2.834 1.00 14.07 C
-ATOM 12072 O SER H 26 3.329 106.490 4.047 1.00 14.37 O
-ATOM 12073 CB SER H 26 1.746 108.613 2.224 1.00 13.95 C
-ATOM 12074 OG SER H 26 2.842 109.175 1.554 1.00 15.75 O
-ATOM 12075 H SER H 26 0.799 106.463 4.002 1.00 0.00 H
-ATOM 12076 HA SER H 26 1.776 106.736 1.221 1.00 0.00 H
-ATOM 12077 1HB SER H 26 0.821 108.907 1.725 1.00 0.00 H
-ATOM 12078 2HB SER H 26 1.700 108.989 3.239 1.00 0.00 H
-ATOM 12079 HG SER H 26 3.590 109.088 2.155 1.00 0.00 H
-ATOM 12080 N GLY H 27 4.134 106.436 1.942 1.00 15.25 N
-ATOM 12081 CA GLY H 27 5.480 105.998 2.312 1.00 15.33 C
-ATOM 12082 C GLY H 27 5.645 104.484 2.166 1.00 15.54 C
-ATOM 12083 O GLY H 27 6.762 103.966 2.211 1.00 15.68 O
-ATOM 12084 H GLY H 27 3.927 106.593 0.965 1.00 0.00 H
-ATOM 12085 1HA GLY H 27 6.210 106.509 1.683 1.00 0.00 H
-ATOM 12086 2HA GLY H 27 5.685 106.291 3.340 1.00 0.00 H
-ATOM 12087 N PHE H 28 4.533 103.775 1.998 1.00 14.69 N
-ATOM 12088 CA PHE H 28 4.566 102.330 1.828 1.00 14.61 C
-ATOM 12089 C PHE H 28 3.317 101.901 1.074 1.00 15.11 C
-ATOM 12090 O PHE H 28 2.335 102.648 1.036 1.00 15.84 O
-ATOM 12091 CB PHE H 28 4.633 101.656 3.199 1.00 14.42 C
-ATOM 12092 CG PHE H 28 3.358 101.732 4.018 1.00 13.48 C
-ATOM 12093 CD1 PHE H 28 2.513 100.633 4.088 1.00 13.56 C
-ATOM 12094 CD2 PHE H 28 2.975 102.891 4.672 1.00 13.15 C
-ATOM 12095 CE1 PHE H 28 1.349 100.671 4.812 1.00 14.07 C
-ATOM 12096 CE2 PHE H 28 1.794 102.928 5.395 1.00 13.58 C
-ATOM 12097 CZ PHE H 28 0.988 101.803 5.461 1.00 16.31 C
-ATOM 12098 H PHE H 28 3.647 104.255 1.979 1.00 0.00 H
-ATOM 12099 HA PHE H 28 5.443 102.053 1.240 1.00 0.00 H
-ATOM 12100 1HB PHE H 28 4.881 100.602 3.063 1.00 0.00 H
-ATOM 12101 2HB PHE H 28 5.438 102.105 3.781 1.00 0.00 H
-ATOM 12102 HD1 PHE H 28 2.797 99.716 3.573 1.00 0.00 H
-ATOM 12103 HD2 PHE H 28 3.611 103.776 4.613 1.00 0.00 H
-ATOM 12104 HE1 PHE H 28 0.714 99.792 4.865 1.00 0.00 H
-ATOM 12105 HE2 PHE H 28 1.498 103.843 5.910 1.00 0.00 H
-ATOM 12106 HZ PHE H 28 0.064 101.815 6.019 1.00 0.00 H
-ATOM 12107 N ASN H 29 3.329 100.701 0.510 1.00 15.27 N
-ATOM 12108 CA ASN H 29 2.130 100.178 -0.124 1.00 15.62 C
-ATOM 12109 C ASN H 29 1.323 99.456 0.950 1.00 16.23 C
-ATOM 12110 O ASN H 29 1.878 98.649 1.690 1.00 16.15 O
-ATOM 12111 CB ASN H 29 2.484 99.226 -1.238 1.00 15.29 C
-ATOM 12112 CG ASN H 29 3.319 99.831 -2.311 1.00 15.43 C
-ATOM 12113 OD1 ASN H 29 2.930 100.775 -3.014 1.00 15.66 O
-ATOM 12114 ND2 ASN H 29 4.505 99.286 -2.446 1.00 15.15 N
-ATOM 12115 H ASN H 29 4.167 100.132 0.536 1.00 0.00 H
-ATOM 12116 HA ASN H 29 1.530 101.002 -0.512 1.00 0.00 H
-ATOM 12117 1HB ASN H 29 2.993 98.357 -0.840 1.00 0.00 H
-ATOM 12118 2HB ASN H 29 1.562 98.891 -1.697 1.00 0.00 H
-ATOM 12119 1HD2 ASN H 29 5.140 99.627 -3.138 1.00 0.00 H
-ATOM 12120 2HD2 ASN H 29 4.778 98.513 -1.826 1.00 0.00 H
-ATOM 12121 N ILE H 30 0.013 99.665 1.016 1.00 16.49 N
-ATOM 12122 CA ILE H 30 -0.733 98.975 2.064 1.00 17.14 C
-ATOM 12123 C ILE H 30 -0.719 97.460 1.860 1.00 18.22 C
-ATOM 12124 O ILE H 30 -0.795 96.720 2.828 1.00 18.92 O
-ATOM 12125 CB ILE H 30 -2.198 99.478 2.202 1.00 17.28 C
-ATOM 12126 CG1 ILE H 30 -3.022 99.203 0.931 1.00 16.27 C
-ATOM 12127 CG2 ILE H 30 -2.210 100.933 2.540 1.00 16.70 C
-ATOM 12128 CD1 ILE H 30 -4.499 99.514 1.091 1.00 14.65 C
-ATOM 12129 H ILE H 30 -0.430 100.327 0.394 1.00 0.00 H
-ATOM 12130 HA ILE H 30 -0.247 99.172 3.011 1.00 0.00 H
-ATOM 12131 HB ILE H 30 -2.673 98.954 3.013 1.00 0.00 H
-ATOM 12132 1HG1 ILE H 30 -2.641 99.794 0.132 1.00 0.00 H
-ATOM 12133 2HG1 ILE H 30 -2.931 98.163 0.663 1.00 0.00 H
-ATOM 12134 1HG2 ILE H 30 -3.239 101.276 2.668 1.00 0.00 H
-ATOM 12135 2HG2 ILE H 30 -1.657 101.088 3.466 1.00 0.00 H
-ATOM 12136 3HG2 ILE H 30 -1.745 101.485 1.743 1.00 0.00 H
-ATOM 12137 1HD1 ILE H 30 -5.024 99.302 0.159 1.00 0.00 H
-ATOM 12138 2HD1 ILE H 30 -4.912 98.909 1.885 1.00 0.00 H
-ATOM 12139 3HD1 ILE H 30 -4.619 100.557 1.341 1.00 0.00 H
-ATOM 12140 N LYS H 37 -0.517 97.002 0.627 1.00 18.46 N
-ATOM 12141 CA LYS H 37 -0.430 95.564 0.355 1.00 18.97 C
-ATOM 12142 C LYS H 37 0.762 94.908 1.056 1.00 19.22 C
-ATOM 12143 O LYS H 37 0.784 93.698 1.255 1.00 20.46 O
-ATOM 12144 CB LYS H 37 -0.319 95.300 -1.149 1.00 19.34 C
-ATOM 12145 CG LYS H 37 1.026 95.701 -1.760 1.00 0.00 C
-ATOM 12146 CD LYS H 37 1.079 95.447 -3.245 1.00 0.00 C
-ATOM 12147 CE LYS H 37 2.399 95.950 -3.870 1.00 0.00 C
-ATOM 12148 NZ LYS H 37 3.619 95.206 -3.368 1.00 0.00 N
-ATOM 12149 H LYS H 37 -0.439 97.656 -0.136 1.00 0.00 H
-ATOM 12150 HA LYS H 37 -1.334 95.085 0.725 1.00 0.00 H
-ATOM 12151 1HB LYS H 37 -0.469 94.236 -1.345 1.00 0.00 H
-ATOM 12152 2HB LYS H 37 -1.098 95.845 -1.669 1.00 0.00 H
-ATOM 12153 1HG LYS H 37 1.218 96.733 -1.560 1.00 0.00 H
-ATOM 12154 2HG LYS H 37 1.817 95.118 -1.299 1.00 0.00 H
-ATOM 12155 1HD LYS H 37 0.982 94.375 -3.423 1.00 0.00 H
-ATOM 12156 2HD LYS H 37 0.248 95.956 -3.725 1.00 0.00 H
-ATOM 12157 1HE LYS H 37 2.337 95.831 -4.951 1.00 0.00 H
-ATOM 12158 2HE LYS H 37 2.518 97.006 -3.637 1.00 0.00 H
-ATOM 12159 1HZ LYS H 37 4.442 95.578 -3.810 1.00 0.00 H
-ATOM 12160 2HZ LYS H 37 3.725 95.310 -2.345 1.00 0.00 H
-ATOM 12161 3HZ LYS H 37 3.539 94.229 -3.581 1.00 0.00 H
-ATOM 12162 N ASP H 38 1.770 95.699 1.425 1.00 18.44 N
-ATOM 12163 CA ASP H 38 2.956 95.130 2.022 1.00 18.00 C
-ATOM 12164 C ASP H 38 2.841 95.027 3.543 1.00 17.11 C
-ATOM 12165 O ASP H 38 3.735 94.557 4.226 1.00 17.01 O
-ATOM 12166 CB ASP H 38 4.170 96.020 1.698 1.00 18.32 C
-ATOM 12167 CG ASP H 38 4.459 96.146 0.174 1.00 21.24 C
-ATOM 12168 OD1 ASP H 38 4.070 95.276 -0.586 1.00 21.88 O
-ATOM 12169 OD2 ASP H 38 5.058 97.136 -0.210 1.00 22.31 O
-ATOM 12170 H ASP H 38 1.710 96.704 1.303 1.00 0.00 H
-ATOM 12171 HA ASP H 38 3.114 94.131 1.618 1.00 0.00 H
-ATOM 12172 1HB ASP H 38 3.978 97.013 2.104 1.00 0.00 H
-ATOM 12173 2HB ASP H 38 5.051 95.621 2.200 1.00 0.00 H
-ATOM 12174 N THR H 39 1.748 95.589 4.085 1.00 16.36 N
-ATOM 12175 CA THR H 39 1.621 95.593 5.547 1.00 15.83 C
-ATOM 12176 C THR H 39 0.142 95.285 5.990 1.00 14.35 C
-ATOM 12177 O THR H 39 -0.739 95.054 5.183 1.00 14.47 O
-ATOM 12178 CB THR H 39 2.255 96.909 6.056 1.00 16.72 C
-ATOM 12179 OG1 THR H 39 3.707 96.788 5.831 1.00 17.24 O
-ATOM 12180 CG2 THR H 39 1.974 97.287 7.481 1.00 16.71 C
-ATOM 12181 H THR H 39 1.037 96.007 3.519 1.00 0.00 H
-ATOM 12182 HA THR H 39 2.219 94.791 5.939 1.00 0.00 H
-ATOM 12183 HB THR H 39 1.903 97.716 5.423 1.00 0.00 H
-ATOM 12184 HG1 THR H 39 3.872 96.011 5.258 1.00 0.00 H
-ATOM 12185 1HG2 THR H 39 2.474 98.200 7.701 1.00 0.00 H
-ATOM 12186 2HG2 THR H 39 0.921 97.452 7.633 1.00 0.00 H
-ATOM 12187 3HG2 THR H 39 2.325 96.516 8.130 1.00 0.00 H
-ATOM 12188 N TYR H 40 -0.061 95.257 7.305 1.00 12.45 N
-ATOM 12189 CA TYR H 40 -1.376 95.034 7.912 1.00 11.26 C
-ATOM 12190 C TYR H 40 -1.932 96.306 8.523 1.00 12.11 C
-ATOM 12191 O TYR H 40 -1.223 96.994 9.276 1.00 11.68 O
-ATOM 12192 CB TYR H 40 -1.221 93.977 8.973 1.00 10.32 C
-ATOM 12193 CG TYR H 40 -0.949 92.659 8.396 1.00 7.81 C
-ATOM 12194 CD1 TYR H 40 0.307 92.338 7.895 1.00 6.26 C
-ATOM 12195 CD2 TYR H 40 -1.953 91.749 8.385 1.00 6.14 C
-ATOM 12196 CE1 TYR H 40 0.532 91.093 7.363 1.00 5.28 C
-ATOM 12197 CE2 TYR H 40 -1.713 90.526 7.876 1.00 6.83 C
-ATOM 12198 CZ TYR H 40 -0.485 90.181 7.361 1.00 8.03 C
-ATOM 12199 OH TYR H 40 -0.281 88.921 6.860 1.00 9.83 O
-ATOM 12200 H TYR H 40 0.723 95.416 7.916 1.00 0.00 H
-ATOM 12201 HA TYR H 40 -2.068 94.701 7.132 1.00 0.00 H
-ATOM 12202 1HB TYR H 40 -0.411 94.255 9.627 1.00 0.00 H
-ATOM 12203 2HB TYR H 40 -2.130 93.912 9.551 1.00 0.00 H
-ATOM 12204 HD1 TYR H 40 1.106 93.071 7.910 1.00 0.00 H
-ATOM 12205 HD2 TYR H 40 -2.928 92.001 8.785 1.00 0.00 H
-ATOM 12206 HE1 TYR H 40 1.500 90.834 6.969 1.00 0.00 H
-ATOM 12207 HE2 TYR H 40 -2.515 89.814 7.884 1.00 0.00 H
-ATOM 12208 HH TYR H 40 -1.159 88.431 6.827 1.00 0.00 H
-ATOM 12209 N ILE H 41 -3.201 96.620 8.227 1.00 12.04 N
-ATOM 12210 CA ILE H 41 -3.819 97.845 8.734 1.00 11.71 C
-ATOM 12211 C ILE H 41 -4.862 97.543 9.794 1.00 12.46 C
-ATOM 12212 O ILE H 41 -5.760 96.709 9.612 1.00 13.47 O
-ATOM 12213 CB ILE H 41 -4.447 98.680 7.600 1.00 10.86 C
-ATOM 12214 CG1 ILE H 41 -3.394 98.942 6.482 1.00 9.95 C
-ATOM 12215 CG2 ILE H 41 -4.981 100.030 8.165 1.00 10.69 C
-ATOM 12216 CD1 ILE H 41 -2.150 99.684 6.946 1.00 7.37 C
-ATOM 12217 H ILE H 41 -3.751 95.995 7.635 1.00 0.00 H
-ATOM 12218 HA ILE H 41 -3.041 98.457 9.202 1.00 0.00 H
-ATOM 12219 HB ILE H 41 -5.272 98.120 7.153 1.00 0.00 H
-ATOM 12220 1HG1 ILE H 41 -3.083 97.981 6.059 1.00 0.00 H
-ATOM 12221 2HG1 ILE H 41 -3.861 99.528 5.689 1.00 0.00 H
-ATOM 12222 1HG2 ILE H 41 -5.413 100.610 7.363 1.00 0.00 H
-ATOM 12223 2HG2 ILE H 41 -5.739 99.863 8.930 1.00 0.00 H
-ATOM 12224 3HG2 ILE H 41 -4.154 100.595 8.603 1.00 0.00 H
-ATOM 12225 1HD1 ILE H 41 -1.481 99.814 6.099 1.00 0.00 H
-ATOM 12226 2HD1 ILE H 41 -2.426 100.661 7.352 1.00 0.00 H
-ATOM 12227 3HD1 ILE H 41 -1.653 99.102 7.718 1.00 0.00 H
-ATOM 12228 N HIS H 42 -4.742 98.235 10.912 1.00 12.35 N
-ATOM 12229 CA HIS H 42 -5.596 98.073 12.067 1.00 12.47 C
-ATOM 12230 C HIS H 42 -6.378 99.335 12.371 1.00 12.92 C
-ATOM 12231 O HIS H 42 -5.895 100.453 12.158 1.00 13.71 O
-ATOM 12232 CB HIS H 42 -4.756 97.787 13.312 1.00 12.03 C
-ATOM 12233 CG HIS H 42 -3.926 96.543 13.274 1.00 11.18 C
-ATOM 12234 ND1 HIS H 42 -4.259 95.394 13.962 1.00 11.19 N
-ATOM 12235 CD2 HIS H 42 -2.768 96.274 12.628 1.00 7.88 C
-ATOM 12236 CE1 HIS H 42 -3.325 94.474 13.750 1.00 10.90 C
-ATOM 12237 NE2 HIS H 42 -2.418 94.980 12.938 1.00 12.10 N
-ATOM 12238 H HIS H 42 -3.981 98.906 10.969 1.00 0.00 H
-ATOM 12239 HA HIS H 42 -6.305 97.262 11.909 1.00 0.00 H
-ATOM 12240 1HB HIS H 42 -4.088 98.628 13.476 1.00 0.00 H
-ATOM 12241 2HB HIS H 42 -5.417 97.743 14.187 1.00 0.00 H
-ATOM 12242 HD2 HIS H 42 -2.224 96.958 11.983 1.00 0.00 H
-ATOM 12243 HE1 HIS H 42 -3.312 93.462 14.164 1.00 0.00 H
-ATOM 12244 HE2 HIS H 42 -1.591 94.503 12.599 1.00 0.00 H
-ATOM 12245 N TRP H 43 -7.560 99.144 12.933 1.00 12.99 N
-ATOM 12246 CA TRP H 43 -8.319 100.233 13.501 1.00 12.45 C
-ATOM 12247 C TRP H 43 -8.411 100.019 14.999 1.00 12.56 C
-ATOM 12248 O TRP H 43 -8.771 98.922 15.461 1.00 13.25 O
-ATOM 12249 CB TRP H 43 -9.700 100.332 12.860 1.00 11.75 C
-ATOM 12250 CG TRP H 43 -9.637 100.795 11.436 1.00 13.27 C
-ATOM 12251 CD1 TRP H 43 -9.456 100.008 10.359 1.00 13.55 C
-ATOM 12252 CD2 TRP H 43 -9.747 102.152 10.933 1.00 12.89 C
-ATOM 12253 NE1 TRP H 43 -9.451 100.762 9.205 1.00 14.29 N
-ATOM 12254 CE2 TRP H 43 -9.630 102.081 9.540 1.00 13.28 C
-ATOM 12255 CE3 TRP H 43 -9.928 103.394 11.544 1.00 10.15 C
-ATOM 12256 CZ2 TRP H 43 -9.696 103.212 8.735 1.00 15.10 C
-ATOM 12257 CZ3 TRP H 43 -9.989 104.532 10.746 1.00 16.07 C
-ATOM 12258 CH2 TRP H 43 -9.879 104.445 9.376 1.00 14.75 C
-ATOM 12259 H TRP H 43 -7.926 98.203 13.002 1.00 0.00 H
-ATOM 12260 HA TRP H 43 -7.791 101.160 13.316 1.00 0.00 H
-ATOM 12261 1HB TRP H 43 -10.182 99.353 12.879 1.00 0.00 H
-ATOM 12262 2HB TRP H 43 -10.327 101.023 13.433 1.00 0.00 H
-ATOM 12263 HD1 TRP H 43 -9.329 98.939 10.413 1.00 0.00 H
-ATOM 12264 HE1 TRP H 43 -9.332 100.396 8.272 1.00 0.00 H
-ATOM 12265 HE3 TRP H 43 -10.012 103.463 12.626 1.00 0.00 H
-ATOM 12266 HZ2 TRP H 43 -9.609 103.162 7.645 1.00 0.00 H
-ATOM 12267 HZ3 TRP H 43 -10.126 105.494 11.238 1.00 0.00 H
-ATOM 12268 HH2 TRP H 43 -9.930 105.359 8.778 1.00 0.00 H
-ATOM 12269 N VAL H 44 -8.084 101.069 15.739 1.00 12.43 N
-ATOM 12270 CA VAL H 44 -8.097 101.146 17.199 1.00 12.88 C
-ATOM 12271 C VAL H 44 -8.936 102.344 17.589 1.00 13.06 C
-ATOM 12272 O VAL H 44 -8.859 103.373 16.933 1.00 12.95 O
-ATOM 12273 CB VAL H 44 -6.664 101.292 17.775 1.00 13.50 C
-ATOM 12274 CG1 VAL H 44 -6.707 101.445 19.304 1.00 14.48 C
-ATOM 12275 CG2 VAL H 44 -5.820 100.068 17.402 1.00 12.43 C
-ATOM 12276 H VAL H 44 -7.780 101.901 15.224 1.00 0.00 H
-ATOM 12277 HA VAL H 44 -8.560 100.246 17.601 1.00 0.00 H
-ATOM 12278 HB VAL H 44 -6.211 102.189 17.363 1.00 0.00 H
-ATOM 12279 1HG1 VAL H 44 -5.697 101.561 19.686 1.00 0.00 H
-ATOM 12280 2HG1 VAL H 44 -7.291 102.322 19.577 1.00 0.00 H
-ATOM 12281 3HG1 VAL H 44 -7.158 100.562 19.748 1.00 0.00 H
-ATOM 12282 1HG2 VAL H 44 -4.814 100.191 17.802 1.00 0.00 H
-ATOM 12283 2HG2 VAL H 44 -6.269 99.172 17.823 1.00 0.00 H
-ATOM 12284 3HG2 VAL H 44 -5.766 99.973 16.319 1.00 0.00 H
-ATOM 12285 N ARG H 45 -9.775 102.233 18.602 1.00 12.86 N
-ATOM 12286 CA ARG H 45 -10.564 103.398 18.952 1.00 12.91 C
-ATOM 12287 C ARG H 45 -10.427 103.766 20.412 1.00 13.49 C
-ATOM 12288 O ARG H 45 -10.070 102.945 21.256 1.00 14.04 O
-ATOM 12289 CB ARG H 45 -12.023 103.178 18.636 1.00 13.20 C
-ATOM 12290 CG ARG H 45 -12.709 102.160 19.501 1.00 12.66 C
-ATOM 12291 CD ARG H 45 -14.123 101.978 19.100 1.00 11.20 C
-ATOM 12292 NE ARG H 45 -14.803 101.050 19.954 1.00 12.97 N
-ATOM 12293 CZ ARG H 45 -16.087 100.697 19.824 1.00 12.81 C
-ATOM 12294 NH1 ARG H 45 -16.831 101.188 18.857 1.00 14.41 N
-ATOM 12295 NH2 ARG H 45 -16.591 99.849 20.694 1.00 9.49 N
-ATOM 12296 H ARG H 45 -9.848 101.374 19.127 1.00 0.00 H
-ATOM 12297 HA ARG H 45 -10.208 104.228 18.367 1.00 0.00 H
-ATOM 12298 1HB ARG H 45 -12.554 104.116 18.712 1.00 0.00 H
-ATOM 12299 2HB ARG H 45 -12.104 102.852 17.610 1.00 0.00 H
-ATOM 12300 1HG ARG H 45 -12.188 101.202 19.447 1.00 0.00 H
-ATOM 12301 2HG ARG H 45 -12.696 102.509 20.532 1.00 0.00 H
-ATOM 12302 1HD ARG H 45 -14.638 102.933 19.159 1.00 0.00 H
-ATOM 12303 2HD ARG H 45 -14.183 101.607 18.086 1.00 0.00 H
-ATOM 12304 HE ARG H 45 -14.281 100.619 20.732 1.00 0.00 H
-ATOM 12305 1HH1 ARG H 45 -16.455 101.849 18.178 1.00 0.00 H
-ATOM 12306 2HH1 ARG H 45 -17.818 100.919 18.787 1.00 0.00 H
-ATOM 12307 1HH2 ARG H 45 -15.979 99.495 21.440 1.00 0.00 H
-ATOM 12308 2HH2 ARG H 45 -17.557 99.560 20.633 1.00 0.00 H
-ATOM 12309 N GLN H 46 -10.701 105.027 20.707 1.00 13.31 N
-ATOM 12310 CA GLN H 46 -10.626 105.508 22.069 1.00 12.63 C
-ATOM 12311 C GLN H 46 -11.782 106.420 22.440 1.00 12.40 C
-ATOM 12312 O GLN H 46 -11.877 107.553 21.962 1.00 12.14 O
-ATOM 12313 CB GLN H 46 -9.304 106.233 22.210 1.00 11.87 C
-ATOM 12314 CG GLN H 46 -8.973 106.724 23.550 1.00 13.38 C
-ATOM 12315 CD GLN H 46 -7.551 107.182 23.575 1.00 16.40 C
-ATOM 12316 OE1 GLN H 46 -7.003 107.628 22.540 1.00 18.28 O
-ATOM 12317 NE2 GLN H 46 -6.922 107.067 24.735 1.00 13.42 N
-ATOM 12318 H GLN H 46 -10.946 105.664 19.957 1.00 0.00 H
-ATOM 12319 HA GLN H 46 -10.640 104.655 22.748 1.00 0.00 H
-ATOM 12320 1HB GLN H 46 -8.513 105.567 21.895 1.00 0.00 H
-ATOM 12321 2HB GLN H 46 -9.302 107.087 21.538 1.00 0.00 H
-ATOM 12322 1HG GLN H 46 -9.620 107.555 23.823 1.00 0.00 H
-ATOM 12323 2HG GLN H 46 -9.082 105.915 24.263 1.00 0.00 H
-ATOM 12324 1HE2 GLN H 46 -5.942 107.339 24.812 1.00 0.00 H
-ATOM 12325 2HE2 GLN H 46 -7.441 106.718 25.545 1.00 0.00 H
-ATOM 12326 N ALA H 47 -12.668 105.920 23.288 1.00 12.43 N
-ATOM 12327 CA ALA H 47 -13.814 106.699 23.722 1.00 12.89 C
-ATOM 12328 C ALA H 47 -13.261 107.849 24.548 1.00 14.25 C
-ATOM 12329 O ALA H 47 -12.198 107.681 25.145 1.00 15.21 O
-ATOM 12330 CB ALA H 47 -14.802 105.847 24.488 1.00 11.37 C
-ATOM 12331 H ALA H 47 -12.539 104.983 23.649 1.00 0.00 H
-ATOM 12332 HA ALA H 47 -14.321 107.081 22.851 1.00 0.00 H
-ATOM 12333 1HB ALA H 47 -15.655 106.447 24.799 1.00 0.00 H
-ATOM 12334 2HB ALA H 47 -15.152 105.036 23.843 1.00 0.00 H
-ATOM 12335 3HB ALA H 47 -14.322 105.435 25.349 1.00 0.00 H
-ATOM 12336 N PRO H 48 -13.884 109.029 24.588 1.00 15.30 N
-ATOM 12337 CA PRO H 48 -13.419 110.126 25.397 1.00 16.10 C
-ATOM 12338 C PRO H 48 -13.235 109.701 26.841 1.00 17.47 C
-ATOM 12339 O PRO H 48 -14.148 109.127 27.445 1.00 17.46 O
-ATOM 12340 CB PRO H 48 -14.559 111.140 25.241 1.00 15.84 C
-ATOM 12341 CG PRO H 48 -15.165 110.815 23.879 1.00 15.09 C
-ATOM 12342 CD PRO H 48 -15.088 109.309 23.779 1.00 15.56 C
-ATOM 12343 HA PRO H 48 -12.475 110.523 24.976 1.00 0.00 H
-ATOM 12344 1HB PRO H 48 -15.275 111.026 26.074 1.00 0.00 H
-ATOM 12345 2HB PRO H 48 -14.163 112.163 25.302 1.00 0.00 H
-ATOM 12346 1HG PRO H 48 -16.196 111.192 23.814 1.00 0.00 H
-ATOM 12347 2HG PRO H 48 -14.592 111.313 23.080 1.00 0.00 H
-ATOM 12348 1HD PRO H 48 -15.978 108.822 24.199 1.00 0.00 H
-ATOM 12349 2HD PRO H 48 -14.935 109.068 22.731 1.00 0.00 H
-ATOM 12350 N GLY H 49 -12.067 109.986 27.402 1.00 19.43 N
-ATOM 12351 CA GLY H 49 -11.753 109.652 28.792 1.00 20.52 C
-ATOM 12352 C GLY H 49 -11.331 108.191 29.013 1.00 21.55 C
-ATOM 12353 O GLY H 49 -11.047 107.796 30.144 1.00 22.32 O
-ATOM 12354 H GLY H 49 -11.359 110.446 26.847 1.00 0.00 H
-ATOM 12355 1HA GLY H 49 -10.961 110.312 29.144 1.00 0.00 H
-ATOM 12356 2HA GLY H 49 -12.628 109.863 29.406 1.00 0.00 H
-ATOM 12357 N LYS H 50 -11.294 107.391 27.945 1.00 21.12 N
-ATOM 12358 CA LYS H 50 -10.983 105.966 28.062 1.00 20.31 C
-ATOM 12359 C LYS H 50 -9.654 105.574 27.420 1.00 20.01 C
-ATOM 12360 O LYS H 50 -8.980 106.396 26.783 1.00 20.52 O
-ATOM 12361 CB LYS H 50 -12.110 105.137 27.459 1.00 20.70 C
-ATOM 12362 CG LYS H 50 -13.490 105.426 28.069 1.00 22.22 C
-ATOM 12363 CD LYS H 50 -13.571 105.092 29.554 1.00 26.33 C
-ATOM 12364 CE LYS H 50 -14.986 105.336 30.074 1.00 28.54 C
-ATOM 12365 NZ LYS H 50 -15.115 105.073 31.541 1.00 30.10 N
-ATOM 12366 H LYS H 50 -11.538 107.751 27.025 1.00 0.00 H
-ATOM 12367 HA LYS H 50 -10.913 105.719 29.120 1.00 0.00 H
-ATOM 12368 1HB LYS H 50 -12.159 105.333 26.388 1.00 0.00 H
-ATOM 12369 2HB LYS H 50 -11.900 104.078 27.585 1.00 0.00 H
-ATOM 12370 1HG LYS H 50 -13.731 106.481 27.915 1.00 0.00 H
-ATOM 12371 2HG LYS H 50 -14.234 104.826 27.562 1.00 0.00 H
-ATOM 12372 1HD LYS H 50 -13.296 104.050 29.717 1.00 0.00 H
-ATOM 12373 2HD LYS H 50 -12.881 105.729 30.112 1.00 0.00 H
-ATOM 12374 1HE LYS H 50 -15.250 106.377 29.881 1.00 0.00 H
-ATOM 12375 2HE LYS H 50 -15.680 104.684 29.536 1.00 0.00 H
-ATOM 12376 1HZ LYS H 50 -16.072 105.256 31.835 1.00 0.00 H
-ATOM 12377 2HZ LYS H 50 -14.878 104.105 31.735 1.00 0.00 H
-ATOM 12378 3HZ LYS H 50 -14.482 105.686 32.046 1.00 0.00 H
-ATOM 12379 N GLY H 51 -9.264 104.314 27.613 1.00 18.62 N
-ATOM 12380 CA GLY H 51 -8.047 103.779 27.026 1.00 17.34 C
-ATOM 12381 C GLY H 51 -8.289 103.289 25.602 1.00 17.14 C
-ATOM 12382 O GLY H 51 -9.352 103.518 25.030 1.00 17.13 O
-ATOM 12383 H GLY H 51 -9.846 103.701 28.173 1.00 0.00 H
-ATOM 12384 1HA GLY H 51 -7.282 104.551 27.014 1.00 0.00 H
-ATOM 12385 2HA GLY H 51 -7.670 102.959 27.638 1.00 0.00 H
-ATOM 12386 N LEU H 52 -7.300 102.608 25.042 1.00 16.72 N
-ATOM 12387 CA LEU H 52 -7.363 102.146 23.666 1.00 15.95 C
-ATOM 12388 C LEU H 52 -8.100 100.817 23.540 1.00 15.69 C
-ATOM 12389 O LEU H 52 -7.893 99.912 24.351 1.00 15.68 O
-ATOM 12390 CB LEU H 52 -5.928 101.973 23.165 1.00 14.82 C
-ATOM 12391 CG LEU H 52 -5.069 103.233 23.186 1.00 16.51 C
-ATOM 12392 CD1 LEU H 52 -3.648 102.865 22.854 1.00 17.64 C
-ATOM 12393 CD2 LEU H 52 -5.617 104.236 22.194 1.00 15.94 C
-ATOM 12394 H LEU H 52 -6.467 102.426 25.582 1.00 0.00 H
-ATOM 12395 HA LEU H 52 -7.884 102.892 23.062 1.00 0.00 H
-ATOM 12396 1HB LEU H 52 -5.441 101.246 23.798 1.00 0.00 H
-ATOM 12397 2HB LEU H 52 -5.952 101.590 22.151 1.00 0.00 H
-ATOM 12398 HG LEU H 52 -5.085 103.664 24.180 1.00 0.00 H
-ATOM 12399 1HD1 LEU H 52 -3.027 103.748 22.893 1.00 0.00 H
-ATOM 12400 2HD1 LEU H 52 -3.289 102.148 23.588 1.00 0.00 H
-ATOM 12401 3HD1 LEU H 52 -3.607 102.428 21.863 1.00 0.00 H
-ATOM 12402 1HD2 LEU H 52 -5.013 105.144 22.215 1.00 0.00 H
-ATOM 12403 2HD2 LEU H 52 -5.597 103.808 21.192 1.00 0.00 H
-ATOM 12404 3HD2 LEU H 52 -6.635 104.475 22.468 1.00 0.00 H
-ATOM 12405 N GLU H 53 -8.905 100.678 22.492 1.00 15.90 N
-ATOM 12406 CA GLU H 53 -9.602 99.431 22.224 1.00 15.67 C
-ATOM 12407 C GLU H 53 -9.453 99.028 20.765 1.00 15.21 C
-ATOM 12408 O GLU H 53 -9.724 99.807 19.854 1.00 14.90 O
-ATOM 12409 CB GLU H 53 -11.087 99.588 22.589 1.00 15.88 C
-ATOM 12410 CG GLU H 53 -11.947 98.356 22.375 1.00 18.95 C
-ATOM 12411 CD GLU H 53 -13.382 98.546 22.835 1.00 22.13 C
-ATOM 12412 OE1 GLU H 53 -14.074 99.379 22.280 1.00 24.92 O
-ATOM 12413 OE2 GLU H 53 -13.781 97.864 23.745 1.00 19.16 O
-ATOM 12414 H GLU H 53 -9.073 101.473 21.885 1.00 0.00 H
-ATOM 12415 HA GLU H 53 -9.167 98.643 22.836 1.00 0.00 H
-ATOM 12416 1HB GLU H 53 -11.169 99.864 23.642 1.00 0.00 H
-ATOM 12417 2HB GLU H 53 -11.516 100.404 22.005 1.00 0.00 H
-ATOM 12418 1HG GLU H 53 -11.948 98.108 21.311 1.00 0.00 H
-ATOM 12419 2HG GLU H 53 -11.502 97.522 22.915 1.00 0.00 H
-ATOM 12420 N TRP H 54 -9.020 97.812 20.521 1.00 14.74 N
-ATOM 12421 CA TRP H 54 -8.859 97.368 19.148 1.00 15.49 C
-ATOM 12422 C TRP H 54 -10.235 97.169 18.513 1.00 16.63 C
-ATOM 12423 O TRP H 54 -11.140 96.649 19.162 1.00 17.11 O
-ATOM 12424 CB TRP H 54 -8.043 96.088 19.138 1.00 15.04 C
-ATOM 12425 CG TRP H 54 -7.691 95.614 17.829 1.00 15.02 C
-ATOM 12426 CD1 TRP H 54 -6.587 95.967 17.109 1.00 14.04 C
-ATOM 12427 CD2 TRP H 54 -8.403 94.662 17.038 1.00 14.21 C
-ATOM 12428 NE1 TRP H 54 -6.557 95.275 15.933 1.00 12.57 N
-ATOM 12429 CE2 TRP H 54 -7.670 94.470 15.877 1.00 13.17 C
-ATOM 12430 CE3 TRP H 54 -9.588 93.954 17.218 1.00 13.57 C
-ATOM 12431 CZ2 TRP H 54 -8.073 93.593 14.919 1.00 14.64 C
-ATOM 12432 CZ3 TRP H 54 -9.978 93.080 16.229 1.00 16.02 C
-ATOM 12433 CH2 TRP H 54 -9.241 92.905 15.119 1.00 13.85 C
-ATOM 12434 H TRP H 54 -8.798 97.187 21.284 1.00 0.00 H
-ATOM 12435 HA TRP H 54 -8.325 98.127 18.584 1.00 0.00 H
-ATOM 12436 1HB TRP H 54 -7.116 96.239 19.693 1.00 0.00 H
-ATOM 12437 2HB TRP H 54 -8.599 95.298 19.639 1.00 0.00 H
-ATOM 12438 HD1 TRP H 54 -5.825 96.677 17.436 1.00 0.00 H
-ATOM 12439 HE1 TRP H 54 -5.823 95.344 15.222 1.00 0.00 H
-ATOM 12440 HE3 TRP H 54 -10.194 94.086 18.126 1.00 0.00 H
-ATOM 12441 HZ2 TRP H 54 -7.516 93.433 14.041 1.00 0.00 H
-ATOM 12442 HZ3 TRP H 54 -10.891 92.530 16.369 1.00 0.00 H
-ATOM 12443 HH2 TRP H 54 -9.580 92.217 14.377 1.00 0.00 H
-ATOM 12444 N VAL H 55 -10.389 97.584 17.254 1.00 17.15 N
-ATOM 12445 CA VAL H 55 -11.667 97.449 16.554 1.00 17.57 C
-ATOM 12446 C VAL H 55 -11.671 96.429 15.424 1.00 16.42 C
-ATOM 12447 O VAL H 55 -12.556 95.577 15.364 1.00 17.18 O
-ATOM 12448 CB VAL H 55 -12.066 98.803 15.940 1.00 17.51 C
-ATOM 12449 CG1 VAL H 55 -13.337 98.678 15.152 1.00 18.88 C
-ATOM 12450 CG2 VAL H 55 -12.242 99.794 17.014 1.00 20.25 C
-ATOM 12451 H VAL H 55 -9.613 98.014 16.767 1.00 0.00 H
-ATOM 12452 HA VAL H 55 -12.421 97.155 17.282 1.00 0.00 H
-ATOM 12453 HB VAL H 55 -11.286 99.125 15.263 1.00 0.00 H
-ATOM 12454 1HG1 VAL H 55 -13.580 99.640 14.722 1.00 0.00 H
-ATOM 12455 2HG1 VAL H 55 -13.214 97.951 14.361 1.00 0.00 H
-ATOM 12456 3HG1 VAL H 55 -14.132 98.366 15.819 1.00 0.00 H
-ATOM 12457 1HG2 VAL H 55 -12.506 100.742 16.571 1.00 0.00 H
-ATOM 12458 2HG2 VAL H 55 -13.036 99.455 17.684 1.00 0.00 H
-ATOM 12459 3HG2 VAL H 55 -11.313 99.894 17.570 1.00 0.00 H
-ATOM 12460 N ALA H 56 -10.747 96.568 14.477 1.00 15.74 N
-ATOM 12461 CA ALA H 56 -10.782 95.693 13.305 1.00 15.19 C
-ATOM 12462 C ALA H 56 -9.476 95.690 12.554 1.00 15.00 C
-ATOM 12463 O ALA H 56 -8.679 96.620 12.663 1.00 16.39 O
-ATOM 12464 CB ALA H 56 -11.900 96.112 12.348 1.00 14.61 C
-ATOM 12465 H ALA H 56 -10.025 97.271 14.597 1.00 0.00 H
-ATOM 12466 HA ALA H 56 -10.965 94.681 13.653 1.00 0.00 H
-ATOM 12467 1HB ALA H 56 -11.921 95.429 11.497 1.00 0.00 H
-ATOM 12468 2HB ALA H 56 -12.870 96.091 12.847 1.00 0.00 H
-ATOM 12469 3HB ALA H 56 -11.698 97.118 12.000 1.00 0.00 H
-ATOM 12470 N ARG H 57 -9.255 94.674 11.726 1.00 13.78 N
-ATOM 12471 CA ARG H 57 -8.090 94.773 10.852 1.00 12.51 C
-ATOM 12472 C ARG H 57 -8.298 94.093 9.520 1.00 11.99 C
-ATOM 12473 O ARG H 57 -9.164 93.229 9.348 1.00 12.58 O
-ATOM 12474 CB ARG H 57 -6.824 94.172 11.416 1.00 12.29 C
-ATOM 12475 CG ARG H 57 -6.768 92.625 11.497 1.00 9.73 C
-ATOM 12476 CD ARG H 57 -5.477 92.267 11.987 1.00 6.39 C
-ATOM 12477 NE ARG H 57 -5.125 90.863 11.751 1.00 12.08 N
-ATOM 12478 CZ ARG H 57 -3.851 90.456 11.726 1.00 9.14 C
-ATOM 12479 NH1 ARG H 57 -2.868 91.317 11.961 1.00 11.34 N
-ATOM 12480 NH2 ARG H 57 -3.529 89.173 11.499 1.00 8.35 N
-ATOM 12481 H ARG H 57 -9.910 93.897 11.681 1.00 0.00 H
-ATOM 12482 HA ARG H 57 -7.902 95.824 10.647 1.00 0.00 H
-ATOM 12483 1HB ARG H 57 -5.976 94.453 10.768 1.00 0.00 H
-ATOM 12484 2HB ARG H 57 -6.608 94.615 12.386 1.00 0.00 H
-ATOM 12485 1HG ARG H 57 -7.475 92.253 12.215 1.00 0.00 H
-ATOM 12486 2HG ARG H 57 -6.936 92.163 10.519 1.00 0.00 H
-ATOM 12487 1HD ARG H 57 -4.712 92.891 11.542 1.00 0.00 H
-ATOM 12488 2HD ARG H 57 -5.484 92.412 13.069 1.00 0.00 H
-ATOM 12489 HE ARG H 57 -5.838 90.183 11.546 1.00 0.00 H
-ATOM 12490 1HH1 ARG H 57 -1.881 91.557 12.101 1.00 0.00 H
-ATOM 12491 2HH1 ARG H 57 -2.205 90.618 11.768 1.00 0.00 H
-ATOM 12492 1HH2 ARG H 57 -4.296 88.498 11.275 1.00 0.00 H
-ATOM 12493 2HH2 ARG H 57 -2.578 88.824 11.467 1.00 0.00 H
-ATOM 12494 N ILE H 58 -7.452 94.502 8.585 1.00 11.18 N
-ATOM 12495 CA ILE H 58 -7.424 93.941 7.259 1.00 11.21 C
-ATOM 12496 C ILE H 58 -6.035 93.793 6.679 1.00 11.43 C
-ATOM 12497 O ILE H 58 -5.146 94.635 6.929 1.00 12.83 O
-ATOM 12498 CB ILE H 58 -8.275 94.789 6.302 1.00 10.35 C
-ATOM 12499 CG1 ILE H 58 -8.387 94.098 4.961 1.00 10.24 C
-ATOM 12500 CG2 ILE H 58 -7.660 96.173 6.116 1.00 11.19 C
-ATOM 12501 CD1 ILE H 58 -9.452 94.637 4.155 1.00 7.08 C
-ATOM 12502 H ILE H 58 -6.791 95.233 8.830 1.00 0.00 H
-ATOM 12503 HA ILE H 58 -7.878 92.947 7.305 1.00 0.00 H
-ATOM 12504 HB ILE H 58 -9.271 94.889 6.712 1.00 0.00 H
-ATOM 12505 1HG1 ILE H 58 -7.469 94.246 4.410 1.00 0.00 H
-ATOM 12506 2HG1 ILE H 58 -8.549 93.029 5.112 1.00 0.00 H
-ATOM 12507 1HG2 ILE H 58 -8.297 96.758 5.448 1.00 0.00 H
-ATOM 12508 2HG2 ILE H 58 -7.600 96.671 7.095 1.00 0.00 H
-ATOM 12509 3HG2 ILE H 58 -6.672 96.085 5.698 1.00 0.00 H
-ATOM 12510 1HD1 ILE H 58 -9.485 94.117 3.210 1.00 0.00 H
-ATOM 12511 2HD1 ILE H 58 -10.397 94.497 4.684 1.00 0.00 H
-ATOM 12512 3HD1 ILE H 58 -9.270 95.684 4.005 1.00 0.00 H
-ATOM 12513 N TYR H 59 -5.854 92.748 5.892 1.00 11.16 N
-ATOM 12514 CA TYR H 59 -4.646 92.521 5.105 1.00 11.23 C
-ATOM 12515 C TYR H 59 -4.923 92.781 3.629 1.00 10.88 C
-ATOM 12516 O TYR H 59 -5.215 91.767 2.921 1.00 10.72 O
-ATOM 12517 CB TYR H 59 -4.129 91.105 5.277 1.00 11.20 C
-ATOM 12518 CG TYR H 59 -2.771 90.927 4.638 1.00 14.23 C
-ATOM 12519 CD1 TYR H 59 -1.929 92.027 4.505 1.00 16.15 C
-ATOM 12520 CD2 TYR H 59 -2.348 89.693 4.212 1.00 15.83 C
-ATOM 12521 CE1 TYR H 59 -0.681 91.884 3.956 1.00 18.01 C
-ATOM 12522 CE2 TYR H 59 -1.097 89.541 3.659 1.00 16.72 C
-ATOM 12523 CZ TYR H 59 -0.261 90.629 3.535 1.00 16.44 C
-ATOM 12524 OH TYR H 59 0.988 90.465 2.992 1.00 16.77 O
-ATOM 12525 H TYR H 59 -6.628 92.091 5.816 1.00 0.00 H
-ATOM 12526 HA TYR H 59 -3.872 93.209 5.463 1.00 0.00 H
-ATOM 12527 1HB TYR H 59 -4.076 90.842 6.331 1.00 0.00 H
-ATOM 12528 2HB TYR H 59 -4.833 90.402 4.808 1.00 0.00 H
-ATOM 12529 HD1 TYR H 59 -2.261 93.003 4.842 1.00 0.00 H
-ATOM 12530 HD2 TYR H 59 -3.007 88.829 4.318 1.00 0.00 H
-ATOM 12531 HE1 TYR H 59 -0.022 92.754 3.852 1.00 0.00 H
-ATOM 12532 HE2 TYR H 59 -0.764 88.563 3.323 1.00 0.00 H
-ATOM 12533 HH TYR H 59 1.106 89.550 2.720 1.00 0.00 H
-ATOM 12534 N PRO H 60 -4.780 93.990 3.076 1.00 11.01 N
-ATOM 12535 CA PRO H 60 -5.304 94.419 1.767 1.00 11.14 C
-ATOM 12536 C PRO H 60 -4.830 93.501 0.637 1.00 11.82 C
-ATOM 12537 O PRO H 60 -5.539 93.409 -0.407 1.00 11.53 O
-ATOM 12538 CB PRO H 60 -4.583 95.789 1.630 1.00 11.52 C
-ATOM 12539 CG PRO H 60 -4.379 96.247 3.018 1.00 10.55 C
-ATOM 12540 CD PRO H 60 -4.049 95.032 3.800 1.00 10.55 C
-ATOM 12541 HA PRO H 60 -6.353 94.531 1.791 1.00 0.00 H
-ATOM 12542 1HB PRO H 60 -3.633 95.651 1.099 1.00 0.00 H
-ATOM 12543 2HB PRO H 60 -5.196 96.456 1.013 1.00 0.00 H
-ATOM 12544 1HG PRO H 60 -3.570 96.960 3.049 1.00 0.00 H
-ATOM 12545 2HG PRO H 60 -5.278 96.792 3.388 1.00 0.00 H
-ATOM 12546 1HD PRO H 60 -2.958 94.858 3.752 1.00 0.00 H
-ATOM 12547 2HD PRO H 60 -4.404 95.174 4.834 1.00 0.00 H
-ATOM 12548 N THR H 61 -3.736 92.782 0.780 1.00 12.45 N
-ATOM 12549 CA THR H 61 -3.211 91.842 -0.170 1.00 13.02 C
-ATOM 12550 C THR H 61 -4.216 90.764 -0.550 1.00 12.99 C
-ATOM 12551 O THR H 61 -4.293 90.337 -1.698 1.00 13.07 O
-ATOM 12552 CB THR H 61 -1.947 91.160 0.314 1.00 13.14 C
-ATOM 12553 OG1 THR H 61 -0.949 92.128 0.578 1.00 15.77 O
-ATOM 12554 CG2 THR H 61 -1.430 90.223 -0.699 1.00 14.37 C
-ATOM 12555 H THR H 61 -3.231 92.882 1.688 1.00 0.00 H
-ATOM 12556 HA THR H 61 -2.970 92.407 -1.085 1.00 0.00 H
-ATOM 12557 HB THR H 61 -2.155 90.593 1.227 1.00 0.00 H
-ATOM 12558 HG1 THR H 61 -1.091 92.524 1.444 1.00 0.00 H
-ATOM 12559 1HG2 THR H 61 -0.534 89.750 -0.330 1.00 0.00 H
-ATOM 12560 2HG2 THR H 61 -2.200 89.485 -0.894 1.00 0.00 H
-ATOM 12561 3HG2 THR H 61 -1.192 90.769 -1.636 1.00 0.00 H
-ATOM 12562 N ASN H 65 -4.948 90.265 0.451 1.00 12.51 N
-ATOM 12563 CA ASN H 65 -5.894 89.189 0.202 1.00 12.77 C
-ATOM 12564 C ASN H 65 -7.290 89.472 0.754 1.00 12.77 C
-ATOM 12565 O ASN H 65 -8.226 88.722 0.501 1.00 12.76 O
-ATOM 12566 CB ASN H 65 -5.327 87.907 0.733 1.00 12.65 C
-ATOM 12567 CG ASN H 65 -5.105 87.934 2.221 1.00 13.85 C
-ATOM 12568 OD1 ASN H 65 -5.730 88.661 3.013 1.00 14.46 O
-ATOM 12569 ND2 ASN H 65 -4.179 87.097 2.632 1.00 11.80 N
-ATOM 12570 H ASN H 65 -4.857 90.673 1.379 1.00 0.00 H
-ATOM 12571 HA ASN H 65 -6.011 89.093 -0.883 1.00 0.00 H
-ATOM 12572 1HB ASN H 65 -5.984 87.072 0.473 1.00 0.00 H
-ATOM 12573 2HB ASN H 65 -4.373 87.721 0.243 1.00 0.00 H
-ATOM 12574 1HD2 ASN H 65 -3.975 87.023 3.607 1.00 0.00 H
-ATOM 12575 2HD2 ASN H 65 -3.696 86.526 1.976 1.00 0.00 H
-ATOM 12576 N GLY H 66 -7.427 90.594 1.459 1.00 12.96 N
-ATOM 12577 CA GLY H 66 -8.720 91.031 1.968 1.00 13.54 C
-ATOM 12578 C GLY H 66 -9.250 90.233 3.158 1.00 13.54 C
-ATOM 12579 O GLY H 66 -10.448 90.270 3.429 1.00 13.70 O
-ATOM 12580 H GLY H 66 -6.606 91.142 1.691 1.00 0.00 H
-ATOM 12581 1HA GLY H 66 -8.632 92.080 2.253 1.00 0.00 H
-ATOM 12582 2HA GLY H 66 -9.451 90.993 1.165 1.00 0.00 H
-ATOM 12583 N TYR H 67 -8.389 89.522 3.868 1.00 13.18 N
-ATOM 12584 CA TYR H 67 -8.870 88.754 5.004 1.00 13.39 C
-ATOM 12585 C TYR H 67 -9.094 89.732 6.152 1.00 13.26 C
-ATOM 12586 O TYR H 67 -8.303 90.688 6.317 1.00 12.88 O
-ATOM 12587 CB TYR H 67 -7.901 87.650 5.398 1.00 13.22 C
-ATOM 12588 CG TYR H 67 -7.669 86.604 4.296 1.00 11.99 C
-ATOM 12589 CD1 TYR H 67 -6.637 85.698 4.425 1.00 10.02 C
-ATOM 12590 CD2 TYR H 67 -8.450 86.584 3.166 1.00 11.95 C
-ATOM 12591 CE1 TYR H 67 -6.374 84.769 3.453 1.00 8.57 C
-ATOM 12592 CE2 TYR H 67 -8.190 85.651 2.157 1.00 10.98 C
-ATOM 12593 CZ TYR H 67 -7.143 84.734 2.323 1.00 8.84 C
-ATOM 12594 OH TYR H 67 -6.863 83.771 1.344 1.00 6.70 O
-ATOM 12595 H TYR H 67 -7.406 89.488 3.591 1.00 0.00 H
-ATOM 12596 HA TYR H 67 -9.842 88.296 4.758 1.00 0.00 H
-ATOM 12597 1HB TYR H 67 -6.930 88.087 5.680 1.00 0.00 H
-ATOM 12598 2HB TYR H 67 -8.281 87.122 6.264 1.00 0.00 H
-ATOM 12599 HD1 TYR H 67 -6.017 85.714 5.310 1.00 0.00 H
-ATOM 12600 HD2 TYR H 67 -9.247 87.305 3.055 1.00 0.00 H
-ATOM 12601 HE1 TYR H 67 -5.558 84.068 3.576 1.00 0.00 H
-ATOM 12602 HE2 TYR H 67 -8.805 85.631 1.253 1.00 0.00 H
-ATOM 12603 HH TYR H 67 -7.683 83.378 1.023 1.00 0.00 H
-ATOM 12604 N THR H 68 -10.168 89.547 6.927 1.00 13.10 N
-ATOM 12605 CA THR H 68 -10.538 90.449 8.000 1.00 13.47 C
-ATOM 12606 C THR H 68 -10.961 89.833 9.348 1.00 13.49 C
-ATOM 12607 O THR H 68 -11.554 88.730 9.398 1.00 14.45 O
-ATOM 12608 CB THR H 68 -11.687 91.393 7.547 1.00 13.86 C
-ATOM 12609 OG1 THR H 68 -12.909 90.657 7.333 1.00 14.14 O
-ATOM 12610 CG2 THR H 68 -11.334 92.050 6.247 1.00 14.05 C
-ATOM 12611 H THR H 68 -10.762 88.736 6.721 1.00 0.00 H
-ATOM 12612 HA THR H 68 -9.662 91.068 8.231 1.00 0.00 H
-ATOM 12613 HB THR H 68 -11.849 92.134 8.296 1.00 0.00 H
-ATOM 12614 HG1 THR H 68 -12.838 90.166 6.494 1.00 0.00 H
-ATOM 12615 1HG2 THR H 68 -12.150 92.695 5.939 1.00 0.00 H
-ATOM 12616 2HG2 THR H 68 -10.430 92.609 6.381 1.00 0.00 H
-ATOM 12617 3HG2 THR H 68 -11.193 91.300 5.489 1.00 0.00 H
-ATOM 12618 N ARG H 69 -10.811 90.645 10.381 1.00 13.05 N
-ATOM 12619 CA ARG H 69 -11.291 90.500 11.749 1.00 13.10 C
-ATOM 12620 C ARG H 69 -11.924 91.742 12.360 1.00 13.62 C
-ATOM 12621 O ARG H 69 -11.496 92.877 12.075 1.00 14.83 O
-ATOM 12622 CB ARG H 69 -10.268 89.993 12.748 1.00 12.26 C
-ATOM 12623 CG ARG H 69 -10.126 88.552 12.954 1.00 11.97 C
-ATOM 12624 CD ARG H 69 -11.357 88.119 13.648 1.00 7.68 C
-ATOM 12625 NE ARG H 69 -11.213 87.086 14.650 1.00 8.39 N
-ATOM 12626 CZ ARG H 69 -10.965 87.445 15.956 1.00 11.90 C
-ATOM 12627 NH1 ARG H 69 -10.849 88.698 16.273 1.00 12.80 N
-ATOM 12628 NH2 ARG H 69 -10.902 86.545 16.919 1.00 10.07 N
-ATOM 12629 H ARG H 69 -10.289 91.503 10.180 1.00 0.00 H
-ATOM 12630 HA ARG H 69 -12.073 89.739 11.727 1.00 0.00 H
-ATOM 12631 1HB ARG H 69 -9.248 90.406 12.476 1.00 0.00 H
-ATOM 12632 2HB ARG H 69 -10.505 90.402 13.694 1.00 0.00 H
-ATOM 12633 1HG ARG H 69 -9.209 88.316 13.521 1.00 0.00 H
-ATOM 12634 2HG ARG H 69 -10.076 88.043 11.960 1.00 0.00 H
-ATOM 12635 1HD ARG H 69 -11.873 88.972 14.157 1.00 0.00 H
-ATOM 12636 2HD ARG H 69 -12.056 87.718 12.855 1.00 0.00 H
-ATOM 12637 HE ARG H 69 -11.320 86.097 14.436 1.00 0.00 H
-ATOM 12638 1HH1 ARG H 69 -11.242 88.880 17.175 1.00 0.00 H
-ATOM 12639 2HH1 ARG H 69 -10.220 88.903 17.065 1.00 0.00 H
-ATOM 12640 1HH2 ARG H 69 -11.061 85.555 16.743 1.00 0.00 H
-ATOM 12641 2HH2 ARG H 69 -10.722 86.863 17.870 1.00 0.00 H
-ATOM 12642 N TYR H 70 -12.910 91.512 13.230 1.00 13.71 N
-ATOM 12643 CA TYR H 70 -13.642 92.539 13.972 1.00 13.88 C
-ATOM 12644 C TYR H 70 -13.667 92.191 15.458 1.00 15.18 C
-ATOM 12645 O TYR H 70 -13.814 91.014 15.813 1.00 15.77 O
-ATOM 12646 CB TYR H 70 -15.048 92.581 13.430 1.00 12.22 C
-ATOM 12647 CG TYR H 70 -15.027 92.705 11.971 1.00 11.17 C
-ATOM 12648 CD1 TYR H 70 -15.057 93.924 11.360 1.00 11.48 C
-ATOM 12649 CD2 TYR H 70 -14.926 91.544 11.224 1.00 11.07 C
-ATOM 12650 CE1 TYR H 70 -14.981 93.987 10.020 1.00 8.97 C
-ATOM 12651 CE2 TYR H 70 -14.850 91.610 9.881 1.00 8.93 C
-ATOM 12652 CZ TYR H 70 -14.871 92.812 9.261 1.00 10.65 C
-ATOM 12653 OH TYR H 70 -14.767 92.855 7.888 1.00 11.93 O
-ATOM 12654 H TYR H 70 -13.184 90.546 13.379 1.00 0.00 H
-ATOM 12655 HA TYR H 70 -13.156 93.501 13.846 1.00 0.00 H
-ATOM 12656 1HB TYR H 70 -15.579 91.674 13.678 1.00 0.00 H
-ATOM 12657 2HB TYR H 70 -15.569 93.423 13.830 1.00 0.00 H
-ATOM 12658 HD1 TYR H 70 -15.134 94.835 11.943 1.00 0.00 H
-ATOM 12659 HD2 TYR H 70 -14.895 90.580 11.733 1.00 0.00 H
-ATOM 12660 HE1 TYR H 70 -14.999 94.946 9.554 1.00 0.00 H
-ATOM 12661 HE2 TYR H 70 -14.757 90.700 9.301 1.00 0.00 H
-ATOM 12662 HH TYR H 70 -14.242 92.065 7.590 1.00 0.00 H
-ATOM 12663 N ALA H 71 -13.569 93.188 16.326 1.00 15.05 N
-ATOM 12664 CA ALA H 71 -13.683 92.949 17.766 1.00 15.00 C
-ATOM 12665 C ALA H 71 -15.066 92.390 18.050 1.00 15.29 C
-ATOM 12666 O ALA H 71 -16.027 92.787 17.389 1.00 15.59 O
-ATOM 12667 CB ALA H 71 -13.445 94.223 18.556 1.00 15.00 C
-ATOM 12668 H ALA H 71 -13.405 94.132 15.976 1.00 0.00 H
-ATOM 12669 HA ALA H 71 -12.949 92.199 18.069 1.00 0.00 H
-ATOM 12670 1HB ALA H 71 -13.532 93.994 19.612 1.00 0.00 H
-ATOM 12671 2HB ALA H 71 -12.440 94.586 18.344 1.00 0.00 H
-ATOM 12672 3HB ALA H 71 -14.154 94.989 18.286 1.00 0.00 H
-ATOM 12673 N ASP H 72 -15.184 91.546 19.067 1.00 16.19 N
-ATOM 12674 CA ASP H 72 -16.491 90.965 19.397 1.00 16.08 C
-ATOM 12675 C ASP H 72 -17.578 92.022 19.615 1.00 16.14 C
-ATOM 12676 O ASP H 72 -18.746 91.780 19.318 1.00 17.17 O
-ATOM 12677 CB ASP H 72 -16.413 90.088 20.664 1.00 16.34 C
-ATOM 12678 CG ASP H 72 -15.702 88.743 20.473 1.00 18.65 C
-ATOM 12679 OD1 ASP H 72 -15.394 88.120 21.462 1.00 17.90 O
-ATOM 12680 OD2 ASP H 72 -15.492 88.346 19.356 1.00 20.19 O
-ATOM 12681 H ASP H 72 -14.370 91.270 19.594 1.00 0.00 H
-ATOM 12682 HA ASP H 72 -16.796 90.334 18.568 1.00 0.00 H
-ATOM 12683 1HB ASP H 72 -15.897 90.635 21.452 1.00 0.00 H
-ATOM 12684 2HB ASP H 72 -17.425 89.885 21.028 1.00 0.00 H
-ATOM 12685 N SER H 73 -17.198 93.194 20.119 1.00 15.96 N
-ATOM 12686 CA SER H 73 -18.167 94.254 20.379 1.00 15.25 C
-ATOM 12687 C SER H 73 -18.669 94.972 19.117 1.00 15.47 C
-ATOM 12688 O SER H 73 -19.638 95.735 19.196 1.00 15.14 O
-ATOM 12689 CB SER H 73 -17.591 95.291 21.329 1.00 15.40 C
-ATOM 12690 OG SER H 73 -16.556 96.028 20.737 1.00 15.23 O
-ATOM 12691 H SER H 73 -16.224 93.348 20.339 1.00 0.00 H
-ATOM 12692 HA SER H 73 -19.031 93.800 20.864 1.00 0.00 H
-ATOM 12693 1HB SER H 73 -18.389 95.968 21.633 1.00 0.00 H
-ATOM 12694 2HB SER H 73 -17.222 94.798 22.224 1.00 0.00 H
-ATOM 12695 HG SER H 73 -15.832 95.418 20.600 1.00 0.00 H
-ATOM 12696 N VAL H 74 -18.010 94.779 17.969 1.00 15.57 N
-ATOM 12697 CA VAL H 74 -18.445 95.455 16.750 1.00 15.93 C
-ATOM 12698 C VAL H 74 -18.724 94.444 15.639 1.00 16.68 C
-ATOM 12699 O VAL H 74 -19.287 94.788 14.589 1.00 16.62 O
-ATOM 12700 CB VAL H 74 -17.402 96.482 16.289 1.00 16.00 C
-ATOM 12701 CG1 VAL H 74 -17.178 97.535 17.391 1.00 15.70 C
-ATOM 12702 CG2 VAL H 74 -16.111 95.785 15.875 1.00 16.22 C
-ATOM 12703 H VAL H 74 -17.225 94.138 17.927 1.00 0.00 H
-ATOM 12704 HA VAL H 74 -19.372 95.986 16.960 1.00 0.00 H
-ATOM 12705 HB VAL H 74 -17.801 96.999 15.458 1.00 0.00 H
-ATOM 12706 1HG1 VAL H 74 -16.472 98.285 17.051 1.00 0.00 H
-ATOM 12707 2HG1 VAL H 74 -18.125 98.027 17.632 1.00 0.00 H
-ATOM 12708 3HG1 VAL H 74 -16.787 97.058 18.281 1.00 0.00 H
-ATOM 12709 1HG2 VAL H 74 -15.394 96.517 15.532 1.00 0.00 H
-ATOM 12710 2HG2 VAL H 74 -15.702 95.250 16.711 1.00 0.00 H
-ATOM 12711 3HG2 VAL H 74 -16.327 95.094 15.073 1.00 0.00 H
-ATOM 12712 N LYS H 75 -18.328 93.198 15.875 1.00 18.16 N
-ATOM 12713 CA LYS H 75 -18.533 92.135 14.912 1.00 19.24 C
-ATOM 12714 C LYS H 75 -20.015 91.970 14.625 1.00 18.46 C
-ATOM 12715 O LYS H 75 -20.837 91.961 15.542 1.00 18.63 O
-ATOM 12716 CB LYS H 75 -17.931 90.817 15.396 1.00 20.66 C
-ATOM 12717 CG LYS H 75 -18.046 89.686 14.382 1.00 24.17 C
-ATOM 12718 CD LYS H 75 -17.351 88.430 14.863 1.00 28.10 C
-ATOM 12719 CE LYS H 75 -17.513 87.302 13.863 1.00 32.19 C
-ATOM 12720 NZ LYS H 75 -16.934 86.042 14.358 1.00 32.73 N
-ATOM 12721 H LYS H 75 -17.846 92.986 16.746 1.00 0.00 H
-ATOM 12722 HA LYS H 75 -18.047 92.420 13.978 1.00 0.00 H
-ATOM 12723 1HB LYS H 75 -16.871 90.954 15.638 1.00 0.00 H
-ATOM 12724 2HB LYS H 75 -18.429 90.509 16.314 1.00 0.00 H
-ATOM 12725 1HG LYS H 75 -19.103 89.457 14.225 1.00 0.00 H
-ATOM 12726 2HG LYS H 75 -17.614 89.997 13.430 1.00 0.00 H
-ATOM 12727 1HD LYS H 75 -16.285 88.644 14.991 1.00 0.00 H
-ATOM 12728 2HD LYS H 75 -17.758 88.125 15.828 1.00 0.00 H
-ATOM 12729 1HE LYS H 75 -18.572 87.149 13.664 1.00 0.00 H
-ATOM 12730 2HE LYS H 75 -17.009 87.573 12.935 1.00 0.00 H
-ATOM 12731 1HZ LYS H 75 -17.063 85.320 13.661 1.00 0.00 H
-ATOM 12732 2HZ LYS H 75 -15.949 86.168 14.538 1.00 0.00 H
-ATOM 12733 3HZ LYS H 75 -17.403 85.777 15.215 1.00 0.00 H
-ATOM 12734 N GLY H 76 -20.358 91.878 13.347 1.00 17.61 N
-ATOM 12735 CA GLY H 76 -21.743 91.750 12.902 1.00 16.37 C
-ATOM 12736 C GLY H 76 -22.320 93.109 12.508 1.00 16.10 C
-ATOM 12737 O GLY H 76 -23.365 93.184 11.862 1.00 15.42 O
-ATOM 12738 H GLY H 76 -19.629 91.896 12.647 1.00 0.00 H
-ATOM 12739 1HA GLY H 76 -21.789 91.074 12.048 1.00 0.00 H
-ATOM 12740 2HA GLY H 76 -22.346 91.309 13.697 1.00 0.00 H
-ATOM 12741 N ARG H 77 -21.616 94.181 12.874 1.00 16.05 N
-ATOM 12742 CA ARG H 77 -22.032 95.536 12.543 1.00 15.90 C
-ATOM 12743 C ARG H 77 -20.992 96.233 11.666 1.00 16.27 C
-ATOM 12744 O ARG H 77 -21.338 97.041 10.801 1.00 16.99 O
-ATOM 12745 CB ARG H 77 -22.231 96.359 13.801 1.00 15.64 C
-ATOM 12746 CG ARG H 77 -23.383 95.953 14.684 1.00 14.36 C
-ATOM 12747 CD ARG H 77 -23.567 96.955 15.761 1.00 14.12 C
-ATOM 12748 NE ARG H 77 -22.443 96.973 16.677 1.00 15.67 N
-ATOM 12749 CZ ARG H 77 -21.928 98.099 17.217 1.00 15.01 C
-ATOM 12750 NH1 ARG H 77 -22.442 99.273 16.927 1.00 10.45 N
-ATOM 12751 NH2 ARG H 77 -20.892 98.041 18.039 1.00 11.54 N
-ATOM 12752 H ARG H 77 -20.771 94.063 13.423 1.00 0.00 H
-ATOM 12753 HA ARG H 77 -22.977 95.496 11.999 1.00 0.00 H
-ATOM 12754 1HB ARG H 77 -21.330 96.303 14.413 1.00 0.00 H
-ATOM 12755 2HB ARG H 77 -22.366 97.396 13.537 1.00 0.00 H
-ATOM 12756 1HG ARG H 77 -24.296 95.895 14.091 1.00 0.00 H
-ATOM 12757 2HG ARG H 77 -23.174 94.982 15.140 1.00 0.00 H
-ATOM 12758 1HD ARG H 77 -23.656 97.949 15.318 1.00 0.00 H
-ATOM 12759 2HD ARG H 77 -24.469 96.727 16.323 1.00 0.00 H
-ATOM 12760 HE ARG H 77 -22.017 96.089 16.927 1.00 0.00 H
-ATOM 12761 1HH1 ARG H 77 -23.253 99.375 16.308 1.00 0.00 H
-ATOM 12762 2HH1 ARG H 77 -22.025 100.106 17.340 1.00 0.00 H
-ATOM 12763 1HH2 ARG H 77 -20.468 97.140 18.295 1.00 0.00 H
-ATOM 12764 2HH2 ARG H 77 -20.497 98.914 18.419 1.00 0.00 H
-ATOM 12765 N PHE H 78 -19.711 95.936 11.898 1.00 16.93 N
-ATOM 12766 CA PHE H 78 -18.655 96.587 11.125 1.00 16.85 C
-ATOM 12767 C PHE H 78 -18.151 95.680 9.995 1.00 16.89 C
-ATOM 12768 O PHE H 78 -18.055 94.467 10.145 1.00 16.80 O
-ATOM 12769 CB PHE H 78 -17.454 96.969 12.008 1.00 16.45 C
-ATOM 12770 CG PHE H 78 -17.679 98.089 13.019 1.00 16.18 C
-ATOM 12771 CD1 PHE H 78 -18.950 98.560 13.350 1.00 15.58 C
-ATOM 12772 CD2 PHE H 78 -16.590 98.668 13.653 1.00 16.04 C
-ATOM 12773 CE1 PHE H 78 -19.123 99.553 14.289 1.00 17.19 C
-ATOM 12774 CE2 PHE H 78 -16.764 99.674 14.589 1.00 17.01 C
-ATOM 12775 CZ PHE H 78 -18.037 100.109 14.911 1.00 17.15 C
-ATOM 12776 H PHE H 78 -19.474 95.296 12.648 1.00 0.00 H
-ATOM 12777 HA PHE H 78 -19.054 97.491 10.677 1.00 0.00 H
-ATOM 12778 1HB PHE H 78 -17.146 96.088 12.568 1.00 0.00 H
-ATOM 12779 2HB PHE H 78 -16.617 97.248 11.371 1.00 0.00 H
-ATOM 12780 HD1 PHE H 78 -19.811 98.146 12.877 1.00 0.00 H
-ATOM 12781 HD2 PHE H 78 -15.592 98.318 13.407 1.00 0.00 H
-ATOM 12782 HE1 PHE H 78 -20.130 99.902 14.535 1.00 0.00 H
-ATOM 12783 HE2 PHE H 78 -15.905 100.116 15.079 1.00 0.00 H
-ATOM 12784 HZ PHE H 78 -18.181 100.897 15.651 1.00 0.00 H
-ATOM 12785 N THR H 79 -17.803 96.323 8.880 1.00 16.70 N
-ATOM 12786 CA THR H 79 -17.141 95.680 7.743 1.00 16.68 C
-ATOM 12787 C THR H 79 -15.878 96.464 7.378 1.00 16.34 C
-ATOM 12788 O THR H 79 -15.915 97.681 7.266 1.00 16.06 O
-ATOM 12789 CB THR H 79 -18.082 95.567 6.529 1.00 16.20 C
-ATOM 12790 OG1 THR H 79 -19.199 94.734 6.870 1.00 16.84 O
-ATOM 12791 CG2 THR H 79 -17.340 94.978 5.345 1.00 16.33 C
-ATOM 12792 H THR H 79 -17.979 97.320 8.828 1.00 0.00 H
-ATOM 12793 HA THR H 79 -16.851 94.673 8.025 1.00 0.00 H
-ATOM 12794 HB THR H 79 -18.455 96.553 6.265 1.00 0.00 H
-ATOM 12795 HG1 THR H 79 -18.876 93.920 7.279 1.00 0.00 H
-ATOM 12796 1HG2 THR H 79 -18.016 94.896 4.488 1.00 0.00 H
-ATOM 12797 2HG2 THR H 79 -16.500 95.622 5.072 1.00 0.00 H
-ATOM 12798 3HG2 THR H 79 -16.967 93.990 5.611 1.00 0.00 H
-ATOM 12799 N ILE H 80 -14.762 95.778 7.191 1.00 15.88 N
-ATOM 12800 CA ILE H 80 -13.526 96.489 6.866 1.00 16.44 C
-ATOM 12801 C ILE H 80 -13.075 96.058 5.475 1.00 17.26 C
-ATOM 12802 O ILE H 80 -13.267 94.906 5.084 1.00 17.90 O
-ATOM 12803 CB ILE H 80 -12.430 96.214 7.911 1.00 15.83 C
-ATOM 12804 CG1 ILE H 80 -11.265 97.099 7.711 1.00 14.24 C
-ATOM 12805 CG2 ILE H 80 -11.962 94.872 7.787 1.00 17.72 C
-ATOM 12806 CD1 ILE H 80 -10.328 97.004 8.811 1.00 9.69 C
-ATOM 12807 H ILE H 80 -14.760 94.767 7.303 1.00 0.00 H
-ATOM 12808 HA ILE H 80 -13.717 97.558 6.841 1.00 0.00 H
-ATOM 12809 HB ILE H 80 -12.829 96.373 8.911 1.00 0.00 H
-ATOM 12810 1HG1 ILE H 80 -10.761 96.850 6.780 1.00 0.00 H
-ATOM 12811 2HG1 ILE H 80 -11.589 98.119 7.679 1.00 0.00 H
-ATOM 12812 1HG2 ILE H 80 -11.193 94.675 8.528 1.00 0.00 H
-ATOM 12813 2HG2 ILE H 80 -12.769 94.202 7.930 1.00 0.00 H
-ATOM 12814 3HG2 ILE H 80 -11.559 94.762 6.791 1.00 0.00 H
-ATOM 12815 1HD1 ILE H 80 -9.494 97.670 8.613 1.00 0.00 H
-ATOM 12816 2HD1 ILE H 80 -10.823 97.278 9.740 1.00 0.00 H
-ATOM 12817 3HD1 ILE H 80 -9.991 95.994 8.866 1.00 0.00 H
-ATOM 12818 N SER H 81 -12.543 97.000 4.708 1.00 18.40 N
-ATOM 12819 CA SER H 81 -12.126 96.726 3.341 1.00 19.49 C
-ATOM 12820 C SER H 81 -10.922 97.576 2.955 1.00 19.98 C
-ATOM 12821 O SER H 81 -10.445 98.382 3.754 1.00 20.15 O
-ATOM 12822 CB SER H 81 -13.292 96.952 2.399 1.00 19.41 C
-ATOM 12823 OG SER H 81 -13.659 98.299 2.354 1.00 19.80 O
-ATOM 12824 H SER H 81 -12.415 97.934 5.094 1.00 0.00 H
-ATOM 12825 HA SER H 81 -11.845 95.678 3.269 1.00 0.00 H
-ATOM 12826 1HB SER H 81 -13.034 96.601 1.402 1.00 0.00 H
-ATOM 12827 2HB SER H 81 -14.142 96.362 2.748 1.00 0.00 H
-ATOM 12828 HG SER H 81 -13.862 98.546 3.263 1.00 0.00 H
-ATOM 12829 N ALA H 82 -10.385 97.362 1.764 1.00 21.08 N
-ATOM 12830 CA ALA H 82 -9.243 98.165 1.339 1.00 21.24 C
-ATOM 12831 C ALA H 82 -9.152 98.227 -0.173 1.00 21.71 C
-ATOM 12832 O ALA H 82 -9.589 97.313 -0.874 1.00 22.22 O
-ATOM 12833 CB ALA H 82 -7.952 97.598 1.906 1.00 21.29 C
-ATOM 12834 H ALA H 82 -10.785 96.677 1.141 1.00 0.00 H
-ATOM 12835 HA ALA H 82 -9.380 99.175 1.706 1.00 0.00 H
-ATOM 12836 1HB ALA H 82 -7.128 98.229 1.589 1.00 0.00 H
-ATOM 12837 2HB ALA H 82 -7.993 97.580 2.991 1.00 0.00 H
-ATOM 12838 3HB ALA H 82 -7.808 96.589 1.533 1.00 0.00 H
-ATOM 12839 N ASP H 83 -8.552 99.304 -0.659 1.00 21.71 N
-ATOM 12840 CA ASP H 83 -8.313 99.492 -2.081 1.00 21.25 C
-ATOM 12841 C ASP H 83 -6.838 99.681 -2.368 1.00 21.38 C
-ATOM 12842 O ASP H 83 -6.272 100.771 -2.171 1.00 21.55 O
-ATOM 12843 CB ASP H 83 -9.162 100.645 -2.623 1.00 20.84 C
-ATOM 12844 CG ASP H 83 -8.976 100.912 -4.128 1.00 21.05 C
-ATOM 12845 OD1 ASP H 83 -7.913 100.600 -4.648 1.00 19.86 O
-ATOM 12846 OD2 ASP H 83 -9.898 101.447 -4.747 1.00 21.18 O
-ATOM 12847 H ASP H 83 -8.235 100.020 -0.012 1.00 0.00 H
-ATOM 12848 HA ASP H 83 -8.632 98.585 -2.596 1.00 0.00 H
-ATOM 12849 1HB ASP H 83 -10.214 100.439 -2.429 1.00 0.00 H
-ATOM 12850 2HB ASP H 83 -8.905 101.553 -2.077 1.00 0.00 H
-ATOM 12851 N THR H 84 -6.208 98.616 -2.847 1.00 21.51 N
-ATOM 12852 CA THR H 84 -4.785 98.582 -3.122 1.00 21.38 C
-ATOM 12853 C THR H 84 -4.361 99.672 -4.106 1.00 21.07 C
-ATOM 12854 O THR H 84 -3.321 100.297 -3.937 1.00 20.99 O
-ATOM 12855 CB THR H 84 -4.360 97.217 -3.685 1.00 21.68 C
-ATOM 12856 OG1 THR H 84 -4.674 96.180 -2.750 1.00 22.15 O
-ATOM 12857 CG2 THR H 84 -2.861 97.200 -3.963 1.00 23.09 C
-ATOM 12858 H THR H 84 -6.756 97.771 -2.999 1.00 0.00 H
-ATOM 12859 HA THR H 84 -4.250 98.750 -2.185 1.00 0.00 H
-ATOM 12860 HB THR H 84 -4.898 97.024 -4.620 1.00 0.00 H
-ATOM 12861 HG1 THR H 84 -4.212 96.339 -1.925 1.00 0.00 H
-ATOM 12862 1HG2 THR H 84 -2.577 96.229 -4.365 1.00 0.00 H
-ATOM 12863 2HG2 THR H 84 -2.610 97.981 -4.683 1.00 0.00 H
-ATOM 12864 3HG2 THR H 84 -2.322 97.382 -3.030 1.00 0.00 H
-ATOM 12865 N SER H 85 -5.156 99.869 -5.176 1.00 20.18 N
-ATOM 12866 CA SER H 85 -4.788 100.832 -6.224 1.00 19.46 C
-ATOM 12867 C SER H 85 -4.876 102.281 -5.734 1.00 18.91 C
-ATOM 12868 O SER H 85 -4.162 103.150 -6.222 1.00 19.30 O
-ATOM 12869 CB SER H 85 -5.668 100.638 -7.452 1.00 19.67 C
-ATOM 12870 OG SER H 85 -6.986 101.048 -7.211 1.00 20.42 O
-ATOM 12871 H SER H 85 -6.029 99.369 -5.251 1.00 0.00 H
-ATOM 12872 HA SER H 85 -3.752 100.641 -6.511 1.00 0.00 H
-ATOM 12873 1HB SER H 85 -5.259 101.191 -8.291 1.00 0.00 H
-ATOM 12874 2HB SER H 85 -5.660 99.582 -7.721 1.00 0.00 H
-ATOM 12875 HG SER H 85 -7.223 100.773 -6.302 1.00 0.00 H
-ATOM 12876 N LYS H 86 -5.722 102.519 -4.723 1.00 17.60 N
-ATOM 12877 CA LYS H 86 -5.815 103.850 -4.117 1.00 16.76 C
-ATOM 12878 C LYS H 86 -4.854 103.951 -2.939 1.00 16.27 C
-ATOM 12879 O LYS H 86 -4.494 105.047 -2.500 1.00 16.41 O
-ATOM 12880 CB LYS H 86 -7.233 104.153 -3.646 1.00 16.44 C
-ATOM 12881 CG LYS H 86 -8.250 104.274 -4.763 1.00 15.41 C
-ATOM 12882 CD LYS H 86 -9.620 104.659 -4.215 1.00 14.58 C
-ATOM 12883 CE LYS H 86 -10.660 104.702 -5.304 1.00 13.20 C
-ATOM 12884 NZ LYS H 86 -11.123 103.328 -5.662 1.00 11.10 N
-ATOM 12885 H LYS H 86 -6.334 101.766 -4.406 1.00 0.00 H
-ATOM 12886 HA LYS H 86 -5.528 104.594 -4.855 1.00 0.00 H
-ATOM 12887 1HB LYS H 86 -7.563 103.361 -2.976 1.00 0.00 H
-ATOM 12888 2HB LYS H 86 -7.237 105.082 -3.076 1.00 0.00 H
-ATOM 12889 1HG LYS H 86 -7.923 105.038 -5.467 1.00 0.00 H
-ATOM 12890 2HG LYS H 86 -8.316 103.329 -5.301 1.00 0.00 H
-ATOM 12891 1HD LYS H 86 -9.930 103.898 -3.498 1.00 0.00 H
-ATOM 12892 2HD LYS H 86 -9.575 105.623 -3.705 1.00 0.00 H
-ATOM 12893 1HE LYS H 86 -11.511 105.291 -4.967 1.00 0.00 H
-ATOM 12894 2HE LYS H 86 -10.226 105.170 -6.191 1.00 0.00 H
-ATOM 12895 1HZ LYS H 86 -11.814 103.370 -6.393 1.00 0.00 H
-ATOM 12896 2HZ LYS H 86 -10.331 102.750 -5.969 1.00 0.00 H
-ATOM 12897 3HZ LYS H 86 -11.516 102.881 -4.845 1.00 0.00 H
-ATOM 12898 N ASN H 87 -4.425 102.790 -2.458 1.00 15.81 N
-ATOM 12899 CA ASN H 87 -3.546 102.633 -1.313 1.00 15.26 C
-ATOM 12900 C ASN H 87 -4.235 103.195 -0.068 1.00 15.26 C
-ATOM 12901 O ASN H 87 -3.627 103.931 0.715 1.00 15.11 O
-ATOM 12902 CB ASN H 87 -2.212 103.322 -1.569 1.00 14.65 C
-ATOM 12903 CG ASN H 87 -1.105 102.698 -0.803 1.00 13.69 C
-ATOM 12904 OD1 ASN H 87 -1.123 101.472 -0.690 1.00 10.37 O
-ATOM 12905 ND2 ASN H 87 -0.166 103.470 -0.318 1.00 10.61 N
-ATOM 12906 H ASN H 87 -4.782 101.939 -2.880 1.00 0.00 H
-ATOM 12907 HA ASN H 87 -3.380 101.571 -1.152 1.00 0.00 H
-ATOM 12908 1HB ASN H 87 -1.974 103.291 -2.633 1.00 0.00 H
-ATOM 12909 2HB ASN H 87 -2.280 104.370 -1.272 1.00 0.00 H
-ATOM 12910 1HD2 ASN H 87 0.622 103.080 0.194 1.00 0.00 H
-ATOM 12911 2HD2 ASN H 87 -0.216 104.461 -0.466 1.00 0.00 H
-ATOM 12912 N THR H 88 -5.531 102.865 0.058 1.00 15.25 N
-ATOM 12913 CA THR H 88 -6.379 103.320 1.161 1.00 15.66 C
-ATOM 12914 C THR H 88 -7.130 102.174 1.862 1.00 14.94 C
-ATOM 12915 O THR H 88 -7.665 101.274 1.211 1.00 14.87 O
-ATOM 12916 CB THR H 88 -7.403 104.350 0.638 1.00 15.97 C
-ATOM 12917 OG1 THR H 88 -6.712 105.456 0.044 1.00 17.65 O
-ATOM 12918 CG2 THR H 88 -8.283 104.867 1.755 1.00 17.16 C
-ATOM 12919 H THR H 88 -5.922 102.250 -0.655 1.00 0.00 H
-ATOM 12920 HA THR H 88 -5.744 103.800 1.904 1.00 0.00 H
-ATOM 12921 HB THR H 88 -8.029 103.879 -0.116 1.00 0.00 H
-ATOM 12922 HG1 THR H 88 -6.005 105.745 0.623 1.00 0.00 H
-ATOM 12923 1HG2 THR H 88 -8.984 105.583 1.346 1.00 0.00 H
-ATOM 12924 2HG2 THR H 88 -8.835 104.055 2.215 1.00 0.00 H
-ATOM 12925 3HG2 THR H 88 -7.678 105.348 2.492 1.00 0.00 H
-ATOM 12926 N ALA H 89 -7.169 102.211 3.197 1.00 14.45 N
-ATOM 12927 CA ALA H 89 -7.944 101.229 3.967 1.00 14.15 C
-ATOM 12928 C ALA H 89 -9.261 101.868 4.413 1.00 14.30 C
-ATOM 12929 O ALA H 89 -9.308 103.060 4.700 1.00 13.73 O
-ATOM 12930 CB ALA H 89 -7.152 100.733 5.162 1.00 13.90 C
-ATOM 12931 H ALA H 89 -6.692 102.970 3.678 1.00 0.00 H
-ATOM 12932 HA ALA H 89 -8.176 100.384 3.325 1.00 0.00 H
-ATOM 12933 1HB ALA H 89 -7.747 100.000 5.709 1.00 0.00 H
-ATOM 12934 2HB ALA H 89 -6.225 100.268 4.825 1.00 0.00 H
-ATOM 12935 3HB ALA H 89 -6.922 101.565 5.812 1.00 0.00 H
-ATOM 12936 N TYR H 90 -10.328 101.081 4.506 1.00 13.94 N
-ATOM 12937 CA TYR H 90 -11.610 101.651 4.928 1.00 14.16 C
-ATOM 12938 C TYR H 90 -12.285 100.853 6.039 1.00 14.06 C
-ATOM 12939 O TYR H 90 -12.215 99.626 6.066 1.00 14.25 O
-ATOM 12940 CB TYR H 90 -12.574 101.678 3.749 1.00 14.02 C
-ATOM 12941 CG TYR H 90 -12.087 102.398 2.533 1.00 16.37 C
-ATOM 12942 CD1 TYR H 90 -12.394 103.728 2.308 1.00 19.30 C
-ATOM 12943 CD2 TYR H 90 -11.337 101.690 1.618 1.00 17.63 C
-ATOM 12944 CE1 TYR H 90 -11.950 104.340 1.151 1.00 18.81 C
-ATOM 12945 CE2 TYR H 90 -10.893 102.290 0.478 1.00 17.22 C
-ATOM 12946 CZ TYR H 90 -11.196 103.606 0.232 1.00 18.51 C
-ATOM 12947 OH TYR H 90 -10.751 104.192 -0.927 1.00 22.24 O
-ATOM 12948 H TYR H 90 -10.267 100.100 4.265 1.00 0.00 H
-ATOM 12949 HA TYR H 90 -11.439 102.657 5.297 1.00 0.00 H
-ATOM 12950 1HB TYR H 90 -12.810 100.657 3.456 1.00 0.00 H
-ATOM 12951 2HB TYR H 90 -13.504 102.150 4.067 1.00 0.00 H
-ATOM 12952 HD1 TYR H 90 -12.989 104.286 3.034 1.00 0.00 H
-ATOM 12953 HD2 TYR H 90 -11.107 100.644 1.809 1.00 0.00 H
-ATOM 12954 HE1 TYR H 90 -12.192 105.385 0.960 1.00 0.00 H
-ATOM 12955 HE2 TYR H 90 -10.307 101.722 -0.235 1.00 0.00 H
-ATOM 12956 HH TYR H 90 -10.028 103.665 -1.275 1.00 0.00 H
-ATOM 12957 N LEU H 91 -13.024 101.549 6.901 1.00 13.42 N
-ATOM 12958 CA LEU H 91 -13.839 100.879 7.919 1.00 12.91 C
-ATOM 12959 C LEU H 91 -15.292 101.335 7.783 1.00 13.41 C
-ATOM 12960 O LEU H 91 -15.600 102.518 7.920 1.00 14.05 O
-ATOM 12961 CB LEU H 91 -13.322 101.177 9.342 1.00 12.88 C
-ATOM 12962 CG LEU H 91 -14.139 100.542 10.498 1.00 11.07 C
-ATOM 12963 CD1 LEU H 91 -14.030 99.013 10.414 1.00 10.36 C
-ATOM 12964 CD2 LEU H 91 -13.633 101.067 11.852 1.00 10.97 C
-ATOM 12965 H LEU H 91 -13.035 102.562 6.818 1.00 0.00 H
-ATOM 12966 HA LEU H 91 -13.805 99.803 7.754 1.00 0.00 H
-ATOM 12967 1HB LEU H 91 -12.309 100.802 9.421 1.00 0.00 H
-ATOM 12968 2HB LEU H 91 -13.302 102.249 9.496 1.00 0.00 H
-ATOM 12969 HG LEU H 91 -15.183 100.803 10.381 1.00 0.00 H
-ATOM 12970 1HD1 LEU H 91 -14.614 98.563 11.208 1.00 0.00 H
-ATOM 12971 2HD1 LEU H 91 -14.408 98.674 9.448 1.00 0.00 H
-ATOM 12972 3HD1 LEU H 91 -12.987 98.721 10.520 1.00 0.00 H
-ATOM 12973 1HD2 LEU H 91 -14.224 100.624 12.652 1.00 0.00 H
-ATOM 12974 2HD2 LEU H 91 -12.589 100.800 11.982 1.00 0.00 H
-ATOM 12975 3HD2 LEU H 91 -13.738 102.145 11.887 1.00 0.00 H
-ATOM 12976 N GLN H 92 -16.184 100.402 7.484 1.00 13.46 N
-ATOM 12977 CA GLN H 92 -17.597 100.707 7.290 1.00 13.62 C
-ATOM 12978 C GLN H 92 -18.391 100.301 8.514 1.00 13.43 C
-ATOM 12979 O GLN H 92 -18.521 99.114 8.823 1.00 13.93 O
-ATOM 12980 CB GLN H 92 -18.155 99.984 6.063 1.00 13.75 C
-ATOM 12981 CG GLN H 92 -19.640 100.233 5.826 1.00 15.32 C
-ATOM 12982 CD GLN H 92 -19.973 101.638 5.311 1.00 18.72 C
-ATOM 12983 OE1 GLN H 92 -19.602 102.009 4.188 1.00 19.65 O
-ATOM 12984 NE2 GLN H 92 -20.661 102.423 6.135 1.00 20.46 N
-ATOM 12985 H GLN H 92 -15.888 99.439 7.393 1.00 0.00 H
-ATOM 12986 HA GLN H 92 -17.719 101.778 7.156 1.00 0.00 H
-ATOM 12987 1HB GLN H 92 -17.604 100.290 5.176 1.00 0.00 H
-ATOM 12988 2HB GLN H 92 -18.009 98.912 6.182 1.00 0.00 H
-ATOM 12989 1HG GLN H 92 -19.999 99.511 5.094 1.00 0.00 H
-ATOM 12990 2HG GLN H 92 -20.168 100.093 6.772 1.00 0.00 H
-ATOM 12991 1HE2 GLN H 92 -20.911 103.350 5.858 1.00 0.00 H
-ATOM 12992 2HE2 GLN H 92 -20.914 102.083 7.046 1.00 0.00 H
-ATOM 12993 N MET H 93 -18.903 101.277 9.239 1.00 13.09 N
-ATOM 12994 CA MET H 93 -19.586 100.953 10.470 1.00 13.14 C
-ATOM 12995 C MET H 93 -21.088 101.124 10.345 1.00 12.96 C
-ATOM 12996 O MET H 93 -21.565 102.228 10.072 1.00 12.79 O
-ATOM 12997 CB MET H 93 -19.041 101.854 11.544 1.00 13.43 C
-ATOM 12998 CG MET H 93 -17.550 101.777 11.673 1.00 15.37 C
-ATOM 12999 SD MET H 93 -16.901 102.826 12.950 1.00 19.30 S
-ATOM 13000 CE MET H 93 -17.188 104.395 12.219 1.00 19.08 C
-ATOM 13001 H MET H 93 -18.788 102.253 8.967 1.00 0.00 H
-ATOM 13002 HA MET H 93 -19.385 99.916 10.726 1.00 0.00 H
-ATOM 13003 1HB MET H 93 -19.307 102.883 11.328 1.00 0.00 H
-ATOM 13004 2HB MET H 93 -19.486 101.577 12.470 1.00 0.00 H
-ATOM 13005 1HG MET H 93 -17.251 100.760 11.862 1.00 0.00 H
-ATOM 13006 2HG MET H 93 -17.107 102.090 10.727 1.00 0.00 H
-ATOM 13007 1HE MET H 93 -16.815 105.167 12.873 1.00 0.00 H
-ATOM 13008 2HE MET H 93 -16.686 104.436 11.274 1.00 0.00 H
-ATOM 13009 3HE MET H 93 -18.248 104.532 12.056 1.00 0.00 H
-ATOM 13010 N ASN H 94 -21.839 100.035 10.535 1.00 13.17 N
-ATOM 13011 CA ASN H 94 -23.294 100.086 10.453 1.00 13.34 C
-ATOM 13012 C ASN H 94 -23.923 99.986 11.833 1.00 13.71 C
-ATOM 13013 O ASN H 94 -23.298 99.482 12.767 1.00 14.14 O
-ATOM 13014 CB ASN H 94 -23.827 98.987 9.546 1.00 13.42 C
-ATOM 13015 CG ASN H 94 -23.438 99.150 8.074 1.00 13.75 C
-ATOM 13016 OD1 ASN H 94 -23.537 100.241 7.479 1.00 14.10 O
-ATOM 13017 ND2 ASN H 94 -22.997 98.065 7.478 1.00 11.58 N
-ATOM 13018 H ASN H 94 -21.409 99.130 10.727 1.00 0.00 H
-ATOM 13019 HA ASN H 94 -23.586 101.050 10.046 1.00 0.00 H
-ATOM 13020 1HB ASN H 94 -23.466 98.024 9.901 1.00 0.00 H
-ATOM 13021 2HB ASN H 94 -24.914 98.967 9.616 1.00 0.00 H
-ATOM 13022 1HD2 ASN H 94 -22.726 98.093 6.516 1.00 0.00 H
-ATOM 13023 2HD2 ASN H 94 -22.936 97.202 7.984 1.00 0.00 H
-ATOM 13024 N SER H 95 -25.155 100.467 11.962 1.00 14.78 N
-ATOM 13025 CA SER H 95 -25.904 100.381 13.210 1.00 15.08 C
-ATOM 13026 C SER H 95 -25.103 100.937 14.384 1.00 15.15 C
-ATOM 13027 O SER H 95 -24.944 100.272 15.414 1.00 15.45 O
-ATOM 13028 CB SER H 95 -26.305 98.950 13.482 1.00 14.99 C
-ATOM 13029 OG SER H 95 -27.327 98.897 14.433 1.00 14.82 O
-ATOM 13030 H SER H 95 -25.596 100.908 11.164 1.00 0.00 H
-ATOM 13031 HA SER H 95 -26.809 100.977 13.103 1.00 0.00 H
-ATOM 13032 1HB SER H 95 -26.633 98.479 12.558 1.00 0.00 H
-ATOM 13033 2HB SER H 95 -25.443 98.399 13.840 1.00 0.00 H
-ATOM 13034 HG SER H 95 -27.038 99.461 15.154 1.00 0.00 H
-ATOM 13035 N LEU H 96 -24.599 102.154 14.207 1.00 15.39 N
-ATOM 13036 CA LEU H 96 -23.815 102.843 15.226 1.00 15.51 C
-ATOM 13037 C LEU H 96 -24.624 103.195 16.473 1.00 15.52 C
-ATOM 13038 O LEU H 96 -25.784 103.611 16.405 1.00 15.99 O
-ATOM 13039 CB LEU H 96 -23.126 104.046 14.586 1.00 15.44 C
-ATOM 13040 CG LEU H 96 -21.928 103.659 13.686 1.00 15.46 C
-ATOM 13041 CD1 LEU H 96 -21.434 104.829 12.881 1.00 17.08 C
-ATOM 13042 CD2 LEU H 96 -20.819 103.193 14.615 1.00 15.74 C
-ATOM 13043 H LEU H 96 -24.785 102.619 13.318 1.00 0.00 H
-ATOM 13044 HA LEU H 96 -23.022 102.165 15.545 1.00 0.00 H
-ATOM 13045 1HB LEU H 96 -23.855 104.574 13.977 1.00 0.00 H
-ATOM 13046 2HB LEU H 96 -22.768 104.699 15.356 1.00 0.00 H
-ATOM 13047 HG LEU H 96 -22.215 102.858 12.996 1.00 0.00 H
-ATOM 13048 1HD1 LEU H 96 -20.591 104.519 12.289 1.00 0.00 H
-ATOM 13049 2HD1 LEU H 96 -22.221 105.163 12.217 1.00 0.00 H
-ATOM 13050 3HD1 LEU H 96 -21.138 105.632 13.548 1.00 0.00 H
-ATOM 13051 1HD2 LEU H 96 -19.952 102.914 14.060 1.00 0.00 H
-ATOM 13052 2HD2 LEU H 96 -20.557 104.005 15.293 1.00 0.00 H
-ATOM 13053 3HD2 LEU H 96 -21.168 102.336 15.197 1.00 0.00 H
-ATOM 13054 N ARG H 97 -24.000 103.003 17.630 1.00 15.39 N
-ATOM 13055 CA ARG H 97 -24.645 103.237 18.920 1.00 15.46 C
-ATOM 13056 C ARG H 97 -23.934 104.334 19.700 1.00 15.12 C
-ATOM 13057 O ARG H 97 -22.803 104.686 19.391 1.00 14.98 O
-ATOM 13058 CB ARG H 97 -24.621 101.959 19.748 1.00 15.98 C
-ATOM 13059 CG ARG H 97 -25.226 100.727 19.064 1.00 18.92 C
-ATOM 13060 CD ARG H 97 -26.695 100.813 18.895 1.00 24.74 C
-ATOM 13061 NE ARG H 97 -27.234 99.585 18.324 1.00 27.69 N
-ATOM 13062 CZ ARG H 97 -28.525 99.389 17.994 1.00 28.60 C
-ATOM 13063 NH1 ARG H 97 -29.409 100.346 18.176 1.00 27.14 N
-ATOM 13064 NH2 ARG H 97 -28.903 98.229 17.485 1.00 28.22 N
-ATOM 13065 H ARG H 97 -23.042 102.648 17.621 1.00 0.00 H
-ATOM 13066 HA ARG H 97 -25.678 103.537 18.750 1.00 0.00 H
-ATOM 13067 1HB ARG H 97 -23.588 101.721 20.008 1.00 0.00 H
-ATOM 13068 2HB ARG H 97 -25.167 102.117 20.676 1.00 0.00 H
-ATOM 13069 1HG ARG H 97 -24.785 100.616 18.072 1.00 0.00 H
-ATOM 13070 2HG ARG H 97 -25.002 99.838 19.655 1.00 0.00 H
-ATOM 13071 1HD ARG H 97 -27.167 100.977 19.864 1.00 0.00 H
-ATOM 13072 2HD ARG H 97 -26.938 101.637 18.224 1.00 0.00 H
-ATOM 13073 HE ARG H 97 -26.589 98.821 18.168 1.00 0.00 H
-ATOM 13074 1HH1 ARG H 97 -29.117 101.233 18.562 1.00 0.00 H
-ATOM 13075 2HH1 ARG H 97 -30.375 100.195 17.927 1.00 0.00 H
-ATOM 13076 1HH2 ARG H 97 -28.221 97.495 17.342 1.00 0.00 H
-ATOM 13077 2HH2 ARG H 97 -29.869 98.077 17.235 1.00 0.00 H
-ATOM 13078 N ALA H 98 -24.559 104.841 20.760 1.00 14.55 N
-ATOM 13079 CA ALA H 98 -23.905 105.857 21.601 1.00 14.76 C
-ATOM 13080 C ALA H 98 -22.575 105.331 22.149 1.00 14.98 C
-ATOM 13081 O ALA H 98 -21.605 106.076 22.321 1.00 14.74 O
-ATOM 13082 CB ALA H 98 -24.814 106.239 22.750 1.00 14.48 C
-ATOM 13083 H ALA H 98 -25.494 104.536 20.987 1.00 0.00 H
-ATOM 13084 HA ALA H 98 -23.706 106.736 20.997 1.00 0.00 H
-ATOM 13085 1HB ALA H 98 -24.323 107.001 23.355 1.00 0.00 H
-ATOM 13086 2HB ALA H 98 -25.750 106.631 22.356 1.00 0.00 H
-ATOM 13087 3HB ALA H 98 -25.013 105.360 23.362 1.00 0.00 H
-ATOM 13088 N GLU H 99 -22.523 104.027 22.372 1.00 15.15 N
-ATOM 13089 CA GLU H 99 -21.364 103.321 22.896 1.00 15.76 C
-ATOM 13090 C GLU H 99 -20.154 103.411 21.962 1.00 14.85 C
-ATOM 13091 O GLU H 99 -19.022 103.166 22.379 1.00 15.12 O
-ATOM 13092 CB GLU H 99 -21.719 101.853 23.133 1.00 16.93 C
-ATOM 13093 CG GLU H 99 -22.728 101.627 24.243 1.00 21.20 C
-ATOM 13094 CD GLU H 99 -23.063 100.170 24.463 1.00 29.31 C
-ATOM 13095 OE1 GLU H 99 -22.681 99.357 23.655 1.00 31.90 O
-ATOM 13096 OE2 GLU H 99 -23.689 99.873 25.453 1.00 30.71 O
-ATOM 13097 H GLU H 99 -23.355 103.489 22.182 1.00 0.00 H
-ATOM 13098 HA GLU H 99 -21.090 103.777 23.851 1.00 0.00 H
-ATOM 13099 1HB GLU H 99 -22.118 101.424 22.211 1.00 0.00 H
-ATOM 13100 2HB GLU H 99 -20.816 101.298 23.388 1.00 0.00 H
-ATOM 13101 1HG GLU H 99 -22.328 102.042 25.166 1.00 0.00 H
-ATOM 13102 2HG GLU H 99 -23.643 102.171 23.994 1.00 0.00 H
-ATOM 13103 N ASP H 100 -20.402 103.717 20.688 1.00 13.69 N
-ATOM 13104 CA ASP H 100 -19.354 103.772 19.687 1.00 12.75 C
-ATOM 13105 C ASP H 100 -18.720 105.158 19.561 1.00 12.87 C
-ATOM 13106 O ASP H 100 -17.818 105.341 18.741 1.00 12.55 O
-ATOM 13107 CB ASP H 100 -19.919 103.367 18.322 1.00 12.53 C
-ATOM 13108 CG ASP H 100 -20.383 101.891 18.231 1.00 14.21 C
-ATOM 13109 OD1 ASP H 100 -21.504 101.688 17.801 1.00 17.17 O
-ATOM 13110 OD2 ASP H 100 -19.629 100.970 18.540 1.00 13.42 O
-ATOM 13111 H ASP H 100 -21.346 103.947 20.398 1.00 0.00 H
-ATOM 13112 HA ASP H 100 -18.572 103.074 19.975 1.00 0.00 H
-ATOM 13113 1HB ASP H 100 -20.758 104.016 18.075 1.00 0.00 H
-ATOM 13114 2HB ASP H 100 -19.152 103.535 17.560 1.00 0.00 H
-ATOM 13115 N THR H 101 -19.166 106.150 20.347 1.00 12.69 N
-ATOM 13116 CA THR H 101 -18.480 107.437 20.235 1.00 12.66 C
-ATOM 13117 C THR H 101 -17.019 107.242 20.620 1.00 12.77 C
-ATOM 13118 O THR H 101 -16.712 106.764 21.716 1.00 12.97 O
-ATOM 13119 CB THR H 101 -19.109 108.534 21.124 1.00 12.38 C
-ATOM 13120 OG1 THR H 101 -20.488 108.787 20.724 1.00 14.62 O
-ATOM 13121 CG2 THR H 101 -18.261 109.827 21.075 1.00 11.97 C
-ATOM 13122 H THR H 101 -19.929 106.013 21.012 1.00 0.00 H
-ATOM 13123 HA THR H 101 -18.522 107.765 19.200 1.00 0.00 H
-ATOM 13124 HB THR H 101 -19.125 108.178 22.152 1.00 0.00 H
-ATOM 13125 HG1 THR H 101 -20.506 109.064 19.814 1.00 0.00 H
-ATOM 13126 1HG2 THR H 101 -18.702 110.577 21.726 1.00 0.00 H
-ATOM 13127 2HG2 THR H 101 -17.250 109.601 21.415 1.00 0.00 H
-ATOM 13128 3HG2 THR H 101 -18.210 110.213 20.076 1.00 0.00 H
-ATOM 13129 N ALA H 102 -16.119 107.604 19.713 1.00 12.51 N
-ATOM 13130 CA ALA H 102 -14.700 107.397 19.956 1.00 12.95 C
-ATOM 13131 C ALA H 102 -13.833 108.047 18.914 1.00 13.01 C
-ATOM 13132 O ALA H 102 -14.263 108.303 17.787 1.00 12.70 O
-ATOM 13133 CB ALA H 102 -14.381 105.909 19.996 1.00 13.08 C
-ATOM 13134 H ALA H 102 -16.440 108.025 18.844 1.00 0.00 H
-ATOM 13135 HA ALA H 102 -14.451 107.859 20.899 1.00 0.00 H
-ATOM 13136 1HB ALA H 102 -13.332 105.783 20.191 1.00 0.00 H
-ATOM 13137 2HB ALA H 102 -14.951 105.406 20.771 1.00 0.00 H
-ATOM 13138 3HB ALA H 102 -14.626 105.472 19.033 1.00 0.00 H
-ATOM 13139 N VAL H 103 -12.578 108.254 19.265 1.00 12.29 N
-ATOM 13140 CA VAL H 103 -11.624 108.639 18.253 1.00 11.30 C
-ATOM 13141 C VAL H 103 -11.090 107.369 17.643 1.00 11.70 C
-ATOM 13142 O VAL H 103 -10.674 106.470 18.365 1.00 12.47 O
-ATOM 13143 CB VAL H 103 -10.474 109.471 18.830 1.00 11.15 C
-ATOM 13144 CG1 VAL H 103 -9.461 109.785 17.722 1.00 7.34 C
-ATOM 13145 CG2 VAL H 103 -11.033 110.749 19.415 1.00 8.91 C
-ATOM 13146 H VAL H 103 -12.278 108.088 20.225 1.00 0.00 H
-ATOM 13147 HA VAL H 103 -12.124 109.212 17.485 1.00 0.00 H
-ATOM 13148 HB VAL H 103 -9.964 108.895 19.604 1.00 0.00 H
-ATOM 13149 1HG1 VAL H 103 -8.636 110.371 18.126 1.00 0.00 H
-ATOM 13150 2HG1 VAL H 103 -9.066 108.860 17.297 1.00 0.00 H
-ATOM 13151 3HG1 VAL H 103 -9.956 110.352 16.945 1.00 0.00 H
-ATOM 13152 1HG2 VAL H 103 -10.218 111.340 19.830 1.00 0.00 H
-ATOM 13153 2HG2 VAL H 103 -11.531 111.313 18.631 1.00 0.00 H
-ATOM 13154 3HG2 VAL H 103 -11.748 110.511 20.206 1.00 0.00 H
-ATOM 13155 N TYR H 104 -11.148 107.264 16.337 1.00 11.25 N
-ATOM 13156 CA TYR H 104 -10.664 106.092 15.643 1.00 11.88 C
-ATOM 13157 C TYR H 104 -9.294 106.371 15.090 1.00 12.82 C
-ATOM 13158 O TYR H 104 -9.033 107.457 14.569 1.00 13.52 O
-ATOM 13159 CB TYR H 104 -11.650 105.679 14.549 1.00 10.33 C
-ATOM 13160 CG TYR H 104 -12.901 104.963 15.065 1.00 7.95 C
-ATOM 13161 CD1 TYR H 104 -13.940 105.668 15.649 1.00 8.25 C
-ATOM 13162 CD2 TYR H 104 -13.016 103.581 14.900 1.00 5.63 C
-ATOM 13163 CE1 TYR H 104 -15.071 104.996 16.091 1.00 9.03 C
-ATOM 13164 CE2 TYR H 104 -14.148 102.923 15.332 1.00 5.44 C
-ATOM 13165 CZ TYR H 104 -15.167 103.624 15.931 1.00 7.51 C
-ATOM 13166 OH TYR H 104 -16.296 102.960 16.361 1.00 8.14 O
-ATOM 13167 H TYR H 104 -11.523 108.038 15.802 1.00 0.00 H
-ATOM 13168 HA TYR H 104 -10.569 105.272 16.352 1.00 0.00 H
-ATOM 13169 1HB TYR H 104 -11.970 106.572 14.007 1.00 0.00 H
-ATOM 13170 2HB TYR H 104 -11.151 105.028 13.843 1.00 0.00 H
-ATOM 13171 HD1 TYR H 104 -13.864 106.749 15.771 1.00 0.00 H
-ATOM 13172 HD2 TYR H 104 -12.209 103.018 14.424 1.00 0.00 H
-ATOM 13173 HE1 TYR H 104 -15.886 105.546 16.563 1.00 0.00 H
-ATOM 13174 HE2 TYR H 104 -14.238 101.848 15.199 1.00 0.00 H
-ATOM 13175 HH TYR H 104 -16.299 102.074 15.990 1.00 0.00 H
-ATOM 13176 N TYR H 105 -8.414 105.396 15.195 1.00 13.74 N
-ATOM 13177 CA TYR H 105 -7.078 105.553 14.689 1.00 14.66 C
-ATOM 13178 C TYR H 105 -6.771 104.454 13.717 1.00 15.88 C
-ATOM 13179 O TYR H 105 -7.117 103.293 13.936 1.00 16.30 O
-ATOM 13180 CB TYR H 105 -6.047 105.453 15.812 1.00 13.80 C
-ATOM 13181 CG TYR H 105 -6.238 106.401 16.944 1.00 12.55 C
-ATOM 13182 CD1 TYR H 105 -5.657 107.646 16.924 1.00 13.65 C
-ATOM 13183 CD2 TYR H 105 -6.982 105.998 18.038 1.00 8.70 C
-ATOM 13184 CE1 TYR H 105 -5.835 108.496 17.993 1.00 13.39 C
-ATOM 13185 CE2 TYR H 105 -7.151 106.834 19.096 1.00 11.08 C
-ATOM 13186 CZ TYR H 105 -6.589 108.078 19.083 1.00 14.02 C
-ATOM 13187 OH TYR H 105 -6.770 108.909 20.159 1.00 15.41 O
-ATOM 13188 H TYR H 105 -8.670 104.537 15.655 1.00 0.00 H
-ATOM 13189 HA TYR H 105 -6.988 106.506 14.168 1.00 0.00 H
-ATOM 13190 1HB TYR H 105 -6.054 104.439 16.214 1.00 0.00 H
-ATOM 13191 2HB TYR H 105 -5.058 105.628 15.390 1.00 0.00 H
-ATOM 13192 HD1 TYR H 105 -5.064 107.959 16.061 1.00 0.00 H
-ATOM 13193 HD2 TYR H 105 -7.434 105.011 18.061 1.00 0.00 H
-ATOM 13194 HE1 TYR H 105 -5.382 109.489 17.980 1.00 0.00 H
-ATOM 13195 HE2 TYR H 105 -7.731 106.514 19.945 1.00 0.00 H
-ATOM 13196 HH TYR H 105 -7.067 108.386 20.932 1.00 0.00 H
-ATOM 13197 N CYS H 106 -6.049 104.819 12.689 1.00 16.56 N
-ATOM 13198 CA CYS H 106 -5.499 103.898 11.731 1.00 17.42 C
-ATOM 13199 C CYS H 106 -4.059 103.647 12.137 1.00 15.96 C
-ATOM 13200 O CYS H 106 -3.298 104.589 12.381 1.00 14.75 O
-ATOM 13201 CB CYS H 106 -5.594 104.489 10.338 1.00 18.75 C
-ATOM 13202 SG CYS H 106 -4.941 103.482 9.022 1.00 26.61 S
-ATOM 13203 H CYS H 106 -5.856 105.808 12.569 1.00 0.00 H
-ATOM 13204 HA CYS H 106 -6.055 102.961 11.763 1.00 0.00 H
-ATOM 13205 1HB CYS H 106 -6.642 104.689 10.118 1.00 0.00 H
-ATOM 13206 2HB CYS H 106 -5.072 105.446 10.322 1.00 0.00 H
-ATOM 13207 N SER H 107 -3.690 102.386 12.258 1.00 15.63 N
-ATOM 13208 CA SER H 107 -2.331 102.050 12.659 1.00 15.61 C
-ATOM 13209 C SER H 107 -1.854 100.834 11.893 1.00 16.22 C
-ATOM 13210 O SER H 107 -2.657 100.088 11.332 1.00 16.00 O
-ATOM 13211 CB SER H 107 -2.270 101.799 14.151 1.00 16.22 C
-ATOM 13212 OG SER H 107 -2.999 100.671 14.489 1.00 14.09 O
-ATOM 13213 H SER H 107 -4.372 101.651 12.074 1.00 0.00 H
-ATOM 13214 HA SER H 107 -1.678 102.881 12.417 1.00 0.00 H
-ATOM 13215 1HB SER H 107 -1.234 101.670 14.458 1.00 0.00 H
-ATOM 13216 2HB SER H 107 -2.666 102.662 14.679 1.00 0.00 H
-ATOM 13217 HG SER H 107 -2.556 99.944 14.043 1.00 0.00 H
-ATOM 13218 N ARG H 108 -0.547 100.609 11.875 1.00 16.62 N
-ATOM 13219 CA ARG H 108 -0.075 99.460 11.116 1.00 17.11 C
-ATOM 13220 C ARG H 108 1.014 98.666 11.829 1.00 18.50 C
-ATOM 13221 O ARG H 108 1.769 99.207 12.632 1.00 18.19 O
-ATOM 13222 CB ARG H 108 0.560 99.919 9.822 1.00 16.43 C
-ATOM 13223 CG ARG H 108 1.914 100.511 10.053 1.00 15.10 C
-ATOM 13224 CD ARG H 108 2.602 100.946 8.843 1.00 11.80 C
-ATOM 13225 NE ARG H 108 4.029 100.981 9.117 1.00 13.13 N
-ATOM 13226 CZ ARG H 108 4.997 101.168 8.204 1.00 17.33 C
-ATOM 13227 NH1 ARG H 108 4.692 101.368 6.954 1.00 17.39 N
-ATOM 13228 NH2 ARG H 108 6.264 101.127 8.570 1.00 17.59 N
-ATOM 13229 H ARG H 108 0.087 101.259 12.344 1.00 0.00 H
-ATOM 13230 HA ARG H 108 -0.911 98.795 10.913 1.00 0.00 H
-ATOM 13231 1HB ARG H 108 0.664 99.089 9.156 1.00 0.00 H
-ATOM 13232 2HB ARG H 108 -0.068 100.664 9.336 1.00 0.00 H
-ATOM 13233 1HG ARG H 108 1.807 101.378 10.701 1.00 0.00 H
-ATOM 13234 2HG ARG H 108 2.548 99.779 10.549 1.00 0.00 H
-ATOM 13235 1HD ARG H 108 2.410 100.301 8.005 1.00 0.00 H
-ATOM 13236 2HD ARG H 108 2.281 101.952 8.597 1.00 0.00 H
-ATOM 13237 HE ARG H 108 4.321 100.790 10.092 1.00 0.00 H
-ATOM 13238 1HH1 ARG H 108 3.721 101.383 6.661 1.00 0.00 H
-ATOM 13239 2HH1 ARG H 108 5.422 101.480 6.265 1.00 0.00 H
-ATOM 13240 1HH2 ARG H 108 6.507 100.940 9.559 1.00 0.00 H
-ATOM 13241 2HH2 ARG H 108 6.994 101.261 7.891 1.00 0.00 H
-ATOM 13242 N TRP H 109 1.113 97.381 11.487 1.00 20.34 N
-ATOM 13243 CA TRP H 109 2.247 96.525 11.902 1.00 21.91 C
-ATOM 13244 C TRP H 109 3.268 96.423 10.770 1.00 23.95 C
-ATOM 13245 O TRP H 109 3.248 95.436 10.029 1.00 26.60 O
-ATOM 13246 CB TRP H 109 1.804 95.113 12.322 1.00 20.66 C
-ATOM 13247 CG TRP H 109 1.133 95.024 13.662 1.00 19.36 C
-ATOM 13248 CD1 TRP H 109 1.032 96.011 14.567 1.00 15.79 C
-ATOM 13249 CD2 TRP H 109 0.490 93.865 14.276 1.00 16.50 C
-ATOM 13250 NE1 TRP H 109 0.379 95.567 15.692 1.00 15.17 N
-ATOM 13251 CE2 TRP H 109 0.033 94.271 15.525 1.00 16.09 C
-ATOM 13252 CE3 TRP H 109 0.269 92.540 13.857 1.00 15.46 C
-ATOM 13253 CZ2 TRP H 109 -0.629 93.413 16.381 1.00 14.30 C
-ATOM 13254 CZ3 TRP H 109 -0.401 91.672 14.723 1.00 17.42 C
-ATOM 13255 CH2 TRP H 109 -0.837 92.110 15.953 1.00 15.84 C
-ATOM 13256 H TRP H 109 0.411 97.018 10.841 1.00 0.00 H
-ATOM 13257 HA TRP H 109 2.740 96.991 12.757 1.00 0.00 H
-ATOM 13258 1HB TRP H 109 1.113 94.711 11.572 1.00 0.00 H
-ATOM 13259 2HB TRP H 109 2.674 94.461 12.340 1.00 0.00 H
-ATOM 13260 HD1 TRP H 109 1.427 97.009 14.422 1.00 0.00 H
-ATOM 13261 HE1 TRP H 109 0.181 96.116 16.510 1.00 0.00 H
-ATOM 13262 HE3 TRP H 109 0.618 92.195 12.884 1.00 0.00 H
-ATOM 13263 HZ2 TRP H 109 -0.978 93.735 17.355 1.00 0.00 H
-ATOM 13264 HZ3 TRP H 109 -0.563 90.649 14.395 1.00 0.00 H
-ATOM 13265 HH2 TRP H 109 -1.349 91.411 16.604 1.00 0.00 H
-ATOM 13266 N GLY H 110 4.117 97.443 10.587 1.00 25.12 N
-ATOM 13267 CA GLY H 110 4.997 97.500 9.417 1.00 26.64 C
-ATOM 13268 C GLY H 110 5.882 96.278 9.172 1.00 26.59 C
-ATOM 13269 O GLY H 110 6.646 95.855 10.038 1.00 27.67 O
-ATOM 13270 H GLY H 110 4.151 98.235 11.241 1.00 0.00 H
-ATOM 13271 1HA GLY H 110 4.422 97.700 8.527 1.00 0.00 H
-ATOM 13272 2HA GLY H 110 5.647 98.366 9.542 1.00 0.00 H
-ATOM 13273 N GLY H 111 5.817 95.750 7.944 1.00 26.46 N
-ATOM 13274 CA GLY H 111 6.651 94.612 7.531 1.00 26.94 C
-ATOM 13275 C GLY H 111 6.243 93.235 8.077 1.00 26.53 C
-ATOM 13276 O GLY H 111 5.117 93.037 8.537 1.00 25.79 O
-ATOM 13277 H GLY H 111 5.147 96.142 7.278 1.00 0.00 H
-ATOM 13278 1HA GLY H 111 6.653 94.567 6.441 1.00 0.00 H
-ATOM 13279 2HA GLY H 111 7.680 94.816 7.828 1.00 0.00 H
-ATOM 13280 N ASP H 112 7.178 92.276 7.955 1.00 26.25 N
-ATOM 13281 CA ASP H 112 6.988 90.863 8.321 1.00 26.56 C
-ATOM 13282 C ASP H 112 7.611 90.447 9.663 1.00 25.86 C
-ATOM 13283 O ASP H 112 7.213 89.431 10.245 1.00 27.49 O
-ATOM 13284 CB ASP H 112 7.573 89.983 7.222 1.00 26.55 C
-ATOM 13285 CG ASP H 112 6.863 90.179 5.895 1.00 29.11 C
-ATOM 13286 OD1 ASP H 112 5.685 89.922 5.829 1.00 32.01 O
-ATOM 13287 OD2 ASP H 112 7.494 90.621 4.965 1.00 27.98 O
-ATOM 13288 H ASP H 112 8.071 92.544 7.569 1.00 0.00 H
-ATOM 13289 HA ASP H 112 5.916 90.678 8.383 1.00 0.00 H
-ATOM 13290 1HB ASP H 112 8.636 90.214 7.098 1.00 0.00 H
-ATOM 13291 2HB ASP H 112 7.491 88.932 7.511 1.00 0.00 H
-ATOM 13292 N GLY H 113 8.655 91.158 10.092 1.00 23.64 N
-ATOM 13293 CA GLY H 113 9.416 90.797 11.296 1.00 21.95 C
-ATOM 13294 C GLY H 113 9.205 91.753 12.476 1.00 21.39 C
-ATOM 13295 O GLY H 113 9.938 91.688 13.466 1.00 21.11 O
-ATOM 13296 H GLY H 113 8.930 91.981 9.575 1.00 0.00 H
-ATOM 13297 1HA GLY H 113 9.149 89.784 11.602 1.00 0.00 H
-ATOM 13298 2HA GLY H 113 10.478 90.769 11.048 1.00 0.00 H
-ATOM 13299 N PHE H 133 8.229 92.649 12.367 1.00 20.59 N
-ATOM 13300 CA PHE H 133 7.990 93.648 13.411 1.00 19.82 C
-ATOM 13301 C PHE H 133 6.487 93.783 13.678 1.00 18.96 C
-ATOM 13302 O PHE H 133 5.740 94.271 12.836 1.00 19.13 O
-ATOM 13303 CB PHE H 133 8.584 94.982 12.952 1.00 20.05 C
-ATOM 13304 CG PHE H 133 8.649 96.056 13.979 1.00 21.70 C
-ATOM 13305 CD1 PHE H 133 9.845 96.306 14.628 1.00 23.21 C
-ATOM 13306 CD2 PHE H 133 7.554 96.832 14.296 1.00 22.58 C
-ATOM 13307 CE1 PHE H 133 9.940 97.295 15.549 1.00 24.01 C
-ATOM 13308 CE2 PHE H 133 7.667 97.821 15.236 1.00 25.09 C
-ATOM 13309 CZ PHE H 133 8.864 98.048 15.858 1.00 25.38 C
-ATOM 13310 H PHE H 133 7.654 92.647 11.537 1.00 0.00 H
-ATOM 13311 HA PHE H 133 8.482 93.329 14.329 1.00 0.00 H
-ATOM 13312 1HB PHE H 133 9.596 94.812 12.583 1.00 0.00 H
-ATOM 13313 2HB PHE H 133 8.002 95.357 12.108 1.00 0.00 H
-ATOM 13314 HD1 PHE H 133 10.724 95.705 14.388 1.00 0.00 H
-ATOM 13315 HD2 PHE H 133 6.599 96.658 13.791 1.00 0.00 H
-ATOM 13316 HE1 PHE H 133 10.882 97.479 16.032 1.00 0.00 H
-ATOM 13317 HE2 PHE H 133 6.804 98.430 15.482 1.00 0.00 H
-ATOM 13318 HZ PHE H 133 8.961 98.827 16.591 1.00 0.00 H
-ATOM 13319 N TYR H 134 6.023 93.301 14.840 1.00 17.63 N
-ATOM 13320 CA TYR H 134 4.572 93.231 15.119 1.00 17.31 C
-ATOM 13321 C TYR H 134 4.070 94.285 16.106 1.00 17.68 C
-ATOM 13322 O TYR H 134 3.035 94.094 16.739 1.00 19.54 O
-ATOM 13323 CB TYR H 134 4.180 91.832 15.642 1.00 16.44 C
-ATOM 13324 CG TYR H 134 4.466 90.682 14.669 1.00 15.78 C
-ATOM 13325 CD1 TYR H 134 4.332 89.346 15.055 1.00 11.63 C
-ATOM 13326 CD2 TYR H 134 4.882 90.961 13.401 1.00 12.08 C
-ATOM 13327 CE1 TYR H 134 4.625 88.350 14.136 1.00 13.49 C
-ATOM 13328 CE2 TYR H 134 5.186 90.000 12.541 1.00 11.33 C
-ATOM 13329 CZ TYR H 134 5.061 88.704 12.873 1.00 13.27 C
-ATOM 13330 OH TYR H 134 5.370 87.732 11.952 1.00 9.68 O
-ATOM 13331 H TYR H 134 6.677 92.936 15.519 1.00 0.00 H
-ATOM 13332 HA TYR H 134 4.041 93.398 14.185 1.00 0.00 H
-ATOM 13333 1HB TYR H 134 4.730 91.639 16.550 1.00 0.00 H
-ATOM 13334 2HB TYR H 134 3.108 91.818 15.895 1.00 0.00 H
-ATOM 13335 HD1 TYR H 134 4.001 89.084 16.070 1.00 0.00 H
-ATOM 13336 HD2 TYR H 134 4.978 91.957 13.080 1.00 0.00 H
-ATOM 13337 HE1 TYR H 134 4.522 87.303 14.392 1.00 0.00 H
-ATOM 13338 HE2 TYR H 134 5.519 90.274 11.556 1.00 0.00 H
-ATOM 13339 HH TYR H 134 6.013 88.094 11.306 1.00 0.00 H
-ATOM 13340 N ALA H 135 4.813 95.372 16.269 1.00 17.17 N
-ATOM 13341 CA ALA H 135 4.363 96.453 17.141 1.00 16.70 C
-ATOM 13342 C ALA H 135 3.817 97.582 16.268 1.00 16.99 C
-ATOM 13343 O ALA H 135 4.216 97.735 15.114 1.00 15.88 O
-ATOM 13344 CB ALA H 135 5.479 96.937 18.051 1.00 16.33 C
-ATOM 13345 H ALA H 135 5.674 95.463 15.750 1.00 0.00 H
-ATOM 13346 HA ALA H 135 3.551 96.077 17.765 1.00 0.00 H
-ATOM 13347 1HB ALA H 135 5.091 97.719 18.685 1.00 0.00 H
-ATOM 13348 2HB ALA H 135 5.833 96.118 18.669 1.00 0.00 H
-ATOM 13349 3HB ALA H 135 6.292 97.318 17.477 1.00 0.00 H
-ATOM 13350 N MET H 136 2.902 98.389 16.804 1.00 17.12 N
-ATOM 13351 CA MET H 136 2.307 99.461 16.001 1.00 17.31 C
-ATOM 13352 C MET H 136 3.235 100.663 15.851 1.00 17.11 C
-ATOM 13353 O MET H 136 3.116 101.663 16.570 1.00 18.15 O
-ATOM 13354 CB MET H 136 0.938 99.868 16.559 1.00 17.12 C
-ATOM 13355 CG MET H 136 -0.115 98.774 16.466 1.00 16.93 C
-ATOM 13356 SD MET H 136 -1.722 99.211 17.136 1.00 22.16 S
-ATOM 13357 CE MET H 136 -2.613 97.669 16.874 1.00 20.82 C
-ATOM 13358 H MET H 136 2.606 98.261 17.759 1.00 0.00 H
-ATOM 13359 HA MET H 136 2.140 99.073 15.000 1.00 0.00 H
-ATOM 13360 1HB MET H 136 1.021 100.162 17.586 1.00 0.00 H
-ATOM 13361 2HB MET H 136 0.568 100.727 16.000 1.00 0.00 H
-ATOM 13362 1HG MET H 136 -0.248 98.506 15.419 1.00 0.00 H
-ATOM 13363 2HG MET H 136 0.240 97.911 17.006 1.00 0.00 H
-ATOM 13364 1HE MET H 136 -3.630 97.770 17.242 1.00 0.00 H
-ATOM 13365 2HE MET H 136 -2.633 97.433 15.809 1.00 0.00 H
-ATOM 13366 3HE MET H 136 -2.114 96.862 17.412 1.00 0.00 H
-ATOM 13367 N ASP H 137 4.183 100.535 14.913 1.00 17.16 N
-ATOM 13368 CA ASP H 137 5.213 101.552 14.681 1.00 17.66 C
-ATOM 13369 C ASP H 137 4.664 102.878 14.143 1.00 18.09 C
-ATOM 13370 O ASP H 137 5.224 103.938 14.425 1.00 18.87 O
-ATOM 13371 CB ASP H 137 6.323 101.017 13.743 1.00 17.37 C
-ATOM 13372 CG ASP H 137 5.891 100.517 12.282 1.00 19.03 C
-ATOM 13373 OD1 ASP H 137 4.780 100.045 12.072 1.00 20.42 O
-ATOM 13374 OD2 ASP H 137 6.721 100.633 11.393 1.00 19.62 O
-ATOM 13375 H ASP H 137 4.195 99.658 14.395 1.00 0.00 H
-ATOM 13376 HA ASP H 137 5.684 101.769 15.639 1.00 0.00 H
-ATOM 13377 1HB ASP H 137 7.038 101.814 13.595 1.00 0.00 H
-ATOM 13378 2HB ASP H 137 6.853 100.230 14.232 1.00 0.00 H
-ATOM 13379 N TYR H 138 3.549 102.830 13.412 1.00 17.92 N
-ATOM 13380 CA TYR H 138 2.925 104.064 12.922 1.00 17.72 C
-ATOM 13381 C TYR H 138 1.427 104.122 13.153 1.00 17.28 C
-ATOM 13382 O TYR H 138 0.692 103.141 12.993 1.00 17.23 O
-ATOM 13383 CB TYR H 138 3.239 104.357 11.450 1.00 17.99 C
-ATOM 13384 CG TYR H 138 4.691 104.720 11.200 1.00 17.44 C
-ATOM 13385 CD1 TYR H 138 5.614 103.742 10.957 1.00 20.06 C
-ATOM 13386 CD2 TYR H 138 5.089 106.056 11.233 1.00 18.63 C
-ATOM 13387 CE1 TYR H 138 6.937 104.058 10.749 1.00 20.60 C
-ATOM 13388 CE2 TYR H 138 6.418 106.389 11.024 1.00 19.97 C
-ATOM 13389 CZ TYR H 138 7.342 105.389 10.782 1.00 19.74 C
-ATOM 13390 OH TYR H 138 8.665 105.708 10.573 1.00 19.49 O
-ATOM 13391 H TYR H 138 3.146 101.925 13.205 1.00 0.00 H
-ATOM 13392 HA TYR H 138 3.348 104.891 13.491 1.00 0.00 H
-ATOM 13393 1HB TYR H 138 2.993 103.491 10.840 1.00 0.00 H
-ATOM 13394 2HB TYR H 138 2.615 105.187 11.108 1.00 0.00 H
-ATOM 13395 HD1 TYR H 138 5.296 102.715 10.934 1.00 0.00 H
-ATOM 13396 HD2 TYR H 138 4.356 106.843 11.424 1.00 0.00 H
-ATOM 13397 HE1 TYR H 138 7.657 103.261 10.562 1.00 0.00 H
-ATOM 13398 HE2 TYR H 138 6.730 107.437 11.047 1.00 0.00 H
-ATOM 13399 HH TYR H 138 8.789 106.652 10.706 1.00 0.00 H
-ATOM 13400 N TRP H 139 0.993 105.323 13.526 1.00 17.01 N
-ATOM 13401 CA TRP H 139 -0.398 105.675 13.791 1.00 16.52 C
-ATOM 13402 C TRP H 139 -0.763 106.942 13.017 1.00 16.04 C
-ATOM 13403 O TRP H 139 0.094 107.810 12.829 1.00 15.23 O
-ATOM 13404 CB TRP H 139 -0.564 105.957 15.289 1.00 16.21 C
-ATOM 13405 CG TRP H 139 -0.329 104.781 16.213 1.00 14.53 C
-ATOM 13406 CD1 TRP H 139 0.873 104.208 16.522 1.00 15.84 C
-ATOM 13407 CD2 TRP H 139 -1.316 104.099 17.019 1.00 12.31 C
-ATOM 13408 NE1 TRP H 139 0.704 103.201 17.427 1.00 14.68 N
-ATOM 13409 CE2 TRP H 139 -0.635 103.124 17.759 1.00 13.44 C
-ATOM 13410 CE3 TRP H 139 -2.698 104.244 17.179 1.00 12.78 C
-ATOM 13411 CZ2 TRP H 139 -1.298 102.286 18.651 1.00 13.57 C
-ATOM 13412 CZ3 TRP H 139 -3.363 103.416 18.068 1.00 14.89 C
-ATOM 13413 CH2 TRP H 139 -2.684 102.462 18.785 1.00 15.01 C
-ATOM 13414 H TRP H 139 1.682 106.052 13.635 1.00 0.00 H
-ATOM 13415 HA TRP H 139 -1.046 104.864 13.479 1.00 0.00 H
-ATOM 13416 1HB TRP H 139 0.109 106.761 15.589 1.00 0.00 H
-ATOM 13417 2HB TRP H 139 -1.578 106.309 15.457 1.00 0.00 H
-ATOM 13418 HD1 TRP H 139 1.834 104.503 16.106 1.00 0.00 H
-ATOM 13419 HE1 TRP H 139 1.479 102.634 17.780 1.00 0.00 H
-ATOM 13420 HE3 TRP H 139 -3.234 105.000 16.615 1.00 0.00 H
-ATOM 13421 HZ2 TRP H 139 -0.776 101.523 19.233 1.00 0.00 H
-ATOM 13422 HZ3 TRP H 139 -4.437 103.544 18.184 1.00 0.00 H
-ATOM 13423 HH2 TRP H 139 -3.239 101.835 19.470 1.00 0.00 H
-ATOM 13424 N GLY H 140 -2.027 107.072 12.623 1.00 16.91 N
-ATOM 13425 CA GLY H 140 -2.494 108.305 11.986 1.00 17.89 C
-ATOM 13426 C GLY H 140 -2.834 109.348 13.056 1.00 18.82 C
-ATOM 13427 O GLY H 140 -2.596 109.115 14.230 1.00 17.92 O
-ATOM 13428 H GLY H 140 -2.673 106.301 12.746 1.00 0.00 H
-ATOM 13429 1HA GLY H 140 -1.714 108.695 11.335 1.00 0.00 H
-ATOM 13430 2HA GLY H 140 -3.362 108.098 11.367 1.00 0.00 H
-ATOM 13431 N GLN H 141 -3.355 110.501 12.640 1.00 20.16 N
-ATOM 13432 CA GLN H 141 -3.637 111.578 13.610 1.00 20.90 C
-ATOM 13433 C GLN H 141 -4.828 111.287 14.542 1.00 20.52 C
-ATOM 13434 O GLN H 141 -4.896 111.824 15.654 1.00 20.68 O
-ATOM 13435 CB GLN H 141 -3.859 112.918 12.883 1.00 21.38 C
-ATOM 13436 CG GLN H 141 -5.278 113.145 12.265 1.00 25.35 C
-ATOM 13437 CD GLN H 141 -5.546 112.575 10.857 1.00 30.68 C
-ATOM 13438 OE1 GLN H 141 -4.701 111.973 10.185 1.00 34.59 O
-ATOM 13439 NE2 GLN H 141 -6.798 112.773 10.431 1.00 30.79 N
-ATOM 13440 H GLN H 141 -3.563 110.642 11.662 1.00 0.00 H
-ATOM 13441 HA GLN H 141 -2.751 111.674 14.246 1.00 0.00 H
-ATOM 13442 1HB GLN H 141 -3.674 113.735 13.578 1.00 0.00 H
-ATOM 13443 2HB GLN H 141 -3.132 113.006 12.078 1.00 0.00 H
-ATOM 13444 1HG GLN H 141 -6.032 112.756 12.930 1.00 0.00 H
-ATOM 13445 2HG GLN H 141 -5.409 114.223 12.188 1.00 0.00 H
-ATOM 13446 1HE2 GLN H 141 -7.134 112.421 9.535 1.00 0.00 H
-ATOM 13447 2HE2 GLN H 141 -7.448 113.253 11.022 1.00 0.00 H
-ATOM 13448 N GLY H 142 -5.757 110.439 14.091 1.00 20.63 N
-ATOM 13449 CA GLY H 142 -6.968 110.099 14.837 1.00 20.11 C
-ATOM 13450 C GLY H 142 -8.195 110.920 14.387 1.00 20.40 C
-ATOM 13451 O GLY H 142 -8.107 112.140 14.235 1.00 20.61 O
-ATOM 13452 H GLY H 142 -5.623 110.022 13.170 1.00 0.00 H
-ATOM 13453 1HA GLY H 142 -7.175 109.037 14.702 1.00 0.00 H
-ATOM 13454 2HA GLY H 142 -6.799 110.255 15.897 1.00 0.00 H
-ATOM 13455 N THR H 143 -9.335 110.252 14.192 1.00 19.74 N
-ATOM 13456 CA THR H 143 -10.581 110.904 13.755 1.00 19.09 C
-ATOM 13457 C THR H 143 -11.768 110.675 14.686 1.00 18.55 C
-ATOM 13458 O THR H 143 -12.061 109.541 15.070 1.00 18.49 O
-ATOM 13459 CB THR H 143 -10.959 110.455 12.341 1.00 19.23 C
-ATOM 13460 OG1 THR H 143 -9.961 110.871 11.435 1.00 19.57 O
-ATOM 13461 CG2 THR H 143 -12.267 111.009 11.917 1.00 21.19 C
-ATOM 13462 H THR H 143 -9.336 109.244 14.338 1.00 0.00 H
-ATOM 13463 HA THR H 143 -10.397 111.979 13.717 1.00 0.00 H
-ATOM 13464 HB THR H 143 -11.021 109.364 12.315 1.00 0.00 H
-ATOM 13465 HG1 THR H 143 -9.118 110.496 11.702 1.00 0.00 H
-ATOM 13466 1HG2 THR H 143 -12.500 110.655 10.912 1.00 0.00 H
-ATOM 13467 2HG2 THR H 143 -13.042 110.665 12.607 1.00 0.00 H
-ATOM 13468 3HG2 THR H 143 -12.228 112.103 11.925 1.00 0.00 H
-ATOM 13469 N LEU H 144 -12.479 111.741 15.036 1.00 17.76 N
-ATOM 13470 CA LEU H 144 -13.617 111.576 15.943 1.00 16.74 C
-ATOM 13471 C LEU H 144 -14.927 111.241 15.260 1.00 16.19 C
-ATOM 13472 O LEU H 144 -15.397 111.948 14.364 1.00 17.22 O
-ATOM 13473 CB LEU H 144 -13.844 112.826 16.804 1.00 16.36 C
-ATOM 13474 CG LEU H 144 -15.081 112.733 17.765 1.00 16.75 C
-ATOM 13475 CD1 LEU H 144 -14.849 111.630 18.811 1.00 16.68 C
-ATOM 13476 CD2 LEU H 144 -15.303 114.062 18.437 1.00 17.13 C
-ATOM 13477 H LEU H 144 -12.222 112.656 14.695 1.00 0.00 H
-ATOM 13478 HA LEU H 144 -13.392 110.761 16.615 1.00 0.00 H
-ATOM 13479 1HB LEU H 144 -12.959 113.000 17.412 1.00 0.00 H
-ATOM 13480 2HB LEU H 144 -13.991 113.683 16.148 1.00 0.00 H
-ATOM 13481 HG LEU H 144 -15.969 112.472 17.186 1.00 0.00 H
-ATOM 13482 1HD1 LEU H 144 -15.717 111.557 19.465 1.00 0.00 H
-ATOM 13483 2HD1 LEU H 144 -14.704 110.691 18.311 1.00 0.00 H
-ATOM 13484 3HD1 LEU H 144 -13.969 111.866 19.402 1.00 0.00 H
-ATOM 13485 1HD2 LEU H 144 -16.172 113.992 19.093 1.00 0.00 H
-ATOM 13486 2HD2 LEU H 144 -14.423 114.326 19.023 1.00 0.00 H
-ATOM 13487 3HD2 LEU H 144 -15.479 114.824 17.679 1.00 0.00 H
-ATOM 13488 N VAL H 145 -15.510 110.152 15.748 1.00 14.35 N
-ATOM 13489 CA VAL H 145 -16.810 109.659 15.361 1.00 13.38 C
-ATOM 13490 C VAL H 145 -17.707 109.781 16.562 1.00 12.70 C
-ATOM 13491 O VAL H 145 -17.384 109.292 17.646 1.00 13.45 O
-ATOM 13492 CB VAL H 145 -16.728 108.188 14.942 1.00 12.88 C
-ATOM 13493 CG1 VAL H 145 -18.147 107.638 14.617 1.00 13.52 C
-ATOM 13494 CG2 VAL H 145 -15.790 108.091 13.761 1.00 13.90 C
-ATOM 13495 H VAL H 145 -15.007 109.621 16.458 1.00 0.00 H
-ATOM 13496 HA VAL H 145 -17.211 110.262 14.543 1.00 0.00 H
-ATOM 13497 HB VAL H 145 -16.333 107.606 15.765 1.00 0.00 H
-ATOM 13498 1HG1 VAL H 145 -18.079 106.591 14.326 1.00 0.00 H
-ATOM 13499 2HG1 VAL H 145 -18.782 107.719 15.500 1.00 0.00 H
-ATOM 13500 3HG1 VAL H 145 -18.588 108.208 13.819 1.00 0.00 H
-ATOM 13501 1HG2 VAL H 145 -15.702 107.061 13.459 1.00 0.00 H
-ATOM 13502 2HG2 VAL H 145 -16.185 108.681 12.944 1.00 0.00 H
-ATOM 13503 3HG2 VAL H 145 -14.806 108.469 14.041 1.00 0.00 H
-ATOM 13504 N THR H 146 -18.846 110.416 16.392 1.00 11.92 N
-ATOM 13505 CA THR H 146 -19.710 110.559 17.543 1.00 11.96 C
-ATOM 13506 C THR H 146 -21.139 110.263 17.171 1.00 11.75 C
-ATOM 13507 O THR H 146 -21.580 110.596 16.072 1.00 11.82 O
-ATOM 13508 CB THR H 146 -19.540 111.970 18.140 1.00 12.10 C
-ATOM 13509 OG1 THR H 146 -20.343 112.104 19.317 1.00 12.99 O
-ATOM 13510 CG2 THR H 146 -19.931 113.016 17.139 1.00 10.64 C
-ATOM 13511 H THR H 146 -19.092 110.813 15.485 1.00 0.00 H
-ATOM 13512 HA THR H 146 -19.420 109.831 18.287 1.00 0.00 H
-ATOM 13513 HB THR H 146 -18.491 112.115 18.411 1.00 0.00 H
-ATOM 13514 HG1 THR H 146 -21.263 111.943 19.099 1.00 0.00 H
-ATOM 13515 1HG2 THR H 146 -19.794 114.002 17.574 1.00 0.00 H
-ATOM 13516 2HG2 THR H 146 -19.308 112.921 16.245 1.00 0.00 H
-ATOM 13517 3HG2 THR H 146 -20.967 112.875 16.880 1.00 0.00 H
-ATOM 13518 N VAL H 147 -21.849 109.631 18.098 1.00 11.44 N
-ATOM 13519 CA VAL H 147 -23.223 109.220 17.831 1.00 11.57 C
-ATOM 13520 C VAL H 147 -24.192 109.913 18.792 1.00 11.94 C
-ATOM 13521 O VAL H 147 -23.988 109.885 20.008 1.00 12.12 O
-ATOM 13522 CB VAL H 147 -23.336 107.684 17.965 1.00 11.55 C
-ATOM 13523 CG1 VAL H 147 -24.755 107.251 17.674 1.00 11.15 C
-ATOM 13524 CG2 VAL H 147 -22.332 106.984 17.040 1.00 10.48 C
-ATOM 13525 H VAL H 147 -21.416 109.397 18.991 1.00 0.00 H
-ATOM 13526 HA VAL H 147 -23.480 109.501 16.815 1.00 0.00 H
-ATOM 13527 HB VAL H 147 -23.106 107.404 18.981 1.00 0.00 H
-ATOM 13528 1HG1 VAL H 147 -24.848 106.177 17.779 1.00 0.00 H
-ATOM 13529 2HG1 VAL H 147 -25.419 107.740 18.368 1.00 0.00 H
-ATOM 13530 3HG1 VAL H 147 -25.015 107.535 16.651 1.00 0.00 H
-ATOM 13531 1HG2 VAL H 147 -22.423 105.913 17.181 1.00 0.00 H
-ATOM 13532 2HG2 VAL H 147 -22.540 107.225 16.020 1.00 0.00 H
-ATOM 13533 3HG2 VAL H 147 -21.317 107.292 17.289 1.00 0.00 H
-ATOM 13534 N SER H 148 -25.218 110.554 18.237 1.00 12.19 N
-ATOM 13535 CA SER H 148 -26.196 111.295 19.038 1.00 12.87 C
-ATOM 13536 C SER H 148 -27.384 111.770 18.211 1.00 12.85 C
-ATOM 13537 O SER H 148 -27.217 112.249 17.090 1.00 12.78 O
-ATOM 13538 OXT SER H 148 -28.523 111.659 18.663 1.00 0.00 O
-ATOM 13539 CB SER H 148 -25.548 112.503 19.697 1.00 12.47 C
-ATOM 13540 OG SER H 148 -26.488 113.242 20.428 1.00 13.74 O
-ATOM 13541 H SER H 148 -25.312 110.500 17.223 1.00 0.00 H
-ATOM 13542 HA SER H 148 -26.577 110.630 19.816 1.00 0.00 H
-ATOM 13543 1HB SER H 148 -24.748 112.190 20.358 1.00 0.00 H
-ATOM 13544 2HB SER H 148 -25.108 113.135 18.937 1.00 0.00 H
-ATOM 13545 HG SER H 148 -26.734 112.689 21.175 1.00 0.00 H
-TER
-ATOM 13547 N ASP L 1 -7.797 84.785 24.286 1.00 30.87 N
-ATOM 13548 CA ASP L 1 -8.158 86.122 24.740 1.00 30.75 C
-ATOM 13549 C ASP L 1 -7.347 86.439 25.987 1.00 29.03 C
-ATOM 13550 O ASP L 1 -7.729 86.081 27.104 1.00 29.42 O
-ATOM 13551 CB ASP L 1 -9.676 86.206 24.983 1.00 30.97 C
-ATOM 13552 CG ASP L 1 -10.234 87.608 25.391 1.00 33.98 C
-ATOM 13553 OD1 ASP L 1 -9.474 88.463 25.792 1.00 37.66 O
-ATOM 13554 OD2 ASP L 1 -11.435 87.770 25.334 1.00 38.04 O
-ATOM 13555 1H ASP L 1 -8.026 84.665 23.312 1.00 0.00 H
-ATOM 13556 2H ASP L 1 -6.802 84.654 24.415 1.00 0.00 H
-ATOM 13557 3H ASP L 1 -8.294 84.099 24.837 1.00 0.00 H
-ATOM 13558 HA ASP L 1 -7.888 86.843 23.965 1.00 0.00 H
-ATOM 13559 1HB ASP L 1 -10.184 85.896 24.067 1.00 0.00 H
-ATOM 13560 2HB ASP L 1 -9.952 85.500 25.758 1.00 0.00 H
-ATOM 13561 N ILE L 2 -6.218 87.106 25.778 1.00 26.30 N
-ATOM 13562 CA ILE L 2 -5.282 87.465 26.841 1.00 22.98 C
-ATOM 13563 C ILE L 2 -5.553 88.904 27.278 1.00 21.67 C
-ATOM 13564 O ILE L 2 -5.582 89.794 26.426 1.00 20.42 O
-ATOM 13565 CB ILE L 2 -3.821 87.407 26.331 1.00 22.50 C
-ATOM 13566 CG1 ILE L 2 -3.475 85.983 25.784 1.00 21.74 C
-ATOM 13567 CG2 ILE L 2 -2.880 87.800 27.487 1.00 21.48 C
-ATOM 13568 CD1 ILE L 2 -2.131 85.870 25.031 1.00 23.80 C
-ATOM 13569 H ILE L 2 -5.989 87.383 24.834 1.00 0.00 H
-ATOM 13570 HA ILE L 2 -5.420 86.802 27.694 1.00 0.00 H
-ATOM 13571 HB ILE L 2 -3.703 88.104 25.509 1.00 0.00 H
-ATOM 13572 1HG1 ILE L 2 -3.458 85.296 26.583 1.00 0.00 H
-ATOM 13573 2HG1 ILE L 2 -4.267 85.682 25.093 1.00 0.00 H
-ATOM 13574 1HG2 ILE L 2 -1.866 87.781 27.143 1.00 0.00 H
-ATOM 13575 2HG2 ILE L 2 -3.125 88.801 27.831 1.00 0.00 H
-ATOM 13576 3HG2 ILE L 2 -2.995 87.102 28.309 1.00 0.00 H
-ATOM 13577 1HD1 ILE L 2 -2.007 84.832 24.686 1.00 0.00 H
-ATOM 13578 2HD1 ILE L 2 -2.118 86.544 24.166 1.00 0.00 H
-ATOM 13579 3HD1 ILE L 2 -1.319 86.122 25.691 1.00 0.00 H
-ATOM 13580 N GLN L 3 -5.746 89.148 28.575 1.00 20.83 N
-ATOM 13581 CA GLN L 3 -6.031 90.506 29.030 1.00 20.08 C
-ATOM 13582 C GLN L 3 -4.818 91.140 29.687 1.00 18.56 C
-ATOM 13583 O GLN L 3 -4.107 90.507 30.479 1.00 18.76 O
-ATOM 13584 CB GLN L 3 -7.194 90.540 30.029 1.00 20.92 C
-ATOM 13585 CG GLN L 3 -8.518 90.062 29.486 1.00 23.86 C
-ATOM 13586 CD GLN L 3 -8.679 88.609 29.664 1.00 29.74 C
-ATOM 13587 OE1 GLN L 3 -8.501 88.124 30.785 1.00 30.18 O
-ATOM 13588 NE2 GLN L 3 -9.001 87.891 28.606 1.00 33.10 N
-ATOM 13589 H GLN L 3 -5.704 88.404 29.262 1.00 0.00 H
-ATOM 13590 HA GLN L 3 -6.302 91.115 28.164 1.00 0.00 H
-ATOM 13591 1HB GLN L 3 -6.947 89.917 30.884 1.00 0.00 H
-ATOM 13592 2HB GLN L 3 -7.329 91.559 30.398 1.00 0.00 H
-ATOM 13593 1HG GLN L 3 -9.321 90.551 30.035 1.00 0.00 H
-ATOM 13594 2HG GLN L 3 -8.591 90.276 28.421 1.00 0.00 H
-ATOM 13595 1HE2 GLN L 3 -9.115 86.896 28.684 1.00 0.00 H
-ATOM 13596 2HE2 GLN L 3 -9.124 88.338 27.691 1.00 0.00 H
-ATOM 13597 N MET L 4 -4.577 92.391 29.344 1.00 16.52 N
-ATOM 13598 CA MET L 4 -3.523 93.187 29.947 1.00 15.09 C
-ATOM 13599 C MET L 4 -4.000 93.898 31.208 1.00 14.61 C
-ATOM 13600 O MET L 4 -4.981 94.650 31.160 1.00 15.71 O
-ATOM 13601 CB MET L 4 -3.059 94.192 28.907 1.00 14.90 C
-ATOM 13602 CG MET L 4 -2.406 93.595 27.679 1.00 15.39 C
-ATOM 13603 SD MET L 4 -0.799 92.865 28.049 1.00 15.99 S
-ATOM 13604 CE MET L 4 -1.217 91.175 28.302 1.00 20.31 C
-ATOM 13605 H MET L 4 -5.171 92.828 28.650 1.00 0.00 H
-ATOM 13606 HA MET L 4 -2.695 92.531 30.222 1.00 0.00 H
-ATOM 13607 1HB MET L 4 -3.933 94.722 28.559 1.00 0.00 H
-ATOM 13608 2HB MET L 4 -2.404 94.902 29.351 1.00 0.00 H
-ATOM 13609 1HG MET L 4 -3.047 92.832 27.228 1.00 0.00 H
-ATOM 13610 2HG MET L 4 -2.259 94.389 26.954 1.00 0.00 H
-ATOM 13611 1HE MET L 4 -0.312 90.618 28.516 1.00 0.00 H
-ATOM 13612 2HE MET L 4 -1.903 91.101 29.145 1.00 0.00 H
-ATOM 13613 3HE MET L 4 -1.693 90.782 27.418 1.00 0.00 H
-ATOM 13614 N THR L 5 -3.310 93.694 32.335 1.00 13.30 N
-ATOM 13615 CA THR L 5 -3.662 94.372 33.572 1.00 13.22 C
-ATOM 13616 C THR L 5 -2.550 95.300 33.969 1.00 13.35 C
-ATOM 13617 O THR L 5 -1.447 94.866 34.362 1.00 12.65 O
-ATOM 13618 CB THR L 5 -3.939 93.360 34.711 1.00 13.63 C
-ATOM 13619 OG1 THR L 5 -5.028 92.502 34.337 1.00 16.67 O
-ATOM 13620 CG2 THR L 5 -4.297 94.098 36.003 1.00 11.66 C
-ATOM 13621 H THR L 5 -2.524 93.044 32.339 1.00 0.00 H
-ATOM 13622 HA THR L 5 -4.561 94.970 33.420 1.00 0.00 H
-ATOM 13623 HB THR L 5 -3.052 92.754 34.876 1.00 0.00 H
-ATOM 13624 HG1 THR L 5 -5.779 93.035 34.084 1.00 0.00 H
-ATOM 13625 1HG2 THR L 5 -4.484 93.369 36.789 1.00 0.00 H
-ATOM 13626 2HG2 THR L 5 -3.466 94.742 36.289 1.00 0.00 H
-ATOM 13627 3HG2 THR L 5 -5.190 94.704 35.846 1.00 0.00 H
-ATOM 13628 N GLN L 6 -2.797 96.587 33.857 1.00 14.17 N
-ATOM 13629 CA GLN L 6 -1.759 97.567 34.075 1.00 14.17 C
-ATOM 13630 C GLN L 6 -1.985 98.358 35.347 1.00 14.86 C
-ATOM 13631 O GLN L 6 -3.101 98.794 35.623 1.00 14.78 O
-ATOM 13632 CB GLN L 6 -1.643 98.493 32.873 1.00 13.40 C
-ATOM 13633 CG GLN L 6 -0.478 99.474 32.946 1.00 13.93 C
-ATOM 13634 CD GLN L 6 -0.365 100.250 31.679 1.00 13.05 C
-ATOM 13635 OE1 GLN L 6 0.612 100.938 31.415 1.00 17.74 O
-ATOM 13636 NE2 GLN L 6 -1.403 100.138 30.872 1.00 11.59 N
-ATOM 13637 H GLN L 6 -3.723 96.883 33.571 1.00 0.00 H
-ATOM 13638 HA GLN L 6 -0.817 97.056 34.179 1.00 0.00 H
-ATOM 13639 1HB GLN L 6 -1.536 97.898 31.965 1.00 0.00 H
-ATOM 13640 2HB GLN L 6 -2.568 99.072 32.768 1.00 0.00 H
-ATOM 13641 1HG GLN L 6 -0.673 100.174 33.761 1.00 0.00 H
-ATOM 13642 2HG GLN L 6 0.443 98.925 33.115 1.00 0.00 H
-ATOM 13643 1HE2 GLN L 6 -1.428 100.624 30.005 1.00 0.00 H
-ATOM 13644 2HE2 GLN L 6 -2.165 99.552 31.139 1.00 0.00 H
-ATOM 13645 N SER L 7 -0.914 98.535 36.104 1.00 15.40 N
-ATOM 13646 CA SER L 7 -0.992 99.276 37.340 1.00 16.30 C
-ATOM 13647 C SER L 7 0.287 100.068 37.625 1.00 15.74 C
-ATOM 13648 O SER L 7 1.368 99.711 37.148 1.00 16.51 O
-ATOM 13649 CB SER L 7 -1.216 98.312 38.506 1.00 17.40 C
-ATOM 13650 OG SER L 7 -0.120 97.454 38.659 1.00 20.36 O
-ATOM 13651 H SER L 7 -0.032 98.125 35.816 1.00 0.00 H
-ATOM 13652 HA SER L 7 -1.847 99.936 37.269 1.00 0.00 H
-ATOM 13653 1HB SER L 7 -1.351 98.859 39.438 1.00 0.00 H
-ATOM 13654 2HB SER L 7 -2.126 97.736 38.344 1.00 0.00 H
-ATOM 13655 HG SER L 7 0.654 98.009 38.635 1.00 0.00 H
-ATOM 13656 N PRO L 8 0.151 101.153 38.377 1.00 14.47 N
-ATOM 13657 CA PRO L 8 -1.045 101.776 38.909 1.00 13.73 C
-ATOM 13658 C PRO L 8 -1.797 102.502 37.779 1.00 14.34 C
-ATOM 13659 O PRO L 8 -1.222 102.758 36.749 1.00 14.63 O
-ATOM 13660 CB PRO L 8 -0.476 102.740 39.948 1.00 12.94 C
-ATOM 13661 CG PRO L 8 0.899 103.075 39.429 1.00 13.01 C
-ATOM 13662 CD PRO L 8 1.405 101.829 38.748 1.00 14.04 C
-ATOM 13663 HA PRO L 8 -1.696 101.043 39.385 1.00 0.00 H
-ATOM 13664 1HB PRO L 8 -1.115 103.626 40.040 1.00 0.00 H
-ATOM 13665 2HB PRO L 8 -0.475 102.248 40.945 1.00 0.00 H
-ATOM 13666 1HG PRO L 8 0.821 103.923 38.735 1.00 0.00 H
-ATOM 13667 2HG PRO L 8 1.558 103.400 40.253 1.00 0.00 H
-ATOM 13668 1HD PRO L 8 1.998 102.078 37.846 1.00 0.00 H
-ATOM 13669 2HD PRO L 8 1.972 101.190 39.441 1.00 0.00 H
-ATOM 13670 N SER L 9 -3.087 102.802 37.975 1.00 14.12 N
-ATOM 13671 CA SER L 9 -3.841 103.549 36.930 1.00 14.21 C
-ATOM 13672 C SER L 9 -3.282 104.964 36.719 1.00 13.42 C
-ATOM 13673 O SER L 9 -3.488 105.600 35.686 1.00 12.87 O
-ATOM 13674 CB SER L 9 -5.318 103.598 37.292 1.00 14.51 C
-ATOM 13675 OG SER L 9 -5.543 104.363 38.444 1.00 16.53 O
-ATOM 13676 H SER L 9 -3.555 102.554 38.821 1.00 0.00 H
-ATOM 13677 HA SER L 9 -3.748 103.009 35.986 1.00 0.00 H
-ATOM 13678 1HB SER L 9 -5.882 104.028 36.454 1.00 0.00 H
-ATOM 13679 2HB SER L 9 -5.674 102.590 37.451 1.00 0.00 H
-ATOM 13680 HG SER L 9 -4.883 104.081 39.082 1.00 0.00 H
-ATOM 13681 N SER L 10 -2.563 105.450 37.713 1.00 12.04 N
-ATOM 13682 CA SER L 10 -1.901 106.744 37.624 1.00 12.20 C
-ATOM 13683 C SER L 10 -0.784 106.775 38.630 1.00 12.74 C
-ATOM 13684 O SER L 10 -0.850 106.109 39.672 1.00 12.71 O
-ATOM 13685 CB SER L 10 -2.878 107.873 37.871 1.00 11.85 C
-ATOM 13686 OG SER L 10 -3.308 107.872 39.206 1.00 12.91 O
-ATOM 13687 H SER L 10 -2.435 104.894 38.540 1.00 0.00 H
-ATOM 13688 HA SER L 10 -1.472 106.847 36.630 1.00 0.00 H
-ATOM 13689 1HB SER L 10 -2.381 108.819 37.653 1.00 0.00 H
-ATOM 13690 2HB SER L 10 -3.734 107.792 37.204 1.00 0.00 H
-ATOM 13691 HG SER L 10 -2.520 107.994 39.731 1.00 0.00 H
-ATOM 13692 N LEU L 11 0.197 107.609 38.380 1.00 12.34 N
-ATOM 13693 CA LEU L 11 1.270 107.798 39.341 1.00 13.21 C
-ATOM 13694 C LEU L 11 1.798 109.209 39.260 1.00 13.08 C
-ATOM 13695 O LEU L 11 1.717 109.837 38.204 1.00 13.27 O
-ATOM 13696 CB LEU L 11 2.396 106.782 39.103 1.00 13.46 C
-ATOM 13697 CG LEU L 11 3.139 106.873 37.760 1.00 15.99 C
-ATOM 13698 CD1 LEU L 11 4.382 107.753 37.940 1.00 15.38 C
-ATOM 13699 CD2 LEU L 11 3.509 105.455 37.272 1.00 13.61 C
-ATOM 13700 H LEU L 11 0.185 108.127 37.500 1.00 0.00 H
-ATOM 13701 HA LEU L 11 0.868 107.647 40.345 1.00 0.00 H
-ATOM 13702 1HB LEU L 11 3.139 106.911 39.889 1.00 0.00 H
-ATOM 13703 2HB LEU L 11 1.991 105.788 39.185 1.00 0.00 H
-ATOM 13704 HG LEU L 11 2.496 107.348 37.024 1.00 0.00 H
-ATOM 13705 1HD1 LEU L 11 4.909 107.835 37.000 1.00 0.00 H
-ATOM 13706 2HD1 LEU L 11 4.090 108.748 38.273 1.00 0.00 H
-ATOM 13707 3HD1 LEU L 11 5.042 107.306 38.679 1.00 0.00 H
-ATOM 13708 1HD2 LEU L 11 4.028 105.517 36.316 1.00 0.00 H
-ATOM 13709 2HD2 LEU L 11 4.159 104.967 38.000 1.00 0.00 H
-ATOM 13710 3HD2 LEU L 11 2.599 104.866 37.146 1.00 0.00 H
-ATOM 13711 N SER L 12 2.371 109.676 40.350 1.00 13.10 N
-ATOM 13712 CA SER L 12 3.009 110.973 40.328 1.00 13.49 C
-ATOM 13713 C SER L 12 4.484 110.797 40.619 1.00 12.78 C
-ATOM 13714 O SER L 12 4.862 110.068 41.534 1.00 12.65 O
-ATOM 13715 CB SER L 12 2.388 111.879 41.380 1.00 14.27 C
-ATOM 13716 OG SER L 12 1.018 112.073 41.148 1.00 18.11 O
-ATOM 13717 H SER L 12 2.386 109.116 41.193 1.00 0.00 H
-ATOM 13718 HA SER L 12 2.891 111.424 39.343 1.00 0.00 H
-ATOM 13719 1HB SER L 12 2.537 111.458 42.371 1.00 0.00 H
-ATOM 13720 2HB SER L 12 2.895 112.837 41.346 1.00 0.00 H
-ATOM 13721 HG SER L 12 0.940 112.447 40.259 1.00 0.00 H
-ATOM 13722 N ALA L 13 5.313 111.504 39.869 1.00 11.97 N
-ATOM 13723 CA ALA L 13 6.757 111.461 40.084 1.00 11.69 C
-ATOM 13724 C ALA L 13 7.367 112.791 39.665 1.00 11.56 C
-ATOM 13725 O ALA L 13 6.782 113.504 38.856 1.00 12.89 O
-ATOM 13726 CB ALA L 13 7.364 110.295 39.322 1.00 9.72 C
-ATOM 13727 H ALA L 13 4.925 112.060 39.106 1.00 0.00 H
-ATOM 13728 HA ALA L 13 6.954 111.330 41.150 1.00 0.00 H
-ATOM 13729 1HB ALA L 13 8.431 110.271 39.493 1.00 0.00 H
-ATOM 13730 2HB ALA L 13 6.921 109.360 39.665 1.00 0.00 H
-ATOM 13731 3HB ALA L 13 7.164 110.415 38.279 1.00 0.00 H
-ATOM 13732 N SER L 14 8.522 113.141 40.221 1.00 10.83 N
-ATOM 13733 CA SER L 14 9.182 114.404 39.878 1.00 10.30 C
-ATOM 13734 C SER L 14 10.093 114.316 38.678 1.00 10.70 C
-ATOM 13735 O SER L 14 10.597 113.249 38.330 1.00 10.27 O
-ATOM 13736 CB SER L 14 9.977 114.940 41.053 1.00 10.33 C
-ATOM 13737 OG SER L 14 9.131 115.356 42.076 1.00 9.39 O
-ATOM 13738 H SER L 14 8.991 112.513 40.879 1.00 0.00 H
-ATOM 13739 HA SER L 14 8.410 115.127 39.642 1.00 0.00 H
-ATOM 13740 1HB SER L 14 10.655 114.175 41.424 1.00 0.00 H
-ATOM 13741 2HB SER L 14 10.589 115.783 40.716 1.00 0.00 H
-ATOM 13742 HG SER L 14 8.665 116.151 41.709 1.00 0.00 H
-ATOM 13743 N VAL L 15 10.381 115.451 38.069 1.00 11.55 N
-ATOM 13744 CA VAL L 15 11.377 115.395 37.006 1.00 10.98 C
-ATOM 13745 C VAL L 15 12.695 114.856 37.590 1.00 11.39 C
-ATOM 13746 O VAL L 15 13.165 115.331 38.626 1.00 12.57 O
-ATOM 13747 CB VAL L 15 11.598 116.779 36.376 1.00 10.64 C
-ATOM 13748 CG1 VAL L 15 12.741 116.725 35.380 1.00 10.01 C
-ATOM 13749 CG2 VAL L 15 10.323 117.206 35.699 1.00 8.46 C
-ATOM 13750 H VAL L 15 9.893 116.315 38.334 1.00 0.00 H
-ATOM 13751 HA VAL L 15 11.021 114.715 36.230 1.00 0.00 H
-ATOM 13752 HB VAL L 15 11.867 117.498 37.149 1.00 0.00 H
-ATOM 13753 1HG1 VAL L 15 12.889 117.709 34.938 1.00 0.00 H
-ATOM 13754 2HG1 VAL L 15 13.655 116.417 35.882 1.00 0.00 H
-ATOM 13755 3HG1 VAL L 15 12.500 116.011 34.604 1.00 0.00 H
-ATOM 13756 1HG2 VAL L 15 10.450 118.188 35.248 1.00 0.00 H
-ATOM 13757 2HG2 VAL L 15 10.065 116.477 34.932 1.00 0.00 H
-ATOM 13758 3HG2 VAL L 15 9.535 117.251 36.449 1.00 0.00 H
-ATOM 13759 N GLY L 16 13.268 113.849 36.927 1.00 11.20 N
-ATOM 13760 CA GLY L 16 14.494 113.177 37.354 1.00 11.26 C
-ATOM 13761 C GLY L 16 14.241 111.850 38.084 1.00 11.50 C
-ATOM 13762 O GLY L 16 15.155 111.042 38.241 1.00 11.42 O
-ATOM 13763 H GLY L 16 12.823 113.539 36.071 1.00 0.00 H
-ATOM 13764 1HA GLY L 16 15.123 112.994 36.484 1.00 0.00 H
-ATOM 13765 2HA GLY L 16 15.055 113.842 38.009 1.00 0.00 H
-ATOM 13766 N ASP L 17 13.006 111.614 38.517 1.00 12.30 N
-ATOM 13767 CA ASP L 17 12.668 110.369 39.195 1.00 13.40 C
-ATOM 13768 C ASP L 17 12.641 109.179 38.253 1.00 13.60 C
-ATOM 13769 O ASP L 17 12.368 109.305 37.057 1.00 13.10 O
-ATOM 13770 CB ASP L 17 11.323 110.463 39.920 1.00 13.33 C
-ATOM 13771 CG ASP L 17 11.378 111.266 41.225 1.00 16.59 C
-ATOM 13772 OD1 ASP L 17 10.327 111.636 41.725 1.00 12.90 O
-ATOM 13773 OD2 ASP L 17 12.456 111.481 41.731 1.00 20.18 O
-ATOM 13774 H ASP L 17 12.276 112.309 38.373 1.00 0.00 H
-ATOM 13775 HA ASP L 17 13.431 110.180 39.949 1.00 0.00 H
-ATOM 13776 1HB ASP L 17 10.604 110.936 39.260 1.00 0.00 H
-ATOM 13777 2HB ASP L 17 10.957 109.450 40.133 1.00 0.00 H
-ATOM 13778 N ARG L 18 12.896 108.006 38.803 1.00 14.34 N
-ATOM 13779 CA ARG L 18 12.772 106.789 38.026 1.00 14.57 C
-ATOM 13780 C ARG L 18 11.330 106.318 38.133 1.00 14.43 C
-ATOM 13781 O ARG L 18 10.783 106.242 39.237 1.00 14.86 O
-ATOM 13782 CB ARG L 18 13.744 105.733 38.522 1.00 13.90 C
-ATOM 13783 CG ARG L 18 13.751 104.419 37.751 1.00 18.57 C
-ATOM 13784 CD ARG L 18 14.857 103.537 38.242 1.00 22.02 C
-ATOM 13785 NE ARG L 18 14.955 102.272 37.520 1.00 25.09 N
-ATOM 13786 CZ ARG L 18 14.381 101.113 37.910 1.00 26.51 C
-ATOM 13787 NH1 ARG L 18 13.668 101.065 39.014 1.00 24.55 N
-ATOM 13788 NH2 ARG L 18 14.540 100.019 37.182 1.00 26.39 N
-ATOM 13789 H ARG L 18 13.154 107.955 39.779 1.00 0.00 H
-ATOM 13790 HA ARG L 18 13.001 107.004 36.983 1.00 0.00 H
-ATOM 13791 1HB ARG L 18 14.756 106.137 38.476 1.00 0.00 H
-ATOM 13792 2HB ARG L 18 13.531 105.502 39.565 1.00 0.00 H
-ATOM 13793 1HG ARG L 18 12.798 103.906 37.886 1.00 0.00 H
-ATOM 13794 2HG ARG L 18 13.904 104.627 36.691 1.00 0.00 H
-ATOM 13795 1HD ARG L 18 15.806 104.065 38.137 1.00 0.00 H
-ATOM 13796 2HD ARG L 18 14.684 103.314 39.293 1.00 0.00 H
-ATOM 13797 HE ARG L 18 15.498 102.263 36.665 1.00 0.00 H
-ATOM 13798 1HH1 ARG L 18 13.546 101.896 39.575 1.00 0.00 H
-ATOM 13799 2HH1 ARG L 18 13.243 100.195 39.304 1.00 0.00 H
-ATOM 13800 1HH2 ARG L 18 15.090 100.050 36.333 1.00 0.00 H
-ATOM 13801 2HH2 ARG L 18 14.112 99.152 37.473 1.00 0.00 H
-ATOM 13802 N VAL L 19 10.702 106.060 36.991 1.00 15.05 N
-ATOM 13803 CA VAL L 19 9.302 105.635 36.970 1.00 15.89 C
-ATOM 13804 C VAL L 19 9.131 104.186 36.555 1.00 16.19 C
-ATOM 13805 O VAL L 19 9.693 103.740 35.551 1.00 17.02 O
-ATOM 13806 CB VAL L 19 8.456 106.538 36.043 1.00 16.35 C
-ATOM 13807 CG1 VAL L 19 7.039 106.017 35.930 1.00 16.00 C
-ATOM 13808 CG2 VAL L 19 8.423 107.929 36.611 1.00 17.14 C
-ATOM 13809 H VAL L 19 11.228 106.158 36.121 1.00 0.00 H
-ATOM 13810 HA VAL L 19 8.904 105.747 37.980 1.00 0.00 H
-ATOM 13811 HB VAL L 19 8.881 106.547 35.064 1.00 0.00 H
-ATOM 13812 1HG1 VAL L 19 6.457 106.666 35.276 1.00 0.00 H
-ATOM 13813 2HG1 VAL L 19 7.060 105.015 35.511 1.00 0.00 H
-ATOM 13814 3HG1 VAL L 19 6.580 105.989 36.914 1.00 0.00 H
-ATOM 13815 1HG2 VAL L 19 7.825 108.559 35.967 1.00 0.00 H
-ATOM 13816 2HG2 VAL L 19 7.978 107.898 37.605 1.00 0.00 H
-ATOM 13817 3HG2 VAL L 19 9.437 108.328 36.680 1.00 0.00 H
-ATOM 13818 N THR L 20 8.349 103.445 37.342 1.00 17.41 N
-ATOM 13819 CA THR L 20 8.067 102.047 37.049 1.00 18.16 C
-ATOM 13820 C THR L 20 6.578 101.845 36.777 1.00 17.74 C
-ATOM 13821 O THR L 20 5.733 102.204 37.600 1.00 18.50 O
-ATOM 13822 CB THR L 20 8.473 101.132 38.229 1.00 18.59 C
-ATOM 13823 OG1 THR L 20 9.870 101.270 38.499 1.00 22.60 O
-ATOM 13824 CG2 THR L 20 8.193 99.667 37.890 1.00 20.36 C
-ATOM 13825 H THR L 20 7.934 103.874 38.160 1.00 0.00 H
-ATOM 13826 HA THR L 20 8.620 101.750 36.156 1.00 0.00 H
-ATOM 13827 HB THR L 20 7.904 101.411 39.119 1.00 0.00 H
-ATOM 13828 HG1 THR L 20 10.367 100.988 37.732 1.00 0.00 H
-ATOM 13829 1HG2 THR L 20 8.483 99.039 38.730 1.00 0.00 H
-ATOM 13830 2HG2 THR L 20 7.129 99.525 37.685 1.00 0.00 H
-ATOM 13831 3HG2 THR L 20 8.769 99.390 37.013 1.00 0.00 H
-ATOM 13832 N ILE L 21 6.274 101.260 35.620 1.00 17.53 N
-ATOM 13833 CA ILE L 21 4.912 100.922 35.199 1.00 17.17 C
-ATOM 13834 C ILE L 21 4.815 99.409 34.955 1.00 18.02 C
-ATOM 13835 O ILE L 21 5.639 98.855 34.213 1.00 18.81 O
-ATOM 13836 CB ILE L 21 4.542 101.718 33.936 1.00 16.88 C
-ATOM 13837 CG1 ILE L 21 4.578 103.258 34.238 1.00 16.87 C
-ATOM 13838 CG2 ILE L 21 3.183 101.247 33.431 1.00 17.53 C
-ATOM 13839 CD1 ILE L 21 4.572 104.143 33.010 1.00 14.13 C
-ATOM 13840 H ILE L 21 7.035 101.038 34.982 1.00 0.00 H
-ATOM 13841 HA ILE L 21 4.218 101.193 36.001 1.00 0.00 H
-ATOM 13842 HB ILE L 21 5.282 101.541 33.177 1.00 0.00 H
-ATOM 13843 1HG1 ILE L 21 3.706 103.512 34.846 1.00 0.00 H
-ATOM 13844 2HG1 ILE L 21 5.469 103.490 34.803 1.00 0.00 H
-ATOM 13845 1HG2 ILE L 21 2.922 101.787 32.524 1.00 0.00 H
-ATOM 13846 2HG2 ILE L 21 3.225 100.181 33.214 1.00 0.00 H
-ATOM 13847 3HG2 ILE L 21 2.422 101.426 34.194 1.00 0.00 H
-ATOM 13848 1HD1 ILE L 21 4.595 105.189 33.306 1.00 0.00 H
-ATOM 13849 2HD1 ILE L 21 5.452 103.924 32.412 1.00 0.00 H
-ATOM 13850 3HD1 ILE L 21 3.685 103.955 32.428 1.00 0.00 H
-ATOM 13851 N THR L 22 3.838 98.726 35.569 1.00 18.36 N
-ATOM 13852 CA THR L 22 3.782 97.266 35.423 1.00 18.92 C
-ATOM 13853 C THR L 22 2.519 96.782 34.721 1.00 18.76 C
-ATOM 13854 O THR L 22 1.410 97.182 35.047 1.00 17.69 O
-ATOM 13855 CB THR L 22 3.842 96.589 36.811 1.00 19.27 C
-ATOM 13856 OG1 THR L 22 5.061 96.962 37.461 1.00 22.39 O
-ATOM 13857 CG2 THR L 22 3.813 95.042 36.682 1.00 19.33 C
-ATOM 13858 H THR L 22 3.140 99.201 36.142 1.00 0.00 H
-ATOM 13859 HA THR L 22 4.632 96.934 34.844 1.00 0.00 H
-ATOM 13860 HB THR L 22 2.992 96.923 37.414 1.00 0.00 H
-ATOM 13861 HG1 THR L 22 5.794 96.722 36.905 1.00 0.00 H
-ATOM 13862 1HG2 THR L 22 3.867 94.593 37.678 1.00 0.00 H
-ATOM 13863 2HG2 THR L 22 2.889 94.706 36.199 1.00 0.00 H
-ATOM 13864 3HG2 THR L 22 4.666 94.703 36.093 1.00 0.00 H
-ATOM 13865 N CYS L 23 2.721 95.873 33.756 1.00 19.34 N
-ATOM 13866 CA CYS L 23 1.608 95.311 33.027 1.00 21.34 C
-ATOM 13867 C CYS L 23 1.604 93.773 33.098 1.00 20.70 C
-ATOM 13868 O CYS L 23 2.446 93.137 32.427 1.00 21.85 O
-ATOM 13869 CB CYS L 23 1.583 95.778 31.599 1.00 22.14 C
-ATOM 13870 SG CYS L 23 0.228 95.150 30.618 1.00 29.34 S
-ATOM 13871 H CYS L 23 3.651 95.612 33.510 1.00 0.00 H
-ATOM 13872 HA CYS L 23 0.667 95.631 33.512 1.00 0.00 H
-ATOM 13873 1HB CYS L 23 1.517 96.867 31.596 1.00 0.00 H
-ATOM 13874 2HB CYS L 23 2.523 95.504 31.105 1.00 0.00 H
-ATOM 13875 N ARG L 24 0.719 93.211 33.875 1.00 19.88 N
-ATOM 13876 CA ARG L 24 0.643 91.776 34.091 1.00 19.34 C
-ATOM 13877 C ARG L 24 -0.267 91.118 33.091 1.00 18.34 C
-ATOM 13878 O ARG L 24 -1.354 91.619 32.797 1.00 19.15 O
-ATOM 13879 CB ARG L 24 0.137 91.453 35.489 1.00 19.50 C
-ATOM 13880 CG ARG L 24 -0.024 89.962 35.774 1.00 22.36 C
-ATOM 13881 CD ARG L 24 -0.337 89.699 37.198 1.00 27.55 C
-ATOM 13882 NE ARG L 24 0.807 89.970 38.047 1.00 32.88 N
-ATOM 13883 CZ ARG L 24 0.808 89.952 39.394 1.00 33.56 C
-ATOM 13884 NH1 ARG L 24 -0.300 89.704 40.075 1.00 31.93 N
-ATOM 13885 NH2 ARG L 24 1.943 90.184 40.031 1.00 31.60 N
-ATOM 13886 H ARG L 24 0.051 93.813 34.352 1.00 0.00 H
-ATOM 13887 HA ARG L 24 1.646 91.362 33.987 1.00 0.00 H
-ATOM 13888 1HB ARG L 24 0.815 91.860 36.232 1.00 0.00 H
-ATOM 13889 2HB ARG L 24 -0.831 91.914 35.641 1.00 0.00 H
-ATOM 13890 1HG ARG L 24 -0.831 89.558 35.163 1.00 0.00 H
-ATOM 13891 2HG ARG L 24 0.915 89.440 35.523 1.00 0.00 H
-ATOM 13892 1HD ARG L 24 -1.171 90.329 37.513 1.00 0.00 H
-ATOM 13893 2HD ARG L 24 -0.611 88.650 37.322 1.00 0.00 H
-ATOM 13894 HE ARG L 24 1.694 90.223 37.581 1.00 0.00 H
-ATOM 13895 1HH1 ARG L 24 -1.170 89.528 39.589 1.00 0.00 H
-ATOM 13896 2HH1 ARG L 24 -0.277 89.703 41.085 1.00 0.00 H
-ATOM 13897 1HH2 ARG L 24 2.807 90.326 39.484 1.00 0.00 H
-ATOM 13898 2HH2 ARG L 24 1.967 90.187 41.036 1.00 0.00 H
-ATOM 13899 N ALA L 25 0.166 90.003 32.527 1.00 16.94 N
-ATOM 13900 CA ALA L 25 -0.721 89.307 31.613 1.00 15.82 C
-ATOM 13901 C ALA L 25 -1.620 88.344 32.381 1.00 14.74 C
-ATOM 13902 O ALA L 25 -1.151 87.628 33.268 1.00 14.55 O
-ATOM 13903 CB ALA L 25 0.067 88.566 30.570 1.00 14.79 C
-ATOM 13904 H ALA L 25 1.097 89.640 32.746 1.00 0.00 H
-ATOM 13905 HA ALA L 25 -1.353 90.040 31.118 1.00 0.00 H
-ATOM 13906 1HB ALA L 25 -0.640 88.107 29.893 1.00 0.00 H
-ATOM 13907 2HB ALA L 25 0.695 89.257 30.021 1.00 0.00 H
-ATOM 13908 3HB ALA L 25 0.691 87.806 31.036 1.00 0.00 H
-ATOM 13909 N SER L 26 -2.904 88.278 32.009 1.00 14.96 N
-ATOM 13910 CA SER L 26 -3.838 87.328 32.628 1.00 15.34 C
-ATOM 13911 C SER L 26 -3.539 85.885 32.232 1.00 16.33 C
-ATOM 13912 O SER L 26 -3.944 84.940 32.921 1.00 16.14 O
-ATOM 13913 CB SER L 26 -5.244 87.635 32.161 1.00 14.97 C
-ATOM 13914 OG SER L 26 -5.389 87.279 30.811 1.00 15.68 O
-ATOM 13915 H SER L 26 -3.257 88.925 31.305 1.00 0.00 H
-ATOM 13916 HA SER L 26 -3.770 87.442 33.722 1.00 0.00 H
-ATOM 13917 1HB SER L 26 -5.964 87.078 32.757 1.00 0.00 H
-ATOM 13918 2HB SER L 26 -5.454 88.694 32.293 1.00 0.00 H
-ATOM 13919 HG SER L 26 -5.479 86.327 30.813 1.00 0.00 H
-ATOM 13920 N GLN L 27 -2.843 85.745 31.109 1.00 16.83 N
-ATOM 13921 CA GLN L 27 -2.424 84.473 30.520 1.00 17.52 C
-ATOM 13922 C GLN L 27 -0.977 84.653 30.089 1.00 17.20 C
-ATOM 13923 O GLN L 27 -0.526 85.796 29.891 1.00 16.06 O
-ATOM 13924 CB GLN L 27 -3.291 84.048 29.319 1.00 17.71 C
-ATOM 13925 CG GLN L 27 -4.792 83.899 29.641 1.00 21.67 C
-ATOM 13926 CD GLN L 27 -5.684 83.444 28.463 1.00 24.32 C
-ATOM 13927 OE1 GLN L 27 -5.542 83.867 27.309 1.00 25.52 O
-ATOM 13928 NE2 GLN L 27 -6.634 82.562 28.785 1.00 24.24 N
-ATOM 13929 H GLN L 27 -2.593 86.592 30.643 1.00 0.00 H
-ATOM 13930 HA GLN L 27 -2.445 83.675 31.268 1.00 0.00 H
-ATOM 13931 1HB GLN L 27 -3.185 84.750 28.537 1.00 0.00 H
-ATOM 13932 2HB GLN L 27 -2.905 83.082 28.931 1.00 0.00 H
-ATOM 13933 1HG GLN L 27 -4.896 83.182 30.455 1.00 0.00 H
-ATOM 13934 2HG GLN L 27 -5.139 84.859 29.943 1.00 0.00 H
-ATOM 13935 1HE2 GLN L 27 -7.269 82.222 28.089 1.00 0.00 H
-ATOM 13936 2HE2 GLN L 27 -6.727 82.254 29.737 1.00 0.00 H
-ATOM 13937 N ASP L 28 -0.218 83.602 29.962 1.00 16.80 N
-ATOM 13938 CA ASP L 28 1.169 83.774 29.526 1.00 16.46 C
-ATOM 13939 C ASP L 28 1.321 84.451 28.171 1.00 15.86 C
-ATOM 13940 O ASP L 28 0.554 84.111 27.239 1.00 15.43 O
-ATOM 13941 CB ASP L 28 1.967 82.500 29.550 1.00 16.91 C
-ATOM 13942 CG ASP L 28 3.490 82.808 29.375 1.00 18.06 C
-ATOM 13943 OD1 ASP L 28 4.250 81.876 29.352 1.00 17.54 O
-ATOM 13944 OD2 ASP L 28 3.880 83.967 29.244 1.00 20.78 O
-ATOM 13945 H ASP L 28 -0.630 82.675 30.129 1.00 0.00 H
-ATOM 13946 HA ASP L 28 1.628 84.449 30.234 1.00 0.00 H
-ATOM 13947 1HB ASP L 28 1.775 81.915 30.473 1.00 0.00 H
-ATOM 13948 2HB ASP L 28 1.634 81.892 28.723 1.00 0.00 H
-ATOM 13949 N VAL L 29 2.239 85.385 27.994 1.00 15.17 N
-ATOM 13950 CA VAL L 29 2.475 86.116 26.776 1.00 14.28 C
-ATOM 13951 C VAL L 29 3.861 85.881 26.127 1.00 13.66 C
-ATOM 13952 O VAL L 29 4.119 86.405 25.063 1.00 13.85 O
-ATOM 13953 CB VAL L 29 2.252 87.617 26.897 1.00 14.13 C
-ATOM 13954 CG1 VAL L 29 2.603 88.343 25.630 1.00 17.00 C
-ATOM 13955 CG2 VAL L 29 0.868 87.817 27.204 1.00 15.17 C
-ATOM 13956 H VAL L 29 2.856 85.544 28.815 1.00 0.00 H
-ATOM 13957 HA VAL L 29 1.704 85.773 26.039 1.00 0.00 H
-ATOM 13958 HB VAL L 29 2.852 88.017 27.698 1.00 0.00 H
-ATOM 13959 1HG1 VAL L 29 2.402 89.380 25.761 1.00 0.00 H
-ATOM 13960 2HG1 VAL L 29 3.658 88.178 25.419 1.00 0.00 H
-ATOM 13961 3HG1 VAL L 29 1.996 87.938 24.810 1.00 0.00 H
-ATOM 13962 1HG2 VAL L 29 0.631 88.860 27.324 1.00 0.00 H
-ATOM 13963 2HG2 VAL L 29 0.293 87.384 26.394 1.00 0.00 H
-ATOM 13964 3HG2 VAL L 29 0.637 87.276 28.141 1.00 0.00 H
-ATOM 13965 N ASN L 38 4.740 85.164 26.844 1.00 12.74 N
-ATOM 13966 CA ASN L 38 6.110 84.966 26.308 1.00 11.55 C
-ATOM 13967 C ASN L 38 6.798 86.356 26.279 1.00 11.40 C
-ATOM 13968 O ASN L 38 6.900 87.034 27.313 1.00 11.05 O
-ATOM 13969 CB ASN L 38 6.072 84.180 24.992 1.00 11.27 C
-ATOM 13970 CG ASN L 38 7.429 83.672 24.412 1.00 10.86 C
-ATOM 13971 OD1 ASN L 38 6.632 84.539 24.093 1.00 9.89 O
-ATOM 13972 ND2 ASN L 38 7.542 82.740 25.308 1.00 6.92 N
-ATOM 13973 H ASN L 38 4.510 84.747 27.729 1.00 0.00 H
-ATOM 13974 HA ASN L 38 6.690 84.385 27.047 1.00 0.00 H
-ATOM 13975 1HB ASN L 38 5.453 83.269 25.148 1.00 0.00 H
-ATOM 13976 2HB ASN L 38 5.564 84.808 24.279 1.00 0.00 H
-ATOM 13977 1HD2 ASN L 38 6.893 82.646 25.993 1.00 0.00 H
-ATOM 13978 2HD2 ASN L 38 8.381 82.146 25.317 1.00 0.00 H
-ATOM 13979 N THR L 39 7.253 86.773 25.083 1.00 11.08 N
-ATOM 13980 CA THR L 39 7.938 88.063 24.986 1.00 10.12 C
-ATOM 13981 C THR L 39 7.320 88.915 23.839 1.00 10.35 C
-ATOM 13982 O THR L 39 8.022 89.491 22.993 1.00 9.57 O
-ATOM 13983 CB THR L 39 9.455 87.802 24.765 1.00 10.26 C
-ATOM 13984 OG1 THR L 39 9.982 86.986 25.820 1.00 8.20 O
-ATOM 13985 CG2 THR L 39 10.172 88.940 24.159 1.00 10.15 C
-ATOM 13986 H THR L 39 7.128 86.177 24.287 1.00 0.00 H
-ATOM 13987 HA THR L 39 7.843 88.612 25.911 1.00 0.00 H
-ATOM 13988 HB THR L 39 9.983 88.408 25.508 1.00 0.00 H
-ATOM 13989 HG1 THR L 39 10.920 86.790 25.611 1.00 0.00 H
-ATOM 13990 1HG2 THR L 39 11.240 88.640 24.053 1.00 0.00 H
-ATOM 13991 2HG2 THR L 39 9.747 89.166 23.182 1.00 0.00 H
-ATOM 13992 3HG2 THR L 39 10.104 89.861 24.781 1.00 0.00 H
-ATOM 13993 N ALA L 40 5.978 89.003 23.842 1.00 11.20 N
-ATOM 13994 CA ALA L 40 5.203 89.686 22.805 1.00 12.51 C
-ATOM 13995 C ALA L 40 4.374 90.848 23.357 1.00 12.80 C
-ATOM 13996 O ALA L 40 3.183 90.964 23.078 1.00 13.07 O
-ATOM 13997 CB ALA L 40 4.282 88.670 22.117 1.00 11.99 C
-ATOM 13998 H ALA L 40 5.468 88.516 24.586 1.00 0.00 H
-ATOM 13999 HA ALA L 40 5.890 90.070 22.067 1.00 0.00 H
-ATOM 14000 1HB ALA L 40 3.721 89.134 21.309 1.00 0.00 H
-ATOM 14001 2HB ALA L 40 4.888 87.872 21.705 1.00 0.00 H
-ATOM 14002 3HB ALA L 40 3.603 88.249 22.833 1.00 0.00 H
-ATOM 14003 N VAL L 41 5.050 91.716 24.129 1.00 12.01 N
-ATOM 14004 CA VAL L 41 4.412 92.924 24.661 1.00 11.01 C
-ATOM 14005 C VAL L 41 5.060 94.209 24.145 1.00 11.03 C
-ATOM 14006 O VAL L 41 6.276 94.365 24.120 1.00 10.43 O
-ATOM 14007 CB VAL L 41 4.388 92.935 26.215 1.00 11.67 C
-ATOM 14008 CG1 VAL L 41 3.833 94.274 26.727 1.00 11.18 C
-ATOM 14009 CG2 VAL L 41 3.496 91.819 26.656 1.00 6.18 C
-ATOM 14010 H VAL L 41 6.020 91.539 24.325 1.00 0.00 H
-ATOM 14011 HA VAL L 41 3.379 92.914 24.351 1.00 0.00 H
-ATOM 14012 HB VAL L 41 5.382 92.809 26.622 1.00 0.00 H
-ATOM 14013 1HG1 VAL L 41 3.780 94.293 27.825 1.00 0.00 H
-ATOM 14014 2HG1 VAL L 41 4.486 95.090 26.394 1.00 0.00 H
-ATOM 14015 3HG1 VAL L 41 2.843 94.416 26.314 1.00 0.00 H
-ATOM 14016 1HG2 VAL L 41 3.422 91.804 27.736 1.00 0.00 H
-ATOM 14017 2HG2 VAL L 41 2.506 91.987 26.225 1.00 0.00 H
-ATOM 14018 3HG2 VAL L 41 3.912 90.895 26.300 1.00 0.00 H
-ATOM 14019 N ALA L 42 4.215 95.126 23.687 1.00 10.90 N
-ATOM 14020 CA ALA L 42 4.685 96.413 23.194 1.00 10.98 C
-ATOM 14021 C ALA L 42 4.272 97.514 24.154 1.00 11.44 C
-ATOM 14022 O ALA L 42 3.224 97.423 24.797 1.00 11.17 O
-ATOM 14023 CB ALA L 42 4.134 96.696 21.802 1.00 10.40 C
-ATOM 14024 H ALA L 42 3.221 94.932 23.715 1.00 0.00 H
-ATOM 14025 HA ALA L 42 5.768 96.388 23.152 1.00 0.00 H
-ATOM 14026 1HB ALA L 42 4.517 97.658 21.454 1.00 0.00 H
-ATOM 14027 2HB ALA L 42 4.439 95.915 21.109 1.00 0.00 H
-ATOM 14028 3HB ALA L 42 3.053 96.732 21.847 1.00 0.00 H
-ATOM 14029 N TRP L 43 5.076 98.575 24.228 1.00 12.16 N
-ATOM 14030 CA TRP L 43 4.710 99.726 25.055 1.00 13.08 C
-ATOM 14031 C TRP L 43 4.552 100.977 24.221 1.00 13.16 C
-ATOM 14032 O TRP L 43 5.393 101.251 23.352 1.00 14.74 O
-ATOM 14033 CB TRP L 43 5.737 99.969 26.148 1.00 12.69 C
-ATOM 14034 CG TRP L 43 5.785 98.890 27.174 1.00 12.90 C
-ATOM 14035 CD1 TRP L 43 6.542 97.756 27.151 1.00 14.54 C
-ATOM 14036 CD2 TRP L 43 5.037 98.853 28.410 1.00 13.72 C
-ATOM 14037 NE1 TRP L 43 6.324 97.020 28.291 1.00 14.49 N
-ATOM 14038 CE2 TRP L 43 5.408 97.684 29.077 1.00 14.40 C
-ATOM 14039 CE3 TRP L 43 4.105 99.720 29.006 1.00 13.68 C
-ATOM 14040 CZ2 TRP L 43 4.884 97.353 30.313 1.00 10.38 C
-ATOM 14041 CZ3 TRP L 43 3.594 99.395 30.249 1.00 10.94 C
-ATOM 14042 CH2 TRP L 43 3.978 98.242 30.890 1.00 11.82 C
-ATOM 14043 H TRP L 43 5.937 98.576 23.688 1.00 0.00 H
-ATOM 14044 HA TRP L 43 3.756 99.507 25.529 1.00 0.00 H
-ATOM 14045 1HB TRP L 43 6.717 100.088 25.718 1.00 0.00 H
-ATOM 14046 2HB TRP L 43 5.497 100.900 26.657 1.00 0.00 H
-ATOM 14047 HD1 TRP L 43 7.226 97.479 26.351 1.00 0.00 H
-ATOM 14048 HE1 TRP L 43 6.776 96.143 28.515 1.00 0.00 H
-ATOM 14049 HE3 TRP L 43 3.801 100.638 28.501 1.00 0.00 H
-ATOM 14050 HZ2 TRP L 43 5.172 96.447 30.833 1.00 0.00 H
-ATOM 14051 HZ3 TRP L 43 2.879 100.078 30.703 1.00 0.00 H
-ATOM 14052 HH2 TRP L 43 3.558 98.017 31.868 1.00 0.00 H
-ATOM 14053 N TYR L 44 3.522 101.770 24.543 1.00 13.10 N
-ATOM 14054 CA TYR L 44 3.208 103.007 23.828 1.00 13.31 C
-ATOM 14055 C TYR L 44 3.095 104.215 24.753 1.00 13.88 C
-ATOM 14056 O TYR L 44 2.762 104.084 25.927 1.00 14.98 O
-ATOM 14057 CB TYR L 44 1.886 102.855 23.080 1.00 13.24 C
-ATOM 14058 CG TYR L 44 1.910 101.710 22.151 1.00 12.48 C
-ATOM 14059 CD1 TYR L 44 1.609 100.455 22.639 1.00 11.84 C
-ATOM 14060 CD2 TYR L 44 2.254 101.880 20.834 1.00 12.56 C
-ATOM 14061 CE1 TYR L 44 1.665 99.386 21.815 1.00 10.55 C
-ATOM 14062 CE2 TYR L 44 2.309 100.793 20.007 1.00 14.30 C
-ATOM 14063 CZ TYR L 44 2.015 99.545 20.497 1.00 14.33 C
-ATOM 14064 OH TYR L 44 2.080 98.447 19.685 1.00 20.40 O
-ATOM 14065 H TYR L 44 2.893 101.449 25.278 1.00 0.00 H
-ATOM 14066 HA TYR L 44 4.012 103.198 23.123 1.00 0.00 H
-ATOM 14067 1HB TYR L 44 1.061 102.727 23.782 1.00 0.00 H
-ATOM 14068 2HB TYR L 44 1.691 103.764 22.502 1.00 0.00 H
-ATOM 14069 HD1 TYR L 44 1.341 100.320 23.691 1.00 0.00 H
-ATOM 14070 HD2 TYR L 44 2.492 102.868 20.454 1.00 0.00 H
-ATOM 14071 HE1 TYR L 44 1.446 98.422 22.198 1.00 0.00 H
-ATOM 14072 HE2 TYR L 44 2.594 100.923 18.970 1.00 0.00 H
-ATOM 14073 HH TYR L 44 2.413 98.733 18.844 1.00 0.00 H
-ATOM 14074 N GLN L 45 3.332 105.393 24.183 1.00 14.20 N
-ATOM 14075 CA GLN L 45 3.190 106.677 24.873 1.00 14.51 C
-ATOM 14076 C GLN L 45 2.132 107.537 24.175 1.00 14.94 C
-ATOM 14077 O GLN L 45 2.198 107.736 22.964 1.00 15.68 O
-ATOM 14078 CB GLN L 45 4.533 107.416 24.860 1.00 14.63 C
-ATOM 14079 CG GLN L 45 4.556 108.727 25.593 1.00 14.17 C
-ATOM 14080 CD GLN L 45 5.912 109.460 25.505 1.00 15.43 C
-ATOM 14081 OE1 GLN L 45 6.350 109.782 24.394 1.00 20.82 O
-ATOM 14082 NE2 GLN L 45 6.570 109.729 26.633 1.00 13.42 N
-ATOM 14083 H GLN L 45 3.624 105.388 23.209 1.00 0.00 H
-ATOM 14084 HA GLN L 45 2.868 106.500 25.905 1.00 0.00 H
-ATOM 14085 1HB GLN L 45 5.270 106.799 25.318 1.00 0.00 H
-ATOM 14086 2HB GLN L 45 4.850 107.592 23.829 1.00 0.00 H
-ATOM 14087 1HG GLN L 45 3.783 109.375 25.181 1.00 0.00 H
-ATOM 14088 2HG GLN L 45 4.350 108.515 26.632 1.00 0.00 H
-ATOM 14089 1HE2 GLN L 45 7.447 110.223 26.596 1.00 0.00 H
-ATOM 14090 2HE2 GLN L 45 6.211 109.450 27.530 1.00 0.00 H
-ATOM 14091 N GLN L 46 1.144 108.048 24.917 1.00 16.14 N
-ATOM 14092 CA GLN L 46 0.144 108.917 24.302 1.00 17.45 C
-ATOM 14093 C GLN L 46 0.051 110.263 24.988 1.00 18.36 C
-ATOM 14094 O GLN L 46 -0.146 110.355 26.206 1.00 18.26 O
-ATOM 14095 CB GLN L 46 -1.257 108.270 24.323 1.00 17.18 C
-ATOM 14096 CG GLN L 46 -2.307 109.123 23.631 1.00 18.33 C
-ATOM 14097 CD GLN L 46 -3.688 108.514 23.627 1.00 20.85 C
-ATOM 14098 OE1 GLN L 46 -4.087 107.799 24.558 1.00 23.84 O
-ATOM 14099 NE2 GLN L 46 -4.431 108.802 22.575 1.00 19.00 N
-ATOM 14100 H GLN L 46 1.082 107.831 25.902 1.00 0.00 H
-ATOM 14101 HA GLN L 46 0.419 109.095 23.265 1.00 0.00 H
-ATOM 14102 1HB GLN L 46 -1.236 107.304 23.832 1.00 0.00 H
-ATOM 14103 2HB GLN L 46 -1.573 108.122 25.353 1.00 0.00 H
-ATOM 14104 1HG GLN L 46 -2.377 110.084 24.138 1.00 0.00 H
-ATOM 14105 2HG GLN L 46 -2.007 109.277 22.594 1.00 0.00 H
-ATOM 14106 1HE2 GLN L 46 -5.365 108.427 22.514 1.00 0.00 H
-ATOM 14107 2HE2 GLN L 46 -4.054 109.410 21.843 1.00 0.00 H
-ATOM 14108 N LYS L 47 0.172 111.330 24.226 1.00 20.48 N
-ATOM 14109 CA LYS L 47 0.055 112.655 24.800 1.00 21.33 C
-ATOM 14110 C LYS L 47 -1.305 113.176 24.403 1.00 21.91 C
-ATOM 14111 O LYS L 47 -1.858 112.723 23.409 1.00 22.15 O
-ATOM 14112 CB LYS L 47 1.221 113.525 24.313 1.00 20.96 C
-ATOM 14113 CG LYS L 47 2.549 112.977 24.785 1.00 21.61 C
-ATOM 14114 CD LYS L 47 3.717 113.795 24.326 1.00 23.98 C
-ATOM 14115 CE LYS L 47 5.019 113.121 24.747 1.00 26.11 C
-ATOM 14116 NZ LYS L 47 6.220 113.915 24.339 1.00 28.30 N
-ATOM 14117 H LYS L 47 0.348 111.216 23.233 1.00 0.00 H
-ATOM 14118 HA LYS L 47 0.146 112.571 25.882 1.00 0.00 H
-ATOM 14119 1HB LYS L 47 1.247 113.556 23.223 1.00 0.00 H
-ATOM 14120 2HB LYS L 47 1.118 114.535 24.683 1.00 0.00 H
-ATOM 14121 1HG LYS L 47 2.551 112.964 25.884 1.00 0.00 H
-ATOM 14122 2HG LYS L 47 2.654 111.954 24.436 1.00 0.00 H
-ATOM 14123 1HD LYS L 47 3.700 113.880 23.240 1.00 0.00 H
-ATOM 14124 2HD LYS L 47 3.660 114.794 24.758 1.00 0.00 H
-ATOM 14125 1HE LYS L 47 5.027 112.986 25.831 1.00 0.00 H
-ATOM 14126 2HE LYS L 47 5.076 112.144 24.270 1.00 0.00 H
-ATOM 14127 1HZ LYS L 47 7.066 113.424 24.625 1.00 0.00 H
-ATOM 14128 2HZ LYS L 47 6.224 114.032 23.339 1.00 0.00 H
-ATOM 14129 3HZ LYS L 47 6.191 114.823 24.783 1.00 0.00 H
-ATOM 14130 N PRO L 48 -1.912 114.100 25.173 1.00 24.06 N
-ATOM 14131 CA PRO L 48 -3.224 114.663 24.876 1.00 24.16 C
-ATOM 14132 C PRO L 48 -3.302 115.216 23.477 1.00 24.49 C
-ATOM 14133 O PRO L 48 -2.419 115.914 23.006 1.00 23.88 O
-ATOM 14134 CB PRO L 48 -3.256 115.821 25.882 1.00 24.19 C
-ATOM 14135 CG PRO L 48 -2.436 115.371 27.053 1.00 23.65 C
-ATOM 14136 CD PRO L 48 -1.320 114.529 26.465 1.00 24.61 C
-ATOM 14137 HA PRO L 48 -3.989 113.911 25.079 1.00 0.00 H
-ATOM 14138 1HB PRO L 48 -2.834 116.714 25.386 1.00 0.00 H
-ATOM 14139 2HB PRO L 48 -4.306 116.071 26.141 1.00 0.00 H
-ATOM 14140 1HG PRO L 48 -2.001 116.246 27.549 1.00 0.00 H
-ATOM 14141 2HG PRO L 48 -3.052 114.860 27.800 1.00 0.00 H
-ATOM 14142 1HD PRO L 48 -0.426 115.134 26.323 1.00 0.00 H
-ATOM 14143 2HD PRO L 48 -1.164 113.672 27.155 1.00 0.00 H
-ATOM 14144 N GLY L 49 -4.406 114.889 22.792 1.00 24.84 N
-ATOM 14145 CA GLY L 49 -4.640 115.363 21.423 1.00 24.34 C
-ATOM 14146 C GLY L 49 -3.884 114.569 20.341 1.00 23.86 C
-ATOM 14147 O GLY L 49 -4.052 114.842 19.151 1.00 24.12 O
-ATOM 14148 H GLY L 49 -5.103 114.295 23.215 1.00 0.00 H
-ATOM 14149 1HA GLY L 49 -5.706 115.364 21.209 1.00 0.00 H
-ATOM 14150 2HA GLY L 49 -4.320 116.407 21.365 1.00 0.00 H
-ATOM 14151 N LYS L 50 -3.055 113.603 20.748 1.00 22.51 N
-ATOM 14152 CA LYS L 50 -2.224 112.845 19.801 1.00 21.94 C
-ATOM 14153 C LYS L 50 -2.562 111.365 19.770 1.00 21.28 C
-ATOM 14154 O LYS L 50 -3.082 110.794 20.726 1.00 21.91 O
-ATOM 14155 CB LYS L 50 -0.748 113.000 20.159 1.00 22.59 C
-ATOM 14156 CG LYS L 50 -0.253 114.440 20.215 1.00 22.31 C
-ATOM 14157 CD LYS L 50 -0.259 115.118 18.842 1.00 24.04 C
-ATOM 14158 CE LYS L 50 0.331 116.539 18.926 1.00 27.78 C
-ATOM 14159 NZ LYS L 50 -0.538 117.470 19.739 1.00 27.68 N
-ATOM 14160 H LYS L 50 -2.940 113.409 21.744 1.00 0.00 H
-ATOM 14161 HA LYS L 50 -2.400 113.244 18.804 1.00 0.00 H
-ATOM 14162 1HB LYS L 50 -0.565 112.548 21.136 1.00 0.00 H
-ATOM 14163 2HB LYS L 50 -0.116 112.454 19.435 1.00 0.00 H
-ATOM 14164 1HG LYS L 50 -0.918 115.005 20.867 1.00 0.00 H
-ATOM 14165 2HG LYS L 50 0.748 114.469 20.648 1.00 0.00 H
-ATOM 14166 1HD LYS L 50 0.321 114.522 18.125 1.00 0.00 H
-ATOM 14167 2HD LYS L 50 -1.290 115.177 18.483 1.00 0.00 H
-ATOM 14168 1HE LYS L 50 1.318 116.480 19.384 1.00 0.00 H
-ATOM 14169 2HE LYS L 50 0.436 116.943 17.915 1.00 0.00 H
-ATOM 14170 1HZ LYS L 50 -0.114 118.386 19.773 1.00 0.00 H
-ATOM 14171 2HZ LYS L 50 -1.454 117.540 19.315 1.00 0.00 H
-ATOM 14172 3HZ LYS L 50 -0.634 117.109 20.683 1.00 0.00 H
-ATOM 14173 N ALA L 51 -2.209 110.723 18.659 1.00 19.84 N
-ATOM 14174 CA ALA L 51 -2.293 109.282 18.567 1.00 18.44 C
-ATOM 14175 C ALA L 51 -1.136 108.715 19.396 1.00 17.65 C
-ATOM 14176 O ALA L 51 -0.090 109.370 19.480 1.00 17.88 O
-ATOM 14177 CB ALA L 51 -2.255 108.797 17.141 1.00 18.21 C
-ATOM 14178 H ALA L 51 -1.839 111.256 17.874 1.00 0.00 H
-ATOM 14179 HA ALA L 51 -3.237 108.982 19.021 1.00 0.00 H
-ATOM 14180 1HB ALA L 51 -2.338 107.734 17.108 1.00 0.00 H
-ATOM 14181 2HB ALA L 51 -3.086 109.253 16.601 1.00 0.00 H
-ATOM 14182 3HB ALA L 51 -1.317 109.115 16.661 1.00 0.00 H
-ATOM 14183 N PRO L 52 -1.240 107.508 19.973 1.00 17.37 N
-ATOM 14184 CA PRO L 52 -0.183 106.833 20.682 1.00 16.08 C
-ATOM 14185 C PRO L 52 1.045 106.605 19.785 1.00 15.22 C
-ATOM 14186 O PRO L 52 0.921 106.445 18.577 1.00 13.86 O
-ATOM 14187 CB PRO L 52 -0.823 105.460 20.981 1.00 15.85 C
-ATOM 14188 CG PRO L 52 -2.318 105.748 21.035 1.00 17.69 C
-ATOM 14189 CD PRO L 52 -2.551 106.810 19.992 1.00 17.54 C
-ATOM 14190 HA PRO L 52 0.087 107.367 21.593 1.00 0.00 H
-ATOM 14191 1HB PRO L 52 -0.523 104.725 20.246 1.00 0.00 H
-ATOM 14192 2HB PRO L 52 -0.442 105.082 21.968 1.00 0.00 H
-ATOM 14193 1HG PRO L 52 -2.876 104.824 20.768 1.00 0.00 H
-ATOM 14194 2HG PRO L 52 -2.633 106.017 22.051 1.00 0.00 H
-ATOM 14195 1HD PRO L 52 -2.760 106.371 19.021 1.00 0.00 H
-ATOM 14196 2HD PRO L 52 -3.352 107.437 20.374 1.00 0.00 H
-ATOM 14197 N LYS L 53 2.237 106.589 20.399 1.00 14.49 N
-ATOM 14198 CA LYS L 53 3.485 106.308 19.682 1.00 14.80 C
-ATOM 14199 C LYS L 53 4.196 105.124 20.298 1.00 14.43 C
-ATOM 14200 O LYS L 53 4.085 104.882 21.507 1.00 14.74 O
-ATOM 14201 CB LYS L 53 4.410 107.538 19.665 1.00 14.29 C
-ATOM 14202 CG LYS L 53 3.852 108.720 18.873 1.00 17.03 C
-ATOM 14203 CD LYS L 53 4.859 109.872 18.763 1.00 20.61 C
-ATOM 14204 CE LYS L 53 4.275 111.034 17.957 1.00 21.40 C
-ATOM 14205 NZ LYS L 53 5.219 112.170 17.840 1.00 26.38 N
-ATOM 14206 H LYS L 53 2.283 106.781 21.394 1.00 0.00 H
-ATOM 14207 HA LYS L 53 3.249 106.050 18.650 1.00 0.00 H
-ATOM 14208 1HB LYS L 53 4.592 107.865 20.691 1.00 0.00 H
-ATOM 14209 2HB LYS L 53 5.376 107.258 19.233 1.00 0.00 H
-ATOM 14210 1HG LYS L 53 3.575 108.389 17.872 1.00 0.00 H
-ATOM 14211 2HG LYS L 53 2.951 109.089 19.371 1.00 0.00 H
-ATOM 14212 1HD LYS L 53 5.131 110.227 19.760 1.00 0.00 H
-ATOM 14213 2HD LYS L 53 5.761 109.517 18.264 1.00 0.00 H
-ATOM 14214 1HE LYS L 53 4.029 110.681 16.957 1.00 0.00 H
-ATOM 14215 2HE LYS L 53 3.361 111.385 18.442 1.00 0.00 H
-ATOM 14216 1HZ LYS L 53 4.788 112.906 17.297 1.00 0.00 H
-ATOM 14217 2HZ LYS L 53 5.444 112.519 18.759 1.00 0.00 H
-ATOM 14218 3HZ LYS L 53 6.063 111.865 17.380 1.00 0.00 H
-ATOM 14219 N LEU L 54 4.940 104.367 19.511 1.00 12.88 N
-ATOM 14220 CA LEU L 54 5.653 103.184 20.003 1.00 13.00 C
-ATOM 14221 C LEU L 54 6.953 103.513 20.732 1.00 13.48 C
-ATOM 14222 O LEU L 54 7.768 104.278 20.238 1.00 15.14 O
-ATOM 14223 CB LEU L 54 5.935 102.235 18.842 1.00 12.53 C
-ATOM 14224 CG LEU L 54 6.664 100.942 19.183 1.00 12.58 C
-ATOM 14225 CD1 LEU L 54 5.804 100.074 20.070 1.00 12.97 C
-ATOM 14226 CD2 LEU L 54 6.959 100.233 17.912 1.00 6.79 C
-ATOM 14227 H LEU L 54 5.010 104.605 18.526 1.00 0.00 H
-ATOM 14228 HA LEU L 54 5.004 102.674 20.713 1.00 0.00 H
-ATOM 14229 1HB LEU L 54 4.992 101.963 18.378 1.00 0.00 H
-ATOM 14230 2HB LEU L 54 6.542 102.759 18.102 1.00 0.00 H
-ATOM 14231 HG LEU L 54 7.586 101.163 19.713 1.00 0.00 H
-ATOM 14232 1HD1 LEU L 54 6.338 99.155 20.299 1.00 0.00 H
-ATOM 14233 2HD1 LEU L 54 5.580 100.597 20.992 1.00 0.00 H
-ATOM 14234 3HD1 LEU L 54 4.883 99.844 19.558 1.00 0.00 H
-ATOM 14235 1HD2 LEU L 54 7.476 99.314 18.142 1.00 0.00 H
-ATOM 14236 2HD2 LEU L 54 6.026 100.010 17.391 1.00 0.00 H
-ATOM 14237 3HD2 LEU L 54 7.577 100.859 17.284 1.00 0.00 H
-ATOM 14238 N LEU L 55 7.103 102.933 21.927 1.00 13.35 N
-ATOM 14239 CA LEU L 55 8.320 103.085 22.721 1.00 11.83 C
-ATOM 14240 C LEU L 55 9.193 101.837 22.652 1.00 12.20 C
-ATOM 14241 O LEU L 55 10.389 101.917 22.369 1.00 12.42 O
-ATOM 14242 CB LEU L 55 7.980 103.269 24.202 1.00 11.86 C
-ATOM 14243 CG LEU L 55 7.221 104.489 24.591 1.00 10.61 C
-ATOM 14244 CD1 LEU L 55 6.887 104.361 26.059 1.00 9.68 C
-ATOM 14245 CD2 LEU L 55 8.079 105.724 24.318 1.00 8.81 C
-ATOM 14246 H LEU L 55 6.361 102.356 22.292 1.00 0.00 H
-ATOM 14247 HA LEU L 55 8.871 103.939 22.369 1.00 0.00 H
-ATOM 14248 1HB LEU L 55 7.414 102.408 24.544 1.00 0.00 H
-ATOM 14249 2HB LEU L 55 8.919 103.296 24.755 1.00 0.00 H
-ATOM 14250 HG LEU L 55 6.289 104.556 24.025 1.00 0.00 H
-ATOM 14251 1HD1 LEU L 55 6.342 105.219 26.381 1.00 0.00 H
-ATOM 14252 2HD1 LEU L 55 6.278 103.469 26.214 1.00 0.00 H
-ATOM 14253 3HD1 LEU L 55 7.798 104.278 26.632 1.00 0.00 H
-ATOM 14254 1HD2 LEU L 55 7.547 106.625 24.612 1.00 0.00 H
-ATOM 14255 2HD2 LEU L 55 9.004 105.652 24.885 1.00 0.00 H
-ATOM 14256 3HD2 LEU L 55 8.310 105.773 23.252 1.00 0.00 H
-ATOM 14257 N ILE L 56 8.575 100.705 22.995 1.00 11.99 N
-ATOM 14258 CA ILE L 56 9.284 99.434 23.129 1.00 11.49 C
-ATOM 14259 C ILE L 56 8.581 98.291 22.417 1.00 11.51 C
-ATOM 14260 O ILE L 56 7.362 98.129 22.536 1.00 12.40 O
-ATOM 14261 CB ILE L 56 9.478 99.055 24.617 1.00 11.80 C
-ATOM 14262 CG1 ILE L 56 10.265 100.139 25.321 1.00 13.59 C
-ATOM 14263 CG2 ILE L 56 10.191 97.704 24.782 1.00 8.66 C
-ATOM 14264 CD1 ILE L 56 10.356 99.909 26.752 1.00 24.37 C
-ATOM 14265 H ILE L 56 7.577 100.744 23.172 1.00 0.00 H
-ATOM 14266 HA ILE L 56 10.264 99.549 22.682 1.00 0.00 H
-ATOM 14267 HB ILE L 56 8.522 98.989 25.088 1.00 0.00 H
-ATOM 14268 1HG1 ILE L 56 11.273 100.196 24.903 1.00 0.00 H
-ATOM 14269 2HG1 ILE L 56 9.776 101.086 25.187 1.00 0.00 H
-ATOM 14270 1HG2 ILE L 56 10.300 97.471 25.840 1.00 0.00 H
-ATOM 14271 2HG2 ILE L 56 9.616 96.915 24.304 1.00 0.00 H
-ATOM 14272 3HG2 ILE L 56 11.169 97.765 24.328 1.00 0.00 H
-ATOM 14273 1HD1 ILE L 56 10.916 100.720 27.216 1.00 0.00 H
-ATOM 14274 2HD1 ILE L 56 9.366 99.857 27.173 1.00 0.00 H
-ATOM 14275 3HD1 ILE L 56 10.859 98.972 26.910 1.00 0.00 H
-ATOM 14276 N TYR L 57 9.345 97.477 21.698 1.00 11.23 N
-ATOM 14277 CA TYR L 57 8.769 96.319 21.037 1.00 10.97 C
-ATOM 14278 C TYR L 57 9.374 95.020 21.590 1.00 10.52 C
-ATOM 14279 O TYR L 57 10.437 95.024 22.223 1.00 10.79 O
-ATOM 14280 CB TYR L 57 8.921 96.457 19.516 1.00 11.62 C
-ATOM 14281 CG TYR L 57 10.329 96.467 18.957 1.00 11.05 C
-ATOM 14282 CD1 TYR L 57 10.922 95.283 18.523 1.00 10.59 C
-ATOM 14283 CD2 TYR L 57 11.026 97.670 18.857 1.00 12.67 C
-ATOM 14284 CE1 TYR L 57 12.190 95.307 17.972 1.00 12.90 C
-ATOM 14285 CE2 TYR L 57 12.298 97.689 18.310 1.00 13.53 C
-ATOM 14286 CZ TYR L 57 12.873 96.513 17.861 1.00 13.92 C
-ATOM 14287 OH TYR L 57 14.128 96.536 17.295 1.00 18.24 O
-ATOM 14288 H TYR L 57 10.345 97.671 21.643 1.00 0.00 H
-ATOM 14289 HA TYR L 57 7.702 96.291 21.249 1.00 0.00 H
-ATOM 14290 1HB TYR L 57 8.380 95.644 19.030 1.00 0.00 H
-ATOM 14291 2HB TYR L 57 8.444 97.381 19.208 1.00 0.00 H
-ATOM 14292 HD1 TYR L 57 10.385 94.341 18.600 1.00 0.00 H
-ATOM 14293 HD2 TYR L 57 10.566 98.595 19.200 1.00 0.00 H
-ATOM 14294 HE1 TYR L 57 12.647 94.383 17.620 1.00 0.00 H
-ATOM 14295 HE2 TYR L 57 12.845 98.622 18.222 1.00 0.00 H
-ATOM 14296 HH TYR L 57 14.463 97.435 17.299 1.00 0.00 H
-ATOM 14297 N SER L 58 8.638 93.915 21.405 1.00 10.49 N
-ATOM 14298 CA SER L 58 9.061 92.583 21.860 1.00 10.76 C
-ATOM 14299 C SER L 58 9.530 92.596 23.318 1.00 11.66 C
-ATOM 14300 O SER L 58 10.545 91.998 23.662 1.00 11.47 O
-ATOM 14301 CB SER L 58 10.142 92.038 20.955 1.00 10.45 C
-ATOM 14302 OG SER L 58 9.659 91.861 19.649 1.00 11.94 O
-ATOM 14303 H SER L 58 7.768 93.994 20.901 1.00 0.00 H
-ATOM 14304 HA SER L 58 8.202 91.910 21.788 1.00 0.00 H
-ATOM 14305 1HB SER L 58 10.958 92.734 20.930 1.00 0.00 H
-ATOM 14306 2HB SER L 58 10.525 91.098 21.346 1.00 0.00 H
-ATOM 14307 HG SER L 58 9.400 92.725 19.348 1.00 0.00 H
-ATOM 14308 N ALA L 59 8.805 93.347 24.151 1.00 11.86 N
-ATOM 14309 CA ALA L 59 8.994 93.532 25.591 1.00 13.04 C
-ATOM 14310 C ALA L 59 10.396 93.966 26.053 1.00 14.02 C
-ATOM 14311 O ALA L 59 10.630 94.020 27.256 1.00 14.26 O
-ATOM 14312 CB ALA L 59 8.632 92.253 26.320 1.00 11.95 C
-ATOM 14313 H ALA L 59 7.990 93.804 23.769 1.00 0.00 H
-ATOM 14314 HA ALA L 59 8.300 94.323 25.893 1.00 0.00 H
-ATOM 14315 1HB ALA L 59 8.715 92.417 27.395 1.00 0.00 H
-ATOM 14316 2HB ALA L 59 7.609 91.977 26.050 1.00 0.00 H
-ATOM 14317 3HB ALA L 59 9.313 91.473 26.038 1.00 0.00 H
-ATOM 14318 N SER L 60 11.322 94.298 25.156 1.00 15.05 N
-ATOM 14319 CA SER L 60 12.626 94.758 25.643 1.00 15.20 C
-ATOM 14320 C SER L 60 13.430 95.620 24.668 1.00 15.40 C
-ATOM 14321 O SER L 60 14.527 96.075 25.016 1.00 15.87 O
-ATOM 14322 CB SER L 60 13.485 93.580 26.068 1.00 15.73 C
-ATOM 14323 OG SER L 60 13.775 92.752 24.984 1.00 15.37 O
-ATOM 14324 H SER L 60 11.111 94.250 24.163 1.00 0.00 H
-ATOM 14325 HA SER L 60 12.441 95.363 26.530 1.00 0.00 H
-ATOM 14326 1HB SER L 60 14.412 93.960 26.491 1.00 0.00 H
-ATOM 14327 2HB SER L 60 12.984 93.006 26.851 1.00 0.00 H
-ATOM 14328 HG SER L 60 14.086 93.340 24.289 1.00 0.00 H
-ATOM 14329 N PHE L 69 12.939 95.833 23.452 1.00 15.42 N
-ATOM 14330 CA PHE L 69 13.727 96.540 22.450 1.00 15.40 C
-ATOM 14331 C PHE L 69 13.280 97.972 22.266 1.00 15.62 C
-ATOM 14332 O PHE L 69 12.114 98.253 22.001 1.00 15.85 O
-ATOM 14333 CB PHE L 69 13.646 95.812 21.131 1.00 15.57 C
-ATOM 14334 CG PHE L 69 14.317 94.499 21.147 1.00 14.78 C
-ATOM 14335 CD1 PHE L 69 13.643 93.408 21.630 1.00 13.96 C
-ATOM 14336 CD2 PHE L 69 15.606 94.336 20.677 1.00 15.75 C
-ATOM 14337 CE1 PHE L 69 14.230 92.163 21.655 1.00 15.01 C
-ATOM 14338 CE2 PHE L 69 16.210 93.089 20.695 1.00 16.86 C
-ATOM 14339 CZ PHE L 69 15.515 91.998 21.190 1.00 16.73 C
-ATOM 14340 H PHE L 69 12.027 95.478 23.186 1.00 0.00 H
-ATOM 14341 HA PHE L 69 14.769 96.551 22.775 1.00 0.00 H
-ATOM 14342 1HB PHE L 69 12.604 95.655 20.885 1.00 0.00 H
-ATOM 14343 2HB PHE L 69 14.093 96.427 20.356 1.00 0.00 H
-ATOM 14344 HD1 PHE L 69 12.635 93.546 22.004 1.00 0.00 H
-ATOM 14345 HD2 PHE L 69 16.149 95.203 20.288 1.00 0.00 H
-ATOM 14346 HE1 PHE L 69 13.674 91.311 22.050 1.00 0.00 H
-ATOM 14347 HE2 PHE L 69 17.227 92.962 20.325 1.00 0.00 H
-ATOM 14348 HZ PHE L 69 15.980 91.013 21.210 1.00 0.00 H
-ATOM 14349 N LEU L 70 14.229 98.881 22.397 1.00 15.63 N
-ATOM 14350 CA LEU L 70 13.925 100.301 22.342 1.00 15.69 C
-ATOM 14351 C LEU L 70 13.714 100.727 20.883 1.00 16.47 C
-ATOM 14352 O LEU L 70 14.598 100.558 20.045 1.00 17.70 O
-ATOM 14353 CB LEU L 70 15.094 101.059 22.988 1.00 15.01 C
-ATOM 14354 CG LEU L 70 14.840 102.481 23.393 1.00 14.24 C
-ATOM 14355 CD1 LEU L 70 15.815 102.857 24.471 1.00 11.60 C
-ATOM 14356 CD2 LEU L 70 15.000 103.385 22.242 1.00 12.13 C
-ATOM 14357 H LEU L 70 15.176 98.583 22.583 1.00 0.00 H
-ATOM 14358 HA LEU L 70 13.011 100.492 22.897 1.00 0.00 H
-ATOM 14359 1HB LEU L 70 15.414 100.516 23.876 1.00 0.00 H
-ATOM 14360 2HB LEU L 70 15.920 101.079 22.281 1.00 0.00 H
-ATOM 14361 HG LEU L 70 13.824 102.560 23.797 1.00 0.00 H
-ATOM 14362 1HD1 LEU L 70 15.596 103.868 24.771 1.00 0.00 H
-ATOM 14363 2HD1 LEU L 70 15.710 102.193 25.326 1.00 0.00 H
-ATOM 14364 3HD1 LEU L 70 16.837 102.792 24.085 1.00 0.00 H
-ATOM 14365 1HD2 LEU L 70 14.811 104.384 22.587 1.00 0.00 H
-ATOM 14366 2HD2 LEU L 70 16.016 103.323 21.845 1.00 0.00 H
-ATOM 14367 3HD2 LEU L 70 14.292 103.121 21.466 1.00 0.00 H
-ATOM 14368 N TYR L 71 12.510 101.207 20.586 1.00 16.76 N
-ATOM 14369 CA TYR L 71 12.136 101.588 19.229 1.00 17.08 C
-ATOM 14370 C TYR L 71 12.937 102.786 18.704 1.00 16.95 C
-ATOM 14371 O TYR L 71 13.188 103.750 19.419 1.00 17.66 O
-ATOM 14372 CB TYR L 71 10.627 101.832 19.141 1.00 17.09 C
-ATOM 14373 CG TYR L 71 10.203 102.191 17.787 1.00 19.18 C
-ATOM 14374 CD1 TYR L 71 10.349 101.268 16.770 1.00 17.02 C
-ATOM 14375 CD2 TYR L 71 9.656 103.419 17.540 1.00 18.64 C
-ATOM 14376 CE1 TYR L 71 9.963 101.590 15.494 1.00 14.97 C
-ATOM 14377 CE2 TYR L 71 9.265 103.749 16.271 1.00 15.78 C
-ATOM 14378 CZ TYR L 71 9.421 102.845 15.247 1.00 14.29 C
-ATOM 14379 OH TYR L 71 9.045 103.185 13.973 1.00 15.79 O
-ATOM 14380 H TYR L 71 11.818 101.318 21.323 1.00 0.00 H
-ATOM 14381 HA TYR L 71 12.356 100.758 18.572 1.00 0.00 H
-ATOM 14382 1HB TYR L 71 10.088 100.940 19.450 1.00 0.00 H
-ATOM 14383 2HB TYR L 71 10.338 102.632 19.806 1.00 0.00 H
-ATOM 14384 HD1 TYR L 71 10.781 100.293 16.983 1.00 0.00 H
-ATOM 14385 HD2 TYR L 71 9.539 104.136 18.353 1.00 0.00 H
-ATOM 14386 HE1 TYR L 71 10.086 100.869 14.688 1.00 0.00 H
-ATOM 14387 HE2 TYR L 71 8.836 104.730 16.075 1.00 0.00 H
-ATOM 14388 HH TYR L 71 8.639 104.058 13.987 1.00 0.00 H
-ATOM 14389 N SER L 72 13.369 102.713 17.447 1.00 17.35 N
-ATOM 14390 CA SER L 72 14.155 103.794 16.870 1.00 17.59 C
-ATOM 14391 C SER L 72 13.436 105.128 17.012 1.00 17.83 C
-ATOM 14392 O SER L 72 12.231 105.229 16.789 1.00 18.37 O
-ATOM 14393 CB SER L 72 14.415 103.520 15.396 1.00 17.33 C
-ATOM 14394 OG SER L 72 15.136 104.575 14.804 1.00 19.39 O
-ATOM 14395 H SER L 72 13.146 101.899 16.890 1.00 0.00 H
-ATOM 14396 HA SER L 72 15.105 103.852 17.398 1.00 0.00 H
-ATOM 14397 1HB SER L 72 14.959 102.585 15.279 1.00 0.00 H
-ATOM 14398 2HB SER L 72 13.458 103.410 14.883 1.00 0.00 H
-ATOM 14399 HG SER L 72 15.987 104.598 15.244 1.00 0.00 H
-ATOM 14400 N GLY L 73 14.191 106.157 17.391 1.00 18.09 N
-ATOM 14401 CA GLY L 73 13.665 107.518 17.560 1.00 18.26 C
-ATOM 14402 C GLY L 73 13.244 107.799 19.001 1.00 19.02 C
-ATOM 14403 O GLY L 73 13.019 108.953 19.380 1.00 19.85 O
-ATOM 14404 H GLY L 73 15.172 105.998 17.563 1.00 0.00 H
-ATOM 14405 1HA GLY L 73 14.423 108.230 17.259 1.00 0.00 H
-ATOM 14406 2HA GLY L 73 12.813 107.654 16.899 1.00 0.00 H
-ATOM 14407 N VAL L 74 13.169 106.762 19.811 1.00 18.95 N
-ATOM 14408 CA VAL L 74 12.791 106.865 21.209 1.00 18.48 C
-ATOM 14409 C VAL L 74 14.041 107.129 22.050 1.00 18.19 C
-ATOM 14410 O VAL L 74 15.111 106.594 21.722 1.00 18.80 O
-ATOM 14411 CB VAL L 74 12.079 105.579 21.644 1.00 18.70 C
-ATOM 14412 CG1 VAL L 74 11.721 105.596 23.124 1.00 18.71 C
-ATOM 14413 CG2 VAL L 74 10.877 105.420 20.781 1.00 16.77 C
-ATOM 14414 H VAL L 74 13.348 105.818 19.448 1.00 0.00 H
-ATOM 14415 HA VAL L 74 12.068 107.665 21.294 1.00 0.00 H
-ATOM 14416 HB VAL L 74 12.729 104.755 21.494 1.00 0.00 H
-ATOM 14417 1HG1 VAL L 74 11.227 104.659 23.388 1.00 0.00 H
-ATOM 14418 2HG1 VAL L 74 12.623 105.706 23.716 1.00 0.00 H
-ATOM 14419 3HG1 VAL L 74 11.044 106.421 23.318 1.00 0.00 H
-ATOM 14420 1HG2 VAL L 74 10.381 104.508 21.024 1.00 0.00 H
-ATOM 14421 2HG2 VAL L 74 10.193 106.253 20.930 1.00 0.00 H
-ATOM 14422 3HG2 VAL L 74 11.181 105.385 19.734 1.00 0.00 H
-ATOM 14423 N PRO L 75 14.019 108.053 23.013 1.00 17.82 N
-ATOM 14424 CA PRO L 75 15.084 108.363 23.941 1.00 17.87 C
-ATOM 14425 C PRO L 75 15.576 107.143 24.716 1.00 17.94 C
-ATOM 14426 O PRO L 75 14.763 106.262 25.059 1.00 18.15 O
-ATOM 14427 CB PRO L 75 14.477 109.407 24.848 1.00 18.23 C
-ATOM 14428 CG PRO L 75 13.403 110.062 24.011 1.00 17.31 C
-ATOM 14429 CD PRO L 75 12.864 108.967 23.135 1.00 17.59 C
-ATOM 14430 HA PRO L 75 15.934 108.797 23.362 1.00 0.00 H
-ATOM 14431 1HB PRO L 75 14.027 108.902 25.724 1.00 0.00 H
-ATOM 14432 2HB PRO L 75 15.226 110.099 25.222 1.00 0.00 H
-ATOM 14433 1HG PRO L 75 12.651 110.543 24.639 1.00 0.00 H
-ATOM 14434 2HG PRO L 75 13.883 110.864 23.413 1.00 0.00 H
-ATOM 14435 1HD PRO L 75 11.998 108.482 23.597 1.00 0.00 H
-ATOM 14436 2HD PRO L 75 12.630 109.442 22.171 1.00 0.00 H
-ATOM 14437 N SER L 76 16.864 107.111 25.029 1.00 18.85 N
-ATOM 14438 CA SER L 76 17.536 106.007 25.729 1.00 19.52 C
-ATOM 14439 C SER L 76 16.982 105.689 27.121 1.00 18.82 C
-ATOM 14440 O SER L 76 17.210 104.607 27.645 1.00 20.05 O
-ATOM 14441 CB SER L 76 19.022 106.292 25.815 1.00 19.47 C
-ATOM 14442 OG SER L 76 19.281 107.393 26.642 1.00 23.18 O
-ATOM 14443 H SER L 76 17.443 107.893 24.725 1.00 0.00 H
-ATOM 14444 HA SER L 76 17.413 105.119 25.111 1.00 0.00 H
-ATOM 14445 1HB SER L 76 19.548 105.416 26.214 1.00 0.00 H
-ATOM 14446 2HB SER L 76 19.422 106.485 24.828 1.00 0.00 H
-ATOM 14447 HG SER L 76 18.887 108.148 26.192 1.00 0.00 H
-ATOM 14448 N ARG L 77 16.272 106.643 27.734 1.00 18.20 N
-ATOM 14449 CA ARG L 77 15.689 106.444 29.050 1.00 17.94 C
-ATOM 14450 C ARG L 77 14.542 105.426 29.099 1.00 17.66 C
-ATOM 14451 O ARG L 77 14.153 104.990 30.184 1.00 18.93 O
-ATOM 14452 CB ARG L 77 15.219 107.769 29.641 1.00 18.64 C
-ATOM 14453 CG ARG L 77 14.092 108.444 28.914 1.00 19.53 C
-ATOM 14454 CD ARG L 77 13.769 109.767 29.538 1.00 20.54 C
-ATOM 14455 NE ARG L 77 12.738 110.464 28.838 1.00 18.05 N
-ATOM 14456 CZ ARG L 77 12.943 111.264 27.784 1.00 20.32 C
-ATOM 14457 NH1 ARG L 77 14.168 111.477 27.342 1.00 23.05 N
-ATOM 14458 NH2 ARG L 77 11.914 111.841 27.205 1.00 18.50 N
-ATOM 14459 H ARG L 77 16.128 107.516 27.251 1.00 0.00 H
-ATOM 14460 HA ARG L 77 16.481 106.076 29.707 1.00 0.00 H
-ATOM 14461 1HB ARG L 77 14.893 107.616 30.670 1.00 0.00 H
-ATOM 14462 2HB ARG L 77 16.058 108.462 29.667 1.00 0.00 H
-ATOM 14463 1HG ARG L 77 14.392 108.606 27.889 1.00 0.00 H
-ATOM 14464 2HG ARG L 77 13.198 107.816 28.940 1.00 0.00 H
-ATOM 14465 1HD ARG L 77 13.427 109.607 30.555 1.00 0.00 H
-ATOM 14466 2HD ARG L 77 14.656 110.396 29.554 1.00 0.00 H
-ATOM 14467 HE ARG L 77 11.775 110.375 29.181 1.00 0.00 H
-ATOM 14468 1HH1 ARG L 77 14.952 111.036 27.803 1.00 0.00 H
-ATOM 14469 2HH1 ARG L 77 14.323 112.090 26.554 1.00 0.00 H
-ATOM 14470 1HH2 ARG L 77 10.966 111.657 27.571 1.00 0.00 H
-ATOM 14471 2HH2 ARG L 77 12.045 112.452 26.419 1.00 0.00 H
-ATOM 14472 N PHE L 78 13.969 105.060 27.947 1.00 16.56 N
-ATOM 14473 CA PHE L 78 12.861 104.102 27.965 1.00 15.02 C
-ATOM 14474 C PHE L 78 13.351 102.663 27.844 1.00 16.02 C
-ATOM 14475 O PHE L 78 13.915 102.274 26.827 1.00 16.16 O
-ATOM 14476 CB PHE L 78 11.866 104.397 26.851 1.00 14.16 C
-ATOM 14477 CG PHE L 78 11.126 105.664 27.076 1.00 10.49 C
-ATOM 14478 CD1 PHE L 78 9.979 105.665 27.841 1.00 7.23 C
-ATOM 14479 CD2 PHE L 78 11.570 106.858 26.539 1.00 7.43 C
-ATOM 14480 CE1 PHE L 78 9.282 106.821 28.068 1.00 9.78 C
-ATOM 14481 CE2 PHE L 78 10.872 108.021 26.767 1.00 5.46 C
-ATOM 14482 CZ PHE L 78 9.725 107.997 27.535 1.00 6.61 C
-ATOM 14483 H PHE L 78 14.306 105.429 27.056 1.00 0.00 H
-ATOM 14484 HA PHE L 78 12.337 104.200 28.918 1.00 0.00 H
-ATOM 14485 1HB PHE L 78 12.391 104.465 25.898 1.00 0.00 H
-ATOM 14486 2HB PHE L 78 11.141 103.586 26.779 1.00 0.00 H
-ATOM 14487 HD1 PHE L 78 9.632 104.733 28.268 1.00 0.00 H
-ATOM 14488 HD2 PHE L 78 12.479 106.871 25.933 1.00 0.00 H
-ATOM 14489 HE1 PHE L 78 8.381 106.805 28.677 1.00 0.00 H
-ATOM 14490 HE2 PHE L 78 11.223 108.961 26.347 1.00 0.00 H
-ATOM 14491 HZ PHE L 78 9.173 108.916 27.725 1.00 0.00 H
-ATOM 14492 N SER L 79 13.091 101.848 28.865 1.00 16.41 N
-ATOM 14493 CA SER L 79 13.585 100.476 28.883 1.00 15.94 C
-ATOM 14494 C SER L 79 12.521 99.494 29.330 1.00 15.86 C
-ATOM 14495 O SER L 79 11.625 99.838 30.101 1.00 16.27 O
-ATOM 14496 CB SER L 79 14.782 100.376 29.806 1.00 15.76 C
-ATOM 14497 OG SER L 79 15.253 99.064 29.867 1.00 16.80 O
-ATOM 14498 H SER L 79 12.601 102.224 29.677 1.00 0.00 H
-ATOM 14499 HA SER L 79 13.895 100.203 27.874 1.00 0.00 H
-ATOM 14500 1HB SER L 79 15.574 101.042 29.454 1.00 0.00 H
-ATOM 14501 2HB SER L 79 14.493 100.706 30.802 1.00 0.00 H
-ATOM 14502 HG SER L 79 14.496 98.524 30.129 1.00 0.00 H
-ATOM 14503 N GLY L 80 12.576 98.266 28.817 1.00 15.29 N
-ATOM 14504 CA GLY L 80 11.586 97.280 29.221 1.00 14.98 C
-ATOM 14505 C GLY L 80 12.200 95.997 29.734 1.00 15.80 C
-ATOM 14506 O GLY L 80 13.366 95.695 29.458 1.00 15.01 O
-ATOM 14507 H GLY L 80 13.314 98.016 28.163 1.00 0.00 H
-ATOM 14508 1HA GLY L 80 10.966 97.714 29.992 1.00 0.00 H
-ATOM 14509 2HA GLY L 80 10.926 97.058 28.379 1.00 0.00 H
-ATOM 14510 N SER L 81 11.392 95.216 30.449 1.00 16.11 N
-ATOM 14511 CA SER L 81 11.819 93.921 30.966 1.00 17.61 C
-ATOM 14512 C SER L 81 10.661 92.950 31.242 1.00 18.16 C
-ATOM 14513 O SER L 81 9.481 93.319 31.225 1.00 19.10 O
-ATOM 14514 CB SER L 81 12.651 94.108 32.217 1.00 16.81 C
-ATOM 14515 OG SER L 81 11.883 94.634 33.260 1.00 19.73 O
-ATOM 14516 H SER L 81 10.451 95.565 30.642 1.00 0.00 H
-ATOM 14517 HA SER L 81 12.456 93.453 30.211 1.00 0.00 H
-ATOM 14518 1HB SER L 81 13.068 93.146 32.521 1.00 0.00 H
-ATOM 14519 2HB SER L 81 13.484 94.771 32.003 1.00 0.00 H
-ATOM 14520 HG SER L 81 11.678 95.537 32.992 1.00 0.00 H
-ATOM 14521 N ARG L 82 11.030 91.698 31.502 1.00 18.37 N
-ATOM 14522 CA ARG L 82 10.126 90.582 31.788 1.00 18.78 C
-ATOM 14523 C ARG L 82 10.488 89.764 33.029 1.00 18.95 C
-ATOM 14524 O ARG L 82 11.642 89.354 33.188 1.00 19.68 O
-ATOM 14525 CB ARG L 82 10.088 89.621 30.610 1.00 19.33 C
-ATOM 14526 CG ARG L 82 9.396 88.308 30.882 1.00 20.54 C
-ATOM 14527 CD ARG L 82 9.480 87.373 29.709 1.00 20.33 C
-ATOM 14528 NE ARG L 82 9.464 85.977 30.171 1.00 21.76 N
-ATOM 14529 CZ ARG L 82 8.372 85.199 30.329 1.00 23.13 C
-ATOM 14530 NH1 ARG L 82 7.180 85.657 30.023 1.00 24.22 N
-ATOM 14531 NH2 ARG L 82 8.525 83.964 30.800 1.00 22.76 N
-ATOM 14532 H ARG L 82 12.027 91.497 31.506 1.00 0.00 H
-ATOM 14533 HA ARG L 82 9.117 90.993 31.942 1.00 0.00 H
-ATOM 14534 1HB ARG L 82 9.576 90.092 29.769 1.00 0.00 H
-ATOM 14535 2HB ARG L 82 11.106 89.395 30.293 1.00 0.00 H
-ATOM 14536 1HG ARG L 82 9.861 87.800 31.727 1.00 0.00 H
-ATOM 14537 2HG ARG L 82 8.332 88.488 31.111 1.00 0.00 H
-ATOM 14538 1HD ARG L 82 8.623 87.537 29.049 1.00 0.00 H
-ATOM 14539 2HD ARG L 82 10.409 87.533 29.156 1.00 0.00 H
-ATOM 14540 HE ARG L 82 10.347 85.568 30.427 1.00 0.00 H
-ATOM 14541 1HH1 ARG L 82 7.078 86.591 29.622 1.00 0.00 H
-ATOM 14542 2HH1 ARG L 82 6.363 85.077 30.165 1.00 0.00 H
-ATOM 14543 1HH2 ARG L 82 9.455 83.614 31.027 1.00 0.00 H
-ATOM 14544 2HH2 ARG L 82 7.721 83.371 30.925 1.00 0.00 H
-ATOM 14545 N SER L 83 9.494 89.492 33.864 1.00 19.41 N
-ATOM 14546 CA SER L 83 9.622 88.601 35.007 1.00 19.55 C
-ATOM 14547 C SER L 83 8.327 87.808 35.175 1.00 20.32 C
-ATOM 14548 O SER L 83 7.302 88.349 35.595 1.00 20.20 O
-ATOM 14549 CB SER L 83 9.912 89.404 36.262 1.00 19.35 C
-ATOM 14550 OG SER L 83 10.001 88.576 37.385 1.00 20.94 O
-ATOM 14551 H SER L 83 8.572 89.906 33.683 1.00 0.00 H
-ATOM 14552 HA SER L 83 10.437 87.895 34.828 1.00 0.00 H
-ATOM 14553 1HB SER L 83 10.851 89.948 36.128 1.00 0.00 H
-ATOM 14554 2HB SER L 83 9.124 90.141 36.403 1.00 0.00 H
-ATOM 14555 HG SER L 83 9.132 88.186 37.498 1.00 0.00 H
-ATOM 14556 N GLY L 84 8.354 86.516 34.869 1.00 21.06 N
-ATOM 14557 CA GLY L 84 7.121 85.741 34.878 1.00 20.80 C
-ATOM 14558 C GLY L 84 6.162 86.353 33.866 1.00 20.61 C
-ATOM 14559 O GLY L 84 6.557 86.616 32.730 1.00 20.69 O
-ATOM 14560 H GLY L 84 9.223 86.087 34.572 1.00 0.00 H
-ATOM 14561 1HA GLY L 84 7.328 84.703 34.621 1.00 0.00 H
-ATOM 14562 2HA GLY L 84 6.675 85.758 35.873 1.00 0.00 H
-ATOM 14563 N THR L 87 4.933 86.634 34.297 1.00 20.45 N
-ATOM 14564 CA THR L 87 3.923 87.233 33.424 1.00 20.14 C
-ATOM 14565 C THR L 87 3.854 88.744 33.607 1.00 20.06 C
-ATOM 14566 O THR L 87 2.951 89.399 33.082 1.00 20.07 O
-ATOM 14567 CB THR L 87 2.534 86.619 33.660 1.00 19.91 C
-ATOM 14568 OG1 THR L 87 2.128 86.843 35.022 1.00 20.01 O
-ATOM 14569 CG2 THR L 87 2.569 85.130 33.368 1.00 19.64 C
-ATOM 14570 H THR L 87 4.687 86.413 35.249 1.00 0.00 H
-ATOM 14571 HA THR L 87 4.204 87.035 32.388 1.00 0.00 H
-ATOM 14572 HB THR L 87 1.811 87.090 32.998 1.00 0.00 H
-ATOM 14573 HG1 THR L 87 2.875 86.742 35.609 1.00 0.00 H
-ATOM 14574 1HG2 THR L 87 1.577 84.706 33.527 1.00 0.00 H
-ATOM 14575 2HG2 THR L 87 2.868 84.975 32.332 1.00 0.00 H
-ATOM 14576 3HG2 THR L 87 3.284 84.641 34.027 1.00 0.00 H
-ATOM 14577 N ASP L 88 4.771 89.297 34.408 1.00 19.55 N
-ATOM 14578 CA ASP L 88 4.811 90.736 34.622 1.00 19.63 C
-ATOM 14579 C ASP L 88 5.759 91.429 33.655 1.00 18.44 C
-ATOM 14580 O ASP L 88 6.963 91.135 33.607 1.00 18.65 O
-ATOM 14581 CB ASP L 88 5.191 91.098 36.067 1.00 20.48 C
-ATOM 14582 CG ASP L 88 4.085 90.848 37.074 1.00 25.54 C
-ATOM 14583 OD1 ASP L 88 2.998 91.284 36.838 1.00 31.90 O
-ATOM 14584 OD2 ASP L 88 4.330 90.243 38.088 1.00 30.06 O
-ATOM 14585 H ASP L 88 5.500 88.724 34.830 1.00 0.00 H
-ATOM 14586 HA ASP L 88 3.819 91.133 34.435 1.00 0.00 H
-ATOM 14587 1HB ASP L 88 6.038 90.495 36.375 1.00 0.00 H
-ATOM 14588 2HB ASP L 88 5.494 92.142 36.114 1.00 0.00 H
-ATOM 14589 N PHE L 89 5.216 92.353 32.876 1.00 16.72 N
-ATOM 14590 CA PHE L 89 6.027 93.105 31.942 1.00 15.21 C
-ATOM 14591 C PHE L 89 6.221 94.499 32.510 1.00 14.57 C
-ATOM 14592 O PHE L 89 5.309 95.059 33.121 1.00 15.17 O
-ATOM 14593 CB PHE L 89 5.357 93.138 30.576 1.00 15.14 C
-ATOM 14594 CG PHE L 89 5.274 91.774 30.004 1.00 14.07 C
-ATOM 14595 CD1 PHE L 89 4.202 90.938 30.320 1.00 11.60 C
-ATOM 14596 CD2 PHE L 89 6.263 91.309 29.169 1.00 13.56 C
-ATOM 14597 CE1 PHE L 89 4.131 89.663 29.801 1.00 12.46 C
-ATOM 14598 CE2 PHE L 89 6.202 90.043 28.641 1.00 14.51 C
-ATOM 14599 CZ PHE L 89 5.142 89.217 28.957 1.00 12.01 C
-ATOM 14600 H PHE L 89 4.216 92.541 32.915 1.00 0.00 H
-ATOM 14601 HA PHE L 89 7.002 92.630 31.844 1.00 0.00 H
-ATOM 14602 1HB PHE L 89 4.354 93.554 30.645 1.00 0.00 H
-ATOM 14603 2HB PHE L 89 5.934 93.763 29.896 1.00 0.00 H
-ATOM 14604 HD1 PHE L 89 3.416 91.302 30.987 1.00 0.00 H
-ATOM 14605 HD2 PHE L 89 7.097 91.965 28.934 1.00 0.00 H
-ATOM 14606 HE1 PHE L 89 3.283 89.013 30.059 1.00 0.00 H
-ATOM 14607 HE2 PHE L 89 6.987 89.682 27.975 1.00 0.00 H
-ATOM 14608 HZ PHE L 89 5.111 88.215 28.533 1.00 0.00 H
-ATOM 14609 N THR L 90 7.403 95.056 32.332 1.00 13.48 N
-ATOM 14610 CA THR L 90 7.674 96.358 32.923 1.00 13.48 C
-ATOM 14611 C THR L 90 8.217 97.396 31.961 1.00 13.73 C
-ATOM 14612 O THR L 90 9.077 97.100 31.132 1.00 13.76 O
-ATOM 14613 CB THR L 90 8.651 96.194 34.104 1.00 13.99 C
-ATOM 14614 OG1 THR L 90 8.068 95.320 35.076 1.00 12.46 O
-ATOM 14615 CG2 THR L 90 8.950 97.535 34.756 1.00 12.31 C
-ATOM 14616 H THR L 90 8.131 94.552 31.826 1.00 0.00 H
-ATOM 14617 HA THR L 90 6.738 96.753 33.319 1.00 0.00 H
-ATOM 14618 HB THR L 90 9.579 95.753 33.747 1.00 0.00 H
-ATOM 14619 HG1 THR L 90 7.164 95.587 35.238 1.00 0.00 H
-ATOM 14620 1HG2 THR L 90 9.633 97.389 35.592 1.00 0.00 H
-ATOM 14621 2HG2 THR L 90 9.414 98.199 34.034 1.00 0.00 H
-ATOM 14622 3HG2 THR L 90 8.021 97.975 35.115 1.00 0.00 H
-ATOM 14623 N LEU L 91 7.703 98.621 32.103 1.00 14.49 N
-ATOM 14624 CA LEU L 91 8.211 99.805 31.422 1.00 14.05 C
-ATOM 14625 C LEU L 91 8.923 100.681 32.433 1.00 13.80 C
-ATOM 14626 O LEU L 91 8.384 100.989 33.506 1.00 13.40 O
-ATOM 14627 CB LEU L 91 7.099 100.596 30.735 1.00 13.27 C
-ATOM 14628 CG LEU L 91 7.484 101.967 30.145 1.00 12.02 C
-ATOM 14629 CD1 LEU L 91 8.445 101.777 29.004 1.00 11.64 C
-ATOM 14630 CD2 LEU L 91 6.231 102.669 29.647 1.00 10.60 C
-ATOM 14631 H LEU L 91 6.952 98.747 32.781 1.00 0.00 H
-ATOM 14632 HA LEU L 91 8.933 99.495 30.664 1.00 0.00 H
-ATOM 14633 1HB LEU L 91 6.799 100.022 29.909 1.00 0.00 H
-ATOM 14634 2HB LEU L 91 6.262 100.707 31.401 1.00 0.00 H
-ATOM 14635 HG LEU L 91 7.970 102.572 30.915 1.00 0.00 H
-ATOM 14636 1HD1 LEU L 91 8.718 102.736 28.591 1.00 0.00 H
-ATOM 14637 2HD1 LEU L 91 9.343 101.266 29.355 1.00 0.00 H
-ATOM 14638 3HD1 LEU L 91 7.956 101.181 28.242 1.00 0.00 H
-ATOM 14639 1HD2 LEU L 91 6.503 103.636 29.233 1.00 0.00 H
-ATOM 14640 2HD2 LEU L 91 5.764 102.066 28.875 1.00 0.00 H
-ATOM 14641 3HD2 LEU L 91 5.533 102.804 30.463 1.00 0.00 H
-ATOM 14642 N THR L 92 10.146 101.057 32.114 1.00 14.14 N
-ATOM 14643 CA THR L 92 10.932 101.885 32.997 1.00 15.06 C
-ATOM 14644 C THR L 92 11.371 103.173 32.326 1.00 16.14 C
-ATOM 14645 O THR L 92 11.862 103.157 31.193 1.00 17.18 O
-ATOM 14646 CB THR L 92 12.181 101.123 33.469 1.00 15.74 C
-ATOM 14647 OG1 THR L 92 11.778 99.938 34.158 1.00 16.74 O
-ATOM 14648 CG2 THR L 92 13.029 101.996 34.402 1.00 13.80 C
-ATOM 14649 H THR L 92 10.556 100.746 31.241 1.00 0.00 H
-ATOM 14650 HA THR L 92 10.327 102.141 33.863 1.00 0.00 H
-ATOM 14651 HB THR L 92 12.774 100.838 32.602 1.00 0.00 H
-ATOM 14652 HG1 THR L 92 11.075 100.163 34.772 1.00 0.00 H
-ATOM 14653 1HG2 THR L 92 13.901 101.438 34.717 1.00 0.00 H
-ATOM 14654 2HG2 THR L 92 13.352 102.891 33.876 1.00 0.00 H
-ATOM 14655 3HG2 THR L 92 12.440 102.282 35.277 1.00 0.00 H
-ATOM 14656 N ILE L 93 11.224 104.288 33.041 1.00 17.22 N
-ATOM 14657 CA ILE L 93 11.753 105.555 32.559 1.00 18.24 C
-ATOM 14658 C ILE L 93 12.902 105.878 33.512 1.00 18.68 C
-ATOM 14659 O ILE L 93 12.671 106.178 34.687 1.00 19.79 O
-ATOM 14660 CB ILE L 93 10.697 106.674 32.585 1.00 17.96 C
-ATOM 14661 CG1 ILE L 93 9.458 106.246 31.771 1.00 19.85 C
-ATOM 14662 CG2 ILE L 93 11.299 107.934 31.964 1.00 18.60 C
-ATOM 14663 CD1 ILE L 93 8.256 107.183 31.909 1.00 22.47 C
-ATOM 14664 H ILE L 93 10.763 104.231 33.947 1.00 0.00 H
-ATOM 14665 HA ILE L 93 12.142 105.443 31.548 1.00 0.00 H
-ATOM 14666 HB ILE L 93 10.402 106.885 33.593 1.00 0.00 H
-ATOM 14667 1HG1 ILE L 93 9.741 106.192 30.732 1.00 0.00 H
-ATOM 14668 2HG1 ILE L 93 9.148 105.251 32.094 1.00 0.00 H
-ATOM 14669 1HG2 ILE L 93 10.561 108.737 31.961 1.00 0.00 H
-ATOM 14670 2HG2 ILE L 93 12.169 108.243 32.534 1.00 0.00 H
-ATOM 14671 3HG2 ILE L 93 11.595 107.716 30.936 1.00 0.00 H
-ATOM 14672 1HD1 ILE L 93 7.431 106.809 31.304 1.00 0.00 H
-ATOM 14673 2HD1 ILE L 93 7.944 107.229 32.952 1.00 0.00 H
-ATOM 14674 3HD1 ILE L 93 8.529 108.183 31.570 1.00 0.00 H
-ATOM 14675 N SER L 94 14.143 105.771 33.031 1.00 18.71 N
-ATOM 14676 CA SER L 94 15.295 105.882 33.932 1.00 18.63 C
-ATOM 14677 C SER L 94 15.430 107.239 34.621 1.00 18.75 C
-ATOM 14678 O SER L 94 16.015 107.339 35.697 1.00 21.09 O
-ATOM 14679 CB SER L 94 16.576 105.623 33.175 1.00 18.88 C
-ATOM 14680 OG SER L 94 16.845 106.674 32.293 1.00 19.34 O
-ATOM 14681 H SER L 94 14.276 105.544 32.044 1.00 0.00 H
-ATOM 14682 HA SER L 94 15.189 105.120 34.705 1.00 0.00 H
-ATOM 14683 1HB SER L 94 17.399 105.511 33.878 1.00 0.00 H
-ATOM 14684 2HB SER L 94 16.484 104.692 32.617 1.00 0.00 H
-ATOM 14685 HG SER L 94 16.929 107.461 32.844 1.00 0.00 H
-ATOM 14686 N SER L 95 14.895 108.269 33.986 1.00 16.97 N
-ATOM 14687 CA SER L 95 14.930 109.635 34.483 1.00 16.26 C
-ATOM 14688 C SER L 95 13.802 110.420 33.854 1.00 15.58 C
-ATOM 14689 O SER L 95 13.936 110.879 32.701 1.00 15.85 O
-ATOM 14690 CB SER L 95 16.267 110.264 34.147 1.00 16.18 C
-ATOM 14691 OG SER L 95 16.329 111.583 34.585 1.00 18.15 O
-ATOM 14692 H SER L 95 14.428 108.086 33.110 1.00 0.00 H
-ATOM 14693 HA SER L 95 14.781 109.625 35.574 1.00 0.00 H
-ATOM 14694 1HB SER L 95 17.078 109.686 34.598 1.00 0.00 H
-ATOM 14695 2HB SER L 95 16.410 110.230 33.063 1.00 0.00 H
-ATOM 14696 HG SER L 95 15.425 111.904 34.538 1.00 0.00 H
-ATOM 14697 N LEU L 96 12.722 110.626 34.576 1.00 14.29 N
-ATOM 14698 CA LEU L 96 11.515 111.271 34.083 1.00 12.58 C
-ATOM 14699 C LEU L 96 11.731 112.699 33.621 1.00 11.94 C
-ATOM 14700 O LEU L 96 12.269 113.520 34.368 1.00 11.73 O
-ATOM 14701 CB LEU L 96 10.449 111.234 35.171 1.00 12.59 C
-ATOM 14702 CG LEU L 96 9.084 111.741 34.798 1.00 11.11 C
-ATOM 14703 CD1 LEU L 96 8.483 110.812 33.757 1.00 10.37 C
-ATOM 14704 CD2 LEU L 96 8.271 111.760 36.059 1.00 9.79 C
-ATOM 14705 H LEU L 96 12.700 110.245 35.534 1.00 0.00 H
-ATOM 14706 HA LEU L 96 11.162 110.702 33.217 1.00 0.00 H
-ATOM 14707 1HB LEU L 96 10.342 110.206 35.504 1.00 0.00 H
-ATOM 14708 2HB LEU L 96 10.796 111.827 36.019 1.00 0.00 H
-ATOM 14709 HG LEU L 96 9.137 112.742 34.370 1.00 0.00 H
-ATOM 14710 1HD1 LEU L 96 7.488 111.161 33.476 1.00 0.00 H
-ATOM 14711 2HD1 LEU L 96 9.127 110.814 32.874 1.00 0.00 H
-ATOM 14712 3HD1 LEU L 96 8.424 109.810 34.145 1.00 0.00 H
-ATOM 14713 1HD2 LEU L 96 7.281 112.071 35.873 1.00 0.00 H
-ATOM 14714 2HD2 LEU L 96 8.248 110.770 36.450 1.00 0.00 H
-ATOM 14715 3HD2 LEU L 96 8.725 112.430 36.782 1.00 0.00 H
-ATOM 14716 N GLN L 97 11.319 113.012 32.411 1.00 11.03 N
-ATOM 14717 CA GLN L 97 11.436 114.349 31.878 1.00 9.90 C
-ATOM 14718 C GLN L 97 10.075 115.000 31.848 1.00 10.08 C
-ATOM 14719 O GLN L 97 9.072 114.272 31.783 1.00 9.92 O
-ATOM 14720 CB GLN L 97 12.076 114.290 30.491 1.00 9.77 C
-ATOM 14721 CG GLN L 97 13.426 113.601 30.488 1.00 10.35 C
-ATOM 14722 CD GLN L 97 14.463 114.316 31.331 1.00 15.98 C
-ATOM 14723 OE1 GLN L 97 14.747 115.506 31.159 1.00 17.27 O
-ATOM 14724 NE2 GLN L 97 15.041 113.572 32.256 1.00 15.69 N
-ATOM 14725 H GLN L 97 10.898 112.278 31.800 1.00 0.00 H
-ATOM 14726 HA GLN L 97 12.098 114.931 32.540 1.00 0.00 H
-ATOM 14727 1HB GLN L 97 11.419 113.705 29.835 1.00 0.00 H
-ATOM 14728 2HB GLN L 97 12.184 115.261 30.045 1.00 0.00 H
-ATOM 14729 1HG GLN L 97 13.306 112.596 30.898 1.00 0.00 H
-ATOM 14730 2HG GLN L 97 13.797 113.542 29.469 1.00 0.00 H
-ATOM 14731 1HE2 GLN L 97 15.734 113.969 32.859 1.00 0.00 H
-ATOM 14732 2HE2 GLN L 97 14.769 112.599 32.360 1.00 0.00 H
-ATOM 14733 N PRO L 98 9.898 116.321 31.869 1.00 10.29 N
-ATOM 14734 CA PRO L 98 8.640 117.010 31.732 1.00 10.45 C
-ATOM 14735 C PRO L 98 7.918 116.635 30.438 1.00 11.47 C
-ATOM 14736 O PRO L 98 6.707 116.663 30.335 1.00 12.23 O
-ATOM 14737 CB PRO L 98 9.014 118.485 31.853 1.00 10.27 C
-ATOM 14738 CG PRO L 98 10.476 118.533 31.461 1.00 9.98 C
-ATOM 14739 CD PRO L 98 11.074 117.230 31.955 1.00 10.10 C
-ATOM 14740 HA PRO L 98 8.006 116.738 32.613 1.00 0.00 H
-ATOM 14741 1HB PRO L 98 8.377 119.093 31.165 1.00 0.00 H
-ATOM 14742 2HB PRO L 98 8.840 118.848 32.874 1.00 0.00 H
-ATOM 14743 1HG PRO L 98 10.562 118.651 30.349 1.00 0.00 H
-ATOM 14744 2HG PRO L 98 10.960 119.426 31.926 1.00 0.00 H
-ATOM 14745 1HD PRO L 98 11.883 116.945 31.287 1.00 0.00 H
-ATOM 14746 2HD PRO L 98 11.377 117.301 32.986 1.00 0.00 H
-ATOM 14747 N GLU L 99 8.728 116.259 29.424 1.00 11.73 N
-ATOM 14748 CA GLU L 99 8.219 115.869 28.127 1.00 12.72 C
-ATOM 14749 C GLU L 99 7.581 114.489 28.135 1.00 12.46 C
-ATOM 14750 O GLU L 99 6.994 114.057 27.138 1.00 11.58 O
-ATOM 14751 CB GLU L 99 9.325 115.870 27.050 1.00 13.16 C
-ATOM 14752 CG GLU L 99 9.938 117.246 26.689 1.00 19.66 C
-ATOM 14753 CD GLU L 99 11.051 117.710 27.594 1.00 26.12 C
-ATOM 14754 OE1 GLU L 99 11.668 116.887 28.222 1.00 30.88 O
-ATOM 14755 OE2 GLU L 99 11.265 118.890 27.679 1.00 29.41 O
-ATOM 14756 H GLU L 99 9.718 116.253 29.573 1.00 0.00 H
-ATOM 14757 HA GLU L 99 7.456 116.590 27.825 1.00 0.00 H
-ATOM 14758 1HB GLU L 99 10.137 115.226 27.381 1.00 0.00 H
-ATOM 14759 2HB GLU L 99 8.926 115.438 26.130 1.00 0.00 H
-ATOM 14760 1HG GLU L 99 10.341 117.159 25.679 1.00 0.00 H
-ATOM 14761 2HG GLU L 99 9.149 118.002 26.668 1.00 0.00 H
-ATOM 14762 N ASP L 100 7.699 113.786 29.256 1.00 12.56 N
-ATOM 14763 CA ASP L 100 7.159 112.452 29.392 1.00 12.65 C
-ATOM 14764 C ASP L 100 5.755 112.463 29.947 1.00 12.94 C
-ATOM 14765 O ASP L 100 5.173 111.400 30.182 1.00 11.86 O
-ATOM 14766 CB ASP L 100 8.063 111.595 30.254 1.00 12.39 C
-ATOM 14767 CG ASP L 100 9.365 111.296 29.593 1.00 14.08 C
-ATOM 14768 OD1 ASP L 100 9.389 111.255 28.378 1.00 12.60 O
-ATOM 14769 OD2 ASP L 100 10.359 111.155 30.265 1.00 14.71 O
-ATOM 14770 H ASP L 100 8.179 114.187 30.062 1.00 0.00 H
-ATOM 14771 HA ASP L 100 7.119 112.006 28.394 1.00 0.00 H
-ATOM 14772 1HB ASP L 100 8.253 112.110 31.181 1.00 0.00 H
-ATOM 14773 2HB ASP L 100 7.566 110.663 30.502 1.00 0.00 H
-ATOM 14774 N PHE L 101 5.186 113.656 30.154 1.00 11.75 N
-ATOM 14775 CA PHE L 101 3.806 113.692 30.621 1.00 11.90 C
-ATOM 14776 C PHE L 101 2.963 113.016 29.557 1.00 12.16 C
-ATOM 14777 O PHE L 101 2.822 113.530 28.445 1.00 12.97 O
-ATOM 14778 CB PHE L 101 3.322 115.129 30.829 1.00 11.72 C
-ATOM 14779 CG PHE L 101 1.891 115.205 31.299 1.00 12.66 C
-ATOM 14780 CD1 PHE L 101 1.553 114.906 32.610 1.00 13.78 C
-ATOM 14781 CD2 PHE L 101 0.871 115.557 30.413 1.00 12.92 C
-ATOM 14782 CE1 PHE L 101 0.229 114.962 33.025 1.00 10.98 C
-ATOM 14783 CE2 PHE L 101 -0.447 115.608 30.830 1.00 12.95 C
-ATOM 14784 CZ PHE L 101 -0.764 115.309 32.134 1.00 15.29 C
-ATOM 14785 H PHE L 101 5.689 114.527 29.987 1.00 0.00 H
-ATOM 14786 HA PHE L 101 3.723 113.137 31.558 1.00 0.00 H
-ATOM 14787 1HB PHE L 101 3.955 115.625 31.562 1.00 0.00 H
-ATOM 14788 2HB PHE L 101 3.413 115.682 29.893 1.00 0.00 H
-ATOM 14789 HD1 PHE L 101 2.337 114.625 33.310 1.00 0.00 H
-ATOM 14790 HD2 PHE L 101 1.124 115.793 29.379 1.00 0.00 H
-ATOM 14791 HE1 PHE L 101 -0.029 114.723 34.054 1.00 0.00 H
-ATOM 14792 HE2 PHE L 101 -1.234 115.883 30.128 1.00 0.00 H
-ATOM 14793 HZ PHE L 101 -1.801 115.344 32.463 1.00 0.00 H
-ATOM 14794 N ALA L 102 2.449 111.833 29.875 1.00 11.65 N
-ATOM 14795 CA ALA L 102 1.744 111.013 28.901 1.00 11.41 C
-ATOM 14796 C ALA L 102 0.992 109.864 29.559 1.00 12.15 C
-ATOM 14797 O ALA L 102 1.263 109.490 30.710 1.00 12.87 O
-ATOM 14798 CB ALA L 102 2.728 110.453 27.882 1.00 10.99 C
-ATOM 14799 H ALA L 102 2.588 111.486 30.816 1.00 0.00 H
-ATOM 14800 HA ALA L 102 1.016 111.644 28.385 1.00 0.00 H
-ATOM 14801 1HB ALA L 102 2.190 109.862 27.151 1.00 0.00 H
-ATOM 14802 2HB ALA L 102 3.253 111.260 27.380 1.00 0.00 H
-ATOM 14803 3HB ALA L 102 3.444 109.833 28.392 1.00 0.00 H
-ATOM 14804 N THR L 103 0.075 109.280 28.794 1.00 12.06 N
-ATOM 14805 CA THR L 103 -0.581 108.049 29.202 1.00 12.77 C
-ATOM 14806 C THR L 103 0.190 106.910 28.567 1.00 13.01 C
-ATOM 14807 O THR L 103 0.540 106.972 27.389 1.00 13.36 O
-ATOM 14808 CB THR L 103 -2.061 107.996 28.783 1.00 12.58 C
-ATOM 14809 OG1 THR L 103 -2.771 109.083 29.391 1.00 13.24 O
-ATOM 14810 CG2 THR L 103 -2.688 106.673 29.256 1.00 12.39 C
-ATOM 14811 H THR L 103 -0.126 109.667 27.880 1.00 0.00 H
-ATOM 14812 HA THR L 103 -0.523 107.955 30.276 1.00 0.00 H
-ATOM 14813 HB THR L 103 -2.142 108.074 27.700 1.00 0.00 H
-ATOM 14814 HG1 THR L 103 -2.759 108.969 30.340 1.00 0.00 H
-ATOM 14815 1HG2 THR L 103 -3.734 106.645 28.966 1.00 0.00 H
-ATOM 14816 2HG2 THR L 103 -2.167 105.832 28.808 1.00 0.00 H
-ATOM 14817 3HG2 THR L 103 -2.615 106.603 30.335 1.00 0.00 H
-ATOM 14818 N TYR L 104 0.511 105.894 29.340 1.00 12.66 N
-ATOM 14819 CA TYR L 104 1.279 104.800 28.787 1.00 12.49 C
-ATOM 14820 C TYR L 104 0.426 103.562 28.673 1.00 13.72 C
-ATOM 14821 O TYR L 104 -0.459 103.316 29.497 1.00 13.35 O
-ATOM 14822 CB TYR L 104 2.520 104.555 29.633 1.00 11.67 C
-ATOM 14823 CG TYR L 104 3.469 105.712 29.597 1.00 10.84 C
-ATOM 14824 CD1 TYR L 104 4.514 105.717 28.711 1.00 9.77 C
-ATOM 14825 CD2 TYR L 104 3.271 106.792 30.442 1.00 15.39 C
-ATOM 14826 CE1 TYR L 104 5.372 106.787 28.670 1.00 13.16 C
-ATOM 14827 CE2 TYR L 104 4.129 107.867 30.394 1.00 11.83 C
-ATOM 14828 CZ TYR L 104 5.171 107.863 29.516 1.00 14.89 C
-ATOM 14829 OH TYR L 104 6.017 108.932 29.447 1.00 14.08 O
-ATOM 14830 H TYR L 104 0.212 105.885 30.306 1.00 0.00 H
-ATOM 14831 HA TYR L 104 1.597 105.066 27.783 1.00 0.00 H
-ATOM 14832 1HB TYR L 104 2.241 104.381 30.648 1.00 0.00 H
-ATOM 14833 2HB TYR L 104 3.043 103.665 29.273 1.00 0.00 H
-ATOM 14834 HD1 TYR L 104 4.657 104.869 28.039 1.00 0.00 H
-ATOM 14835 HD2 TYR L 104 2.431 106.795 31.138 1.00 0.00 H
-ATOM 14836 HE1 TYR L 104 6.197 106.797 27.967 1.00 0.00 H
-ATOM 14837 HE2 TYR L 104 3.975 108.724 31.047 1.00 0.00 H
-ATOM 14838 HH TYR L 104 5.595 109.727 29.845 1.00 0.00 H
-ATOM 14839 N TYR L 105 0.695 102.778 27.638 1.00 14.92 N
-ATOM 14840 CA TYR L 105 -0.045 101.547 27.447 1.00 16.71 C
-ATOM 14841 C TYR L 105 0.838 100.366 27.171 1.00 18.17 C
-ATOM 14842 O TYR L 105 1.797 100.451 26.409 1.00 19.12 O
-ATOM 14843 CB TYR L 105 -1.012 101.657 26.261 1.00 16.51 C
-ATOM 14844 CG TYR L 105 -2.053 102.711 26.395 1.00 14.66 C
-ATOM 14845 CD1 TYR L 105 -1.787 104.009 25.980 1.00 13.99 C
-ATOM 14846 CD2 TYR L 105 -3.280 102.386 26.944 1.00 13.10 C
-ATOM 14847 CE1 TYR L 105 -2.755 104.972 26.116 1.00 15.72 C
-ATOM 14848 CE2 TYR L 105 -4.238 103.347 27.084 1.00 14.53 C
-ATOM 14849 CZ TYR L 105 -3.983 104.638 26.673 1.00 17.40 C
-ATOM 14850 OH TYR L 105 -4.939 105.607 26.831 1.00 19.26 O
-ATOM 14851 H TYR L 105 1.428 103.056 26.989 1.00 0.00 H
-ATOM 14852 HA TYR L 105 -0.606 101.332 28.354 1.00 0.00 H
-ATOM 14853 1HB TYR L 105 -0.449 101.852 25.351 1.00 0.00 H
-ATOM 14854 2HB TYR L 105 -1.520 100.697 26.123 1.00 0.00 H
-ATOM 14855 HD1 TYR L 105 -0.813 104.263 25.549 1.00 0.00 H
-ATOM 14856 HD2 TYR L 105 -3.481 101.363 27.273 1.00 0.00 H
-ATOM 14857 HE1 TYR L 105 -2.557 105.993 25.798 1.00 0.00 H
-ATOM 14858 HE2 TYR L 105 -5.197 103.090 27.526 1.00 0.00 H
-ATOM 14859 HH TYR L 105 -5.556 105.341 27.517 1.00 0.00 H
-ATOM 14860 N CYS L 106 0.446 99.240 27.726 1.00 17.68 N
-ATOM 14861 CA CYS L 106 1.023 97.971 27.358 1.00 19.18 C
-ATOM 14862 C CYS L 106 0.060 97.304 26.402 1.00 18.54 C
-ATOM 14863 O CYS L 106 -1.158 97.428 26.564 1.00 19.07 O
-ATOM 14864 CB CYS L 106 1.223 97.094 28.573 1.00 19.19 C
-ATOM 14865 SG CYS L 106 -0.286 96.742 29.460 1.00 28.00 S
-ATOM 14866 H CYS L 106 -0.304 99.261 28.398 1.00 0.00 H
-ATOM 14867 HA CYS L 106 1.986 98.134 26.869 1.00 0.00 H
-ATOM 14868 1HB CYS L 106 1.655 96.142 28.264 1.00 0.00 H
-ATOM 14869 2HB CYS L 106 1.904 97.550 29.243 1.00 0.00 H
-ATOM 14870 N GLN L 107 0.597 96.567 25.447 1.00 17.00 N
-ATOM 14871 CA GLN L 107 -0.223 95.809 24.517 1.00 15.72 C
-ATOM 14872 C GLN L 107 0.354 94.439 24.257 1.00 14.27 C
-ATOM 14873 O GLN L 107 1.551 94.316 24.019 1.00 13.82 O
-ATOM 14874 CB GLN L 107 -0.316 96.513 23.152 1.00 16.40 C
-ATOM 14875 CG GLN L 107 -1.156 95.770 22.102 1.00 16.78 C
-ATOM 14876 CD GLN L 107 -1.228 96.447 20.756 1.00 16.92 C
-ATOM 14877 OE1 GLN L 107 -2.302 96.725 20.219 1.00 21.50 O
-ATOM 14878 NE2 GLN L 107 -0.069 96.716 20.180 1.00 11.91 N
-ATOM 14879 H GLN L 107 1.607 96.562 25.342 1.00 0.00 H
-ATOM 14880 HA GLN L 107 -1.205 95.692 24.947 1.00 0.00 H
-ATOM 14881 1HB GLN L 107 -0.725 97.507 23.275 1.00 0.00 H
-ATOM 14882 2HB GLN L 107 0.676 96.593 22.754 1.00 0.00 H
-ATOM 14883 1HG GLN L 107 -0.711 94.805 21.931 1.00 0.00 H
-ATOM 14884 2HG GLN L 107 -2.164 95.655 22.475 1.00 0.00 H
-ATOM 14885 1HE2 GLN L 107 -0.055 97.165 19.288 1.00 0.00 H
-ATOM 14886 2HE2 GLN L 107 0.786 96.465 20.637 1.00 0.00 H
-ATOM 14887 N GLN L 108 -0.494 93.415 24.207 1.00 13.13 N
-ATOM 14888 CA GLN L 108 0.048 92.147 23.757 1.00 12.56 C
-ATOM 14889 C GLN L 108 -0.329 92.031 22.308 1.00 11.48 C
-ATOM 14890 O GLN L 108 -1.446 92.377 21.918 1.00 11.14 O
-ATOM 14891 CB GLN L 108 -0.447 90.913 24.545 1.00 11.96 C
-ATOM 14892 CG GLN L 108 -1.967 90.682 24.542 1.00 12.35 C
-ATOM 14893 CD GLN L 108 -2.585 89.930 23.308 1.00 13.88 C
-ATOM 14894 OE1 GLN L 108 -1.962 89.145 22.516 1.00 18.45 O
-ATOM 14895 NE2 GLN L 108 -3.898 90.219 23.182 1.00 16.21 N
-ATOM 14896 H GLN L 108 -1.478 93.556 24.422 1.00 0.00 H
-ATOM 14897 HA GLN L 108 1.133 92.163 23.822 1.00 0.00 H
-ATOM 14898 1HB GLN L 108 0.040 90.016 24.146 1.00 0.00 H
-ATOM 14899 2HB GLN L 108 -0.135 91.004 25.575 1.00 0.00 H
-ATOM 14900 1HG GLN L 108 -2.222 90.110 25.422 1.00 0.00 H
-ATOM 14901 2HG GLN L 108 -2.439 91.666 24.603 1.00 0.00 H
-ATOM 14902 1HE2 GLN L 108 -4.480 89.862 22.413 1.00 0.00 H
-ATOM 14903 2HE2 GLN L 108 -4.331 90.843 23.867 1.00 0.00 H
-ATOM 14904 N HIS L 109 0.597 91.502 21.535 1.00 11.28 N
-ATOM 14905 CA HIS L 109 0.422 91.309 20.105 1.00 10.80 C
-ATOM 14906 C HIS L 109 0.808 89.900 19.768 1.00 10.89 C
-ATOM 14907 O HIS L 109 1.536 89.636 18.803 1.00 11.00 O
-ATOM 14908 CB HIS L 109 1.242 92.304 19.289 1.00 10.27 C
-ATOM 14909 CG HIS L 109 2.712 92.268 19.597 1.00 9.83 C
-ATOM 14910 ND1 HIS L 109 3.316 93.106 20.503 1.00 12.10 N
-ATOM 14911 CD2 HIS L 109 3.678 91.460 19.127 1.00 9.45 C
-ATOM 14912 CE1 HIS L 109 4.596 92.811 20.570 1.00 11.08 C
-ATOM 14913 NE2 HIS L 109 4.843 91.812 19.744 1.00 9.39 N
-ATOM 14914 H HIS L 109 1.498 91.251 21.972 1.00 0.00 H
-ATOM 14915 HA HIS L 109 -0.602 91.429 19.845 1.00 0.00 H
-ATOM 14916 1HB HIS L 109 1.122 92.102 18.229 1.00 0.00 H
-ATOM 14917 2HB HIS L 109 0.889 93.325 19.468 1.00 0.00 H
-ATOM 14918 HD2 HIS L 109 3.538 90.660 18.394 1.00 0.00 H
-ATOM 14919 HE1 HIS L 109 5.333 93.302 21.213 1.00 0.00 H
-ATOM 14920 HE2 HIS L 109 5.741 91.365 19.592 1.00 0.00 H
-ATOM 14921 N TYR L 110 0.420 88.985 20.644 1.00 11.33 N
-ATOM 14922 CA TYR L 110 0.716 87.591 20.430 1.00 11.54 C
-ATOM 14923 C TYR L 110 -0.476 87.023 19.671 1.00 12.47 C
-ATOM 14924 O TYR L 110 -0.311 86.374 18.613 1.00 12.06 O
-ATOM 14925 CB TYR L 110 0.938 86.864 21.757 1.00 11.29 C
-ATOM 14926 CG TYR L 110 1.457 85.402 21.659 1.00 10.98 C
-ATOM 14927 CD1 TYR L 110 2.121 84.792 22.694 1.00 11.78 C
-ATOM 14928 CD2 TYR L 110 1.171 84.721 20.487 1.00 7.96 C
-ATOM 14929 CE1 TYR L 110 2.550 83.503 22.597 1.00 9.43 C
-ATOM 14930 CE2 TYR L 110 1.600 83.386 20.365 1.00 10.72 C
-ATOM 14931 CZ TYR L 110 2.276 82.784 21.444 1.00 10.43 C
-ATOM 14932 OH TYR L 110 2.687 81.443 21.350 1.00 11.41 O
-ATOM 14933 H TYR L 110 -0.167 89.223 21.435 1.00 0.00 H
-ATOM 14934 HA TYR L 110 1.582 87.472 19.787 1.00 0.00 H
-ATOM 14935 1HB TYR L 110 1.587 87.391 22.368 1.00 0.00 H
-ATOM 14936 2HB TYR L 110 -0.030 86.777 22.241 1.00 0.00 H
-ATOM 14937 HD1 TYR L 110 2.316 85.388 23.557 1.00 0.00 H
-ATOM 14938 HD2 TYR L 110 0.620 85.208 19.662 1.00 0.00 H
-ATOM 14939 HE1 TYR L 110 3.140 83.062 23.473 1.00 0.00 H
-ATOM 14940 HE2 TYR L 110 1.413 82.798 19.497 1.00 0.00 H
-ATOM 14941 HH TYR L 110 2.690 81.193 20.408 1.00 0.00 H
-ATOM 14942 N THR L 111 -1.668 87.250 20.202 1.00 12.85 N
-ATOM 14943 CA THR L 111 -2.869 86.679 19.664 1.00 14.32 C
-ATOM 14944 C THR L 111 -3.803 87.761 19.101 1.00 15.18 C
-ATOM 14945 O THR L 111 -3.560 88.945 19.308 1.00 14.21 O
-ATOM 14946 CB THR L 111 -3.556 85.872 20.791 1.00 15.09 C
-ATOM 14947 OG1 THR L 111 -3.904 86.801 21.860 1.00 13.50 O
-ATOM 14948 CG2 THR L 111 -2.595 84.796 21.329 1.00 13.16 C
-ATOM 14949 H THR L 111 -1.747 87.824 21.049 1.00 0.00 H
-ATOM 14950 HA THR L 111 -2.599 85.989 18.850 1.00 0.00 H
-ATOM 14951 HB THR L 111 -4.449 85.390 20.406 1.00 0.00 H
-ATOM 14952 HG1 THR L 111 -3.171 87.457 22.002 1.00 0.00 H
-ATOM 14953 1HG2 THR L 111 -3.098 84.232 22.118 1.00 0.00 H
-ATOM 14954 2HG2 THR L 111 -2.333 84.123 20.519 1.00 0.00 H
-ATOM 14955 3HG2 THR L 111 -1.699 85.260 21.722 1.00 0.00 H
-ATOM 14956 N THR L 135 -4.829 87.340 18.363 1.00 15.61 N
-ATOM 14957 CA THR L 135 -5.807 88.241 17.814 1.00 15.99 C
-ATOM 14958 C THR L 135 -7.137 88.107 18.582 1.00 16.43 C
-ATOM 14959 O THR L 135 -7.650 87.000 18.746 1.00 15.70 O
-ATOM 14960 CB THR L 135 -5.996 88.030 16.305 1.00 16.29 C
-ATOM 14961 OG1 THR L 135 -4.765 88.323 15.604 1.00 16.62 O
-ATOM 14962 CG2 THR L 135 -7.097 88.954 15.743 1.00 16.22 C
-ATOM 14963 H THR L 135 -4.931 86.341 18.197 1.00 0.00 H
-ATOM 14964 HA THR L 135 -5.429 89.253 17.912 1.00 0.00 H
-ATOM 14965 HB THR L 135 -6.274 86.977 16.135 1.00 0.00 H
-ATOM 14966 HG1 THR L 135 -4.006 88.051 16.107 1.00 0.00 H
-ATOM 14967 1HG2 THR L 135 -7.225 88.814 14.698 1.00 0.00 H
-ATOM 14968 2HG2 THR L 135 -8.062 88.748 16.248 1.00 0.00 H
-ATOM 14969 3HG2 THR L 135 -6.817 89.997 15.902 1.00 0.00 H
-ATOM 14970 N PRO L 136 -7.720 89.226 19.050 1.00 16.70 N
-ATOM 14971 CA PRO L 136 -7.288 90.595 18.890 1.00 17.20 C
-ATOM 14972 C PRO L 136 -6.108 90.859 19.828 1.00 17.42 C
-ATOM 14973 O PRO L 136 -6.003 90.179 20.861 1.00 17.71 O
-ATOM 14974 CB PRO L 136 -8.542 91.374 19.331 1.00 16.80 C
-ATOM 14975 CG PRO L 136 -9.219 90.482 20.343 1.00 18.22 C
-ATOM 14976 CD PRO L 136 -8.947 89.064 19.863 1.00 16.83 C
-ATOM 14977 HA PRO L 136 -7.069 90.795 17.857 1.00 0.00 H
-ATOM 14978 1HB PRO L 136 -8.263 92.371 19.717 1.00 0.00 H
-ATOM 14979 2HB PRO L 136 -9.206 91.525 18.484 1.00 0.00 H
-ATOM 14980 1HG PRO L 136 -8.804 90.663 21.354 1.00 0.00 H
-ATOM 14981 2HG PRO L 136 -10.296 90.734 20.403 1.00 0.00 H
-ATOM 14982 1HD PRO L 136 -8.744 88.396 20.701 1.00 0.00 H
-ATOM 14983 2HD PRO L 136 -9.790 88.689 19.242 1.00 0.00 H
-ATOM 14984 N PRO L 137 -5.266 91.814 19.492 1.00 17.65 N
-ATOM 14985 CA PRO L 137 -4.283 92.360 20.357 1.00 18.22 C
-ATOM 14986 C PRO L 137 -5.072 93.137 21.363 1.00 19.11 C
-ATOM 14987 O PRO L 137 -6.184 93.592 21.059 1.00 19.49 O
-ATOM 14988 CB PRO L 137 -3.416 93.234 19.417 1.00 17.34 C
-ATOM 14989 CG PRO L 137 -4.337 93.597 18.300 1.00 17.57 C
-ATOM 14990 CD PRO L 137 -5.268 92.396 18.140 1.00 17.09 C
-ATOM 14991 HA PRO L 137 -3.697 91.557 20.823 1.00 0.00 H
-ATOM 14992 1HB PRO L 137 -3.028 94.098 19.989 1.00 0.00 H
-ATOM 14993 2HB PRO L 137 -2.553 92.659 19.088 1.00 0.00 H
-ATOM 14994 1HG PRO L 137 -4.863 94.503 18.555 1.00 0.00 H
-ATOM 14995 2HG PRO L 137 -3.771 93.796 17.382 1.00 0.00 H
-ATOM 14996 1HD PRO L 137 -6.269 92.785 17.903 1.00 0.00 H
-ATOM 14997 2HD PRO L 137 -4.882 91.700 17.388 1.00 0.00 H
-ATOM 14998 N THR L 138 -4.566 93.262 22.571 1.00 19.00 N
-ATOM 14999 CA THR L 138 -5.291 93.998 23.572 1.00 17.74 C
-ATOM 15000 C THR L 138 -4.402 94.974 24.302 1.00 17.37 C
-ATOM 15001 O THR L 138 -3.222 94.703 24.522 1.00 18.95 O
-ATOM 15002 CB THR L 138 -5.975 93.049 24.598 1.00 17.66 C
-ATOM 15003 OG1 THR L 138 -4.976 92.286 25.274 1.00 18.33 O
-ATOM 15004 CG2 THR L 138 -6.974 92.073 23.912 1.00 16.51 C
-ATOM 15005 H THR L 138 -3.632 92.872 22.745 1.00 0.00 H
-ATOM 15006 HA THR L 138 -6.073 94.579 23.077 1.00 0.00 H
-ATOM 15007 HB THR L 138 -6.514 93.650 25.336 1.00 0.00 H
-ATOM 15008 HG1 THR L 138 -4.910 91.409 24.878 1.00 0.00 H
-ATOM 15009 1HG2 THR L 138 -7.431 91.431 24.666 1.00 0.00 H
-ATOM 15010 2HG2 THR L 138 -7.755 92.644 23.403 1.00 0.00 H
-ATOM 15011 3HG2 THR L 138 -6.464 91.449 23.182 1.00 0.00 H
-ATOM 15012 N PHE L 139 -4.996 96.070 24.766 1.00 16.22 N
-ATOM 15013 CA PHE L 139 -4.269 97.079 25.519 1.00 15.67 C
-ATOM 15014 C PHE L 139 -4.693 97.031 26.975 1.00 15.25 C
-ATOM 15015 O PHE L 139 -5.823 96.651 27.283 1.00 15.17 O
-ATOM 15016 CB PHE L 139 -4.571 98.491 24.993 1.00 15.53 C
-ATOM 15017 CG PHE L 139 -4.165 98.780 23.549 1.00 16.29 C
-ATOM 15018 CD1 PHE L 139 -2.914 99.307 23.239 1.00 17.19 C
-ATOM 15019 CD2 PHE L 139 -5.069 98.558 22.502 1.00 14.25 C
-ATOM 15020 CE1 PHE L 139 -2.574 99.598 21.923 1.00 18.46 C
-ATOM 15021 CE2 PHE L 139 -4.727 98.851 21.192 1.00 18.75 C
-ATOM 15022 CZ PHE L 139 -3.484 99.370 20.906 1.00 17.58 C
-ATOM 15023 H PHE L 139 -5.971 96.224 24.565 1.00 0.00 H
-ATOM 15024 HA PHE L 139 -3.205 96.878 25.452 1.00 0.00 H
-ATOM 15025 1HB PHE L 139 -5.639 98.688 25.085 1.00 0.00 H
-ATOM 15026 2HB PHE L 139 -4.069 99.226 25.638 1.00 0.00 H
-ATOM 15027 HD1 PHE L 139 -2.203 99.489 24.044 1.00 0.00 H
-ATOM 15028 HD2 PHE L 139 -6.060 98.155 22.727 1.00 0.00 H
-ATOM 15029 HE1 PHE L 139 -1.589 100.006 21.690 1.00 0.00 H
-ATOM 15030 HE2 PHE L 139 -5.437 98.672 20.386 1.00 0.00 H
-ATOM 15031 HZ PHE L 139 -3.216 99.593 19.876 1.00 0.00 H
-ATOM 15032 N GLY L 140 -3.803 97.451 27.862 1.00 14.45 N
-ATOM 15033 CA GLY L 140 -4.191 97.560 29.262 1.00 15.75 C
-ATOM 15034 C GLY L 140 -5.054 98.802 29.390 1.00 16.21 C
-ATOM 15035 O GLY L 140 -5.251 99.522 28.416 1.00 16.92 O
-ATOM 15036 H GLY L 140 -2.865 97.683 27.554 1.00 0.00 H
-ATOM 15037 1HA GLY L 140 -4.751 96.679 29.568 1.00 0.00 H
-ATOM 15038 2HA GLY L 140 -3.305 97.633 29.889 1.00 0.00 H
-ATOM 15039 N GLN L 141 -5.538 99.089 30.595 1.00 16.39 N
-ATOM 15040 CA GLN L 141 -6.424 100.232 30.813 1.00 17.80 C
-ATOM 15041 C GLN L 141 -5.736 101.556 30.499 1.00 16.82 C
-ATOM 15042 O GLN L 141 -6.375 102.519 30.066 1.00 16.60 O
-ATOM 15043 CB GLN L 141 -6.928 100.232 32.258 1.00 17.61 C
-ATOM 15044 CG GLN L 141 -7.864 99.076 32.583 1.00 24.77 C
-ATOM 15045 CD GLN L 141 -8.330 99.091 34.031 1.00 34.03 C
-ATOM 15046 OE1 GLN L 141 -7.690 99.698 34.893 1.00 36.20 O
-ATOM 15047 NE2 GLN L 141 -9.442 98.419 34.308 1.00 33.63 N
-ATOM 15048 H GLN L 141 -5.330 98.479 31.371 1.00 0.00 H
-ATOM 15049 HA GLN L 141 -7.281 100.137 30.143 1.00 0.00 H
-ATOM 15050 1HB GLN L 141 -6.076 100.180 32.939 1.00 0.00 H
-ATOM 15051 2HB GLN L 141 -7.456 101.162 32.467 1.00 0.00 H
-ATOM 15052 1HG GLN L 141 -8.739 99.132 31.936 1.00 0.00 H
-ATOM 15053 2HG GLN L 141 -7.329 98.139 32.406 1.00 0.00 H
-ATOM 15054 1HE2 GLN L 141 -9.791 98.396 35.246 1.00 0.00 H
-ATOM 15055 2HE2 GLN L 141 -9.931 97.938 33.581 1.00 0.00 H
-ATOM 15056 N GLY L 142 -4.433 101.587 30.731 1.00 16.60 N
-ATOM 15057 CA GLY L 142 -3.610 102.762 30.527 1.00 16.15 C
-ATOM 15058 C GLY L 142 -3.228 103.360 31.853 1.00 16.56 C
-ATOM 15059 O GLY L 142 -4.026 103.334 32.798 1.00 15.56 O
-ATOM 15060 H GLY L 142 -3.997 100.751 31.078 1.00 0.00 H
-ATOM 15061 1HA GLY L 142 -2.721 102.504 29.956 1.00 0.00 H
-ATOM 15062 2HA GLY L 142 -4.164 103.496 29.945 1.00 0.00 H
-ATOM 15063 N THR L 143 -2.031 103.918 31.939 1.00 18.01 N
-ATOM 15064 CA THR L 143 -1.586 104.554 33.169 1.00 18.53 C
-ATOM 15065 C THR L 143 -1.196 105.975 32.871 1.00 18.47 C
-ATOM 15066 O THR L 143 -0.549 106.226 31.856 1.00 19.17 O
-ATOM 15067 CB THR L 143 -0.374 103.860 33.788 1.00 18.29 C
-ATOM 15068 OG1 THR L 143 -0.030 104.504 35.011 1.00 19.27 O
-ATOM 15069 CG2 THR L 143 0.763 103.981 32.879 1.00 19.37 C
-ATOM 15070 H THR L 143 -1.414 103.881 31.122 1.00 0.00 H
-ATOM 15071 HA THR L 143 -2.402 104.552 33.886 1.00 0.00 H
-ATOM 15072 HB THR L 143 -0.590 102.802 33.974 1.00 0.00 H
-ATOM 15073 HG1 THR L 143 -0.112 105.446 34.901 1.00 0.00 H
-ATOM 15074 1HG2 THR L 143 1.600 103.505 33.339 1.00 0.00 H
-ATOM 15075 2HG2 THR L 143 0.531 103.490 31.934 1.00 0.00 H
-ATOM 15076 3HG2 THR L 143 0.986 105.030 32.709 1.00 0.00 H
-ATOM 15077 N LYS L 144 -1.503 106.906 33.752 1.00 18.35 N
-ATOM 15078 CA LYS L 144 -1.117 108.281 33.447 1.00 18.25 C
-ATOM 15079 C LYS L 144 -0.104 108.837 34.433 1.00 17.63 C
-ATOM 15080 O LYS L 144 -0.319 108.848 35.649 1.00 18.49 O
-ATOM 15081 CB LYS L 144 -2.369 109.163 33.307 1.00 18.39 C
-ATOM 15082 CG LYS L 144 -2.115 110.596 32.770 1.00 22.50 C
-ATOM 15083 CD LYS L 144 -2.263 111.664 33.853 1.00 24.67 C
-ATOM 15084 CE LYS L 144 -3.763 111.874 34.186 1.00 24.70 C
-ATOM 15085 NZ LYS L 144 -4.013 112.998 35.158 1.00 22.87 N
-ATOM 15086 H LYS L 144 -2.056 106.657 34.578 1.00 0.00 H
-ATOM 15087 HA LYS L 144 -0.621 108.295 32.481 1.00 0.00 H
-ATOM 15088 1HB LYS L 144 -3.073 108.677 32.628 1.00 0.00 H
-ATOM 15089 2HB LYS L 144 -2.862 109.255 34.276 1.00 0.00 H
-ATOM 15090 1HG LYS L 144 -1.098 110.652 32.358 1.00 0.00 H
-ATOM 15091 2HG LYS L 144 -2.817 110.811 31.962 1.00 0.00 H
-ATOM 15092 1HD LYS L 144 -1.735 111.336 34.748 1.00 0.00 H
-ATOM 15093 2HD LYS L 144 -1.825 112.602 33.514 1.00 0.00 H
-ATOM 15094 1HE LYS L 144 -4.299 112.086 33.258 1.00 0.00 H
-ATOM 15095 2HE LYS L 144 -4.153 110.953 34.616 1.00 0.00 H
-ATOM 15096 1HZ LYS L 144 -5.004 113.074 35.328 1.00 0.00 H
-ATOM 15097 2HZ LYS L 144 -3.536 112.838 36.058 1.00 0.00 H
-ATOM 15098 3HZ LYS L 144 -3.677 113.864 34.773 1.00 0.00 H
-ATOM 15099 N VAL L 145 1.037 109.255 33.884 1.00 16.91 N
-ATOM 15100 CA VAL L 145 2.113 109.798 34.694 1.00 14.99 C
-ATOM 15101 C VAL L 145 1.975 111.300 34.833 1.00 15.85 C
-ATOM 15102 O VAL L 145 1.936 112.023 33.835 1.00 16.40 O
-ATOM 15103 CB VAL L 145 3.493 109.476 34.067 1.00 14.45 C
-ATOM 15104 CG1 VAL L 145 4.618 110.129 34.900 1.00 11.69 C
-ATOM 15105 CG2 VAL L 145 3.691 107.961 33.997 1.00 15.19 C
-ATOM 15106 H VAL L 145 1.143 109.217 32.869 1.00 0.00 H
-ATOM 15107 HA VAL L 145 2.064 109.350 35.688 1.00 0.00 H
-ATOM 15108 HB VAL L 145 3.535 109.898 33.063 1.00 0.00 H
-ATOM 15109 1HG1 VAL L 145 5.581 109.903 34.446 1.00 0.00 H
-ATOM 15110 2HG1 VAL L 145 4.478 111.209 34.932 1.00 0.00 H
-ATOM 15111 3HG1 VAL L 145 4.599 109.747 35.907 1.00 0.00 H
-ATOM 15112 1HG2 VAL L 145 4.659 107.742 33.544 1.00 0.00 H
-ATOM 15113 2HG2 VAL L 145 3.655 107.547 34.987 1.00 0.00 H
-ATOM 15114 3HG2 VAL L 145 2.899 107.515 33.394 1.00 0.00 H
-ATOM 15115 N GLU L 146 1.910 111.762 36.070 1.00 15.50 N
-ATOM 15116 CA GLU L 146 1.827 113.179 36.359 1.00 17.57 C
-ATOM 15117 C GLU L 146 3.211 113.616 36.762 1.00 16.96 C
-ATOM 15118 O GLU L 146 3.945 112.831 37.375 1.00 16.92 O
-ATOM 15119 CB GLU L 146 0.801 113.460 37.451 1.00 18.30 C
-ATOM 15120 CG GLU L 146 -0.608 113.064 37.040 1.00 25.15 C
-ATOM 15121 CD GLU L 146 -1.669 113.387 38.053 1.00 33.01 C
-ATOM 15122 OE1 GLU L 146 -1.347 113.906 39.094 1.00 33.22 O
-ATOM 15123 OE2 GLU L 146 -2.826 113.129 37.762 1.00 36.90 O
-ATOM 15124 H GLU L 146 1.919 111.095 36.840 1.00 0.00 H
-ATOM 15125 HA GLU L 146 1.546 113.719 35.458 1.00 0.00 H
-ATOM 15126 1HB GLU L 146 1.065 112.900 38.349 1.00 0.00 H
-ATOM 15127 2HB GLU L 146 0.805 114.520 37.705 1.00 0.00 H
-ATOM 15128 1HG GLU L 146 -0.850 113.563 36.106 1.00 0.00 H
-ATOM 15129 2HG GLU L 146 -0.611 111.989 36.858 1.00 0.00 H
-ATOM 15130 N ILE L 147 3.590 114.836 36.420 1.00 17.11 N
-ATOM 15131 CA ILE L 147 4.940 115.248 36.726 1.00 16.64 C
-ATOM 15132 C ILE L 147 5.028 116.383 37.729 1.00 16.23 C
-ATOM 15133 O ILE L 147 4.388 117.437 37.568 1.00 16.84 O
-ATOM 15134 CB ILE L 147 5.716 115.552 35.445 1.00 16.80 C
-ATOM 15135 CG1 ILE L 147 5.681 114.296 34.569 1.00 19.77 C
-ATOM 15136 CG2 ILE L 147 7.145 115.910 35.774 1.00 16.41 C
-ATOM 15137 CD1 ILE L 147 6.395 114.414 33.286 1.00 22.75 C
-ATOM 15138 H ILE L 147 2.956 115.458 35.933 1.00 0.00 H
-ATOM 15139 HA ILE L 147 5.445 114.398 37.176 1.00 0.00 H
-ATOM 15140 HB ILE L 147 5.240 116.372 34.904 1.00 0.00 H
-ATOM 15141 1HG1 ILE L 147 6.087 113.508 35.111 1.00 0.00 H
-ATOM 15142 2HG1 ILE L 147 4.646 114.048 34.338 1.00 0.00 H
-ATOM 15143 1HG2 ILE L 147 7.683 116.104 34.856 1.00 0.00 H
-ATOM 15144 2HG2 ILE L 147 7.165 116.802 36.404 1.00 0.00 H
-ATOM 15145 3HG2 ILE L 147 7.620 115.080 36.306 1.00 0.00 H
-ATOM 15146 1HD1 ILE L 147 6.331 113.475 32.736 1.00 0.00 H
-ATOM 15147 2HD1 ILE L 147 5.975 115.215 32.689 1.00 0.00 H
-ATOM 15148 3HD1 ILE L 147 7.431 114.629 33.505 1.00 0.00 H
-ATOM 15149 N LYS L 148 5.802 116.141 38.778 1.00 15.64 N
-ATOM 15150 CA LYS L 148 6.029 117.056 39.882 1.00 15.93 C
-ATOM 15151 C LYS L 148 7.471 117.600 39.829 1.00 14.55 C
-ATOM 15152 O LYS L 148 8.115 117.524 38.783 1.00 14.92 O
-ATOM 15153 OXT LYS L 148 8.081 117.554 40.907 1.00 0.00 O
-ATOM 15154 CB LYS L 148 5.820 116.337 41.226 1.00 16.17 C
-ATOM 15155 CG LYS L 148 4.460 115.669 41.447 1.00 19.62 C
-ATOM 15156 CD LYS L 148 4.323 115.153 42.922 1.00 23.99 C
-ATOM 15157 CE LYS L 148 5.239 113.939 43.220 1.00 24.82 C
-ATOM 15158 NZ LYS L 148 5.015 113.383 44.610 1.00 23.33 N
-ATOM 15159 H LYS L 148 6.259 115.230 38.800 1.00 0.00 H
-ATOM 15160 HA LYS L 148 5.343 117.894 39.788 1.00 0.00 H
-ATOM 15161 1HB LYS L 148 6.571 115.560 41.330 1.00 0.00 H
-ATOM 15162 2HB LYS L 148 5.982 117.051 42.040 1.00 0.00 H
-ATOM 15163 1HG LYS L 148 3.639 116.356 41.221 1.00 0.00 H
-ATOM 15164 2HG LYS L 148 4.390 114.811 40.774 1.00 0.00 H
-ATOM 15165 1HD LYS L 148 4.583 115.952 43.620 1.00 0.00 H
-ATOM 15166 2HD LYS L 148 3.283 114.863 43.099 1.00 0.00 H
-ATOM 15167 1HE LYS L 148 5.032 113.155 42.490 1.00 0.00 H
-ATOM 15168 2HE LYS L 148 6.285 114.243 43.127 1.00 0.00 H
-ATOM 15169 1HZ LYS L 148 5.634 112.584 44.757 1.00 0.00 H
-ATOM 15170 2HZ LYS L 148 5.215 114.106 45.299 1.00 0.00 H
-ATOM 15171 3HZ LYS L 148 4.046 113.081 44.703 1.00 0.00 H
-TER
-# All scores below are weighted scores, not raw scores.
-#BEGIN_POSE_ENERGIES_TABLE ./data/my_lab_test.pdb
-label fa_atr fa_rep fa_sol fa_intra_rep fa_intra_sol_xover4 lk_ball_wtd fa_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun p_aa_pp yhh_planarity ref rama_prepro cart_bonded total
-weights 1 0.55 1 0.005 1 1 1 1 1 1 1 1.25 0.4 0.7 0.6 0.625 1 0.45 0.625 NA
-pose -5650.11 493.794 3289.98 11.6901 171.738 -103.781 -1943.84 -81.9051 -633.397 -264.183 -169.116 -1.78212 25.1349 1204.9 -259.693 1.18051 372.765 -41.4564 779.291 -2798.8
-SER:NtermProteinFull_1 -1.67573 0.03249 2.47203 0.00244 0.07394 -0.29844 -0.83766 0 0 0 0 0 -0.09225 0.2031 0 0 -0.28969 0 0.01875 -0.39102
-ASP_2 -3.67553 0.11443 4.17524 0.00382 0.25989 -0.29458 -3.91878 0 0 0 -0.61269 0 -0.01847 1.49142 0.04109 0 -2.14574 -0.18752 0.14556 -4.62185
-PHE_3 -8.67545 0.99192 2.22062 0.02577 0.48106 -0.2149 -1.35467 0 0 -0.48047 0 0 -0.0091 1.19518 -0.50505 0 1.21829 -0.25444 0.27429 -5.08696
-VAL_4 -6.89365 0.44002 0.9908 0.02154 0.05376 0.11345 -2.04459 0 0 0 0 0 -0.01829 0.02701 -0.37117 0 2.64269 -0.24522 0.20936 -5.07428
-VAL_5 -7.74701 1.06959 1.52176 0.01875 0.0483 0.21359 -2.23533 0 0 0 0 0 -0.04452 0.02621 -0.72183 0 2.64269 -0.35935 0.28166 -5.28549
-ILE_6 -8.06671 0.78754 0.41492 0.02547 0.08156 0.04588 -2.19876 0 0 0 0 0 -0.02643 0.25274 -0.69225 0 2.30374 -0.32157 0.36437 -7.0295
-LYS_7 -8.63251 0.62913 6.79395 0.0197 0.23747 0.55492 -5.87307 0 0 -0.3697 -0.88857 0 -0.05816 1.29889 0.36145 0 -0.71458 -0.03084 0.49465 -6.17729
-ALA_8 -6.64454 0.63922 1.96437 0.00182 0 -0.05565 -2.38374 0 0 0 0 0 0.01227 0 0.2819 0 1.32468 0.05222 0.49656 -4.31088
-LEU_9 -6.69852 0.69733 2.96198 0.02201 0.08904 -0.45444 -1.18271 0 0 0 0 0 0.11058 0.05054 -0.11025 0 1.66147 -0.21205 0.41959 -2.64542
-GLU_10 -5.89154 0.36699 5.09229 0.00733 0.37925 -0.06749 -1.83001 0 0 -0.88142 0 0 0.01613 2.71131 0.04403 0 -2.72453 -0.0883 0.47079 -2.39515
-ASP_11 -3.23563 0.17859 3.3904 0.00305 0.26619 -0.11757 -2.43836 0 0 -0.88124 0 0 0.05484 1.61798 0.06058 0 -2.14574 -0.17429 0.42164 -2.99957
-GLY_12 -1.71053 0.04938 1.91063 8e-05 0 0.01233 -0.76724 0 0 0 0 0 -0.12996 0 -1.50136 0 0.79816 -0.29949 0.39716 -1.24084
-VAL_13 -7.82922 1.01732 1.75088 0.0156 0.03872 0.00549 -2.28227 0 0 0 0 0 0.13704 0.16377 -0.27921 0 2.64269 -0.27409 0.51124 -4.38204
-ASN_14 -6.44274 0.29964 5.77391 0.01104 0.46094 0.18848 -2.77875 0 0 0 -0.86411 0 -0.05116 3.41258 -0.02333 0 -1.34026 -0.08917 0.46092 -0.98201
-VAL_15 -6.76915 0.53815 1.20901 0.01708 0.0435 -0.05978 -2.09923 0 0 0 0 0 0.14036 0.04673 -0.60938 0 2.64269 -0.04733 0.29352 -4.65383
-ILE_16 -7.55615 0.82885 3.21388 0.03079 0.07467 -0.02771 -2.15151 0 0 0 0 0 0.01985 0.30671 -0.77239 0 2.30374 -0.39628 0.30304 -3.82252
-GLY_17 -4.28913 0.28536 2.9349 2e-05 0 -0.01138 -3.08737 0 0 0 0 0 -0.0703 0 1.15132 0 0.79816 0.58414 0.25304 -1.45124
-LEU_18 -8.16576 0.67118 2.99714 0.01717 0.07318 -0.16463 -2.91072 0 0 0 0 0 0.37882 1.91893 -0.32237 0 1.66147 0.76478 0.3208 -2.76
-THR_19 -5.73433 0.60723 4.74071 0.00601 0.09565 -0.04412 -2.01876 0 0 -0.70977 0 0 0.13865 0.54442 0.2941 0 1.15175 -0.10881 0.93817 -0.09909
-ARG_20 -7.73025 0.34082 7.96821 0.01516 0.5071 0.20965 -4.50527 0 0 -0.92426 -1.20701 0 -0.03842 2.06496 -0.00956 0 -0.09474 -0.14973 1.02345 -2.52988
-GLY_21 -2.02595 0.16087 1.87261 9e-05 0 -0.3776 0.27628 0 0 0 0 0 -0.09092 0 -1.51755 0 0.79816 0.27822 0.30075 -0.32503
-ALA_22 -2.09071 0.07945 1.77252 0.0014 0 -0.29537 0.48313 0 0 0 0 0 -0.04466 0 -0.34444 0 1.32468 0.08309 0.07735 1.04644
-ASP_23 -1.82023 0.13632 2.23544 0.00347 0.29101 -0.34288 -0.3545 0 0 0 0 0 -0.05141 2.77089 -0.1554 0 -2.14574 -0.27766 0.14515 0.43447
-THR_24 -3.42811 0.1567 2.18295 0.01064 0.06042 -0.52988 -0.20659 0 0 0 0 0 -0.00614 0.03299 0.10818 0 1.15175 0.06101 0.19725 -0.20883
-ARG_25 -5.193 0.35775 4.65174 0.01905 0.64168 -0.0588 -1.89396 0 0 -0.70977 0 0 -0.00564 5.34573 -0.07367 0 -0.09474 0.03482 0.77623 3.79742
-PHE_26 -4.6157 0.64522 2.24395 0.02686 0.54811 -0.21317 -0.5353 0 0 0 0 0 0.01095 3.01741 -0.10981 0 1.21829 -0.16344 0.89681 2.97016
-HIS_27 -6.32632 0.3082 4.62107 0.00754 0.78156 -0.4582 -0.40924 0 0 0 -0.96772 0 0.03632 2.97194 -0.45582 0 -0.30065 0.12313 0.37978 0.3116
-HIS_28 -6.70091 0.41884 5.76609 0.00498 0.32345 -0.21091 -1.75567 0 0 0 -0.92352 0 -0.02163 1.50486 -0.43815 0 -0.30065 0.28567 0.31583 -1.7317
-SER_29 -2.97588 0.09718 2.72347 0.00224 0.0714 -0.12753 -0.52587 0 0 0 -0.86411 0 -0.04238 0.22082 0.21244 0 -0.28969 0.36639 0.28461 -0.84693
-GLU_30 -5.8474 0.24428 6.40631 0.00899 0.53436 0.51693 -4.84113 0 0 0 -1.71964 0 -0.03936 3.84855 0.31075 0 -2.72453 0.43968 0.23207 -2.63014
-LYS_31 -2.63791 0.20263 2.56648 0.01146 0.28982 -0.09158 -1.19656 0 0 0 0 0 0.01736 2.68599 0.01852 0 -0.71458 0.01786 0.1823 1.35179
-LEU_32 -8.35197 0.85929 3.20229 0.01238 0.05096 0.15168 -3.02931 0 0 0 0 0 0.27141 0.23432 -0.02674 0 1.66147 -0.09517 0.29305 -4.76633
-ASP_33 -4.4109 0.25876 4.87589 0.00302 0.25928 -0.04733 -3.11706 0 0 -0.9164 0 0 0.02728 1.93066 0.17402 0 -2.14574 -0.00348 0.51153 -2.60047
-LYS_34 -5.28208 0.37681 4.44083 0.00879 0.14629 -0.4945 -1.96566 0 0 -0.88124 0 0 -0.09165 1.03239 -0.00614 0 -0.71458 -0.19863 0.33402 -3.29534
-GLY_35 -3.99835 0.1656 3.28346 8e-05 0 0.10788 -2.01786 0 0 0 0 0 -0.13574 0 -1.49062 0 0.79816 -0.57581 0.30681 -3.5564
-GLU_36 -7.68034 0.3865 8.39696 0.0038 0.18712 0.11528 -6.12074 0 0 -0.9164 -1.07076 0 -0.00518 3.36259 -0.04128 0 -2.72453 -0.53685 0.41795 -6.22588
-VAL_37 -7.41722 0.57963 1.41185 0.01835 0.04412 0.06901 -1.93134 0 0 0 0 0 -0.02289 0.06842 -0.77808 0 2.64269 -0.37053 0.25418 -5.43182
-LEU_38 -7.40013 0.49424 1.51858 0.01625 0.09599 0.0311 -2.19895 0 0 0 0 0 0.00204 0.42884 -0.25158 0 1.66147 -0.15691 0.16655 -5.59253
-ILE_39 -8.34293 1.24345 0.63541 0.02444 0.07522 0.17317 -2.30239 0 0 0 0 0 0.22874 0.39218 -0.70791 0 2.30374 -0.14248 0.68296 -5.73639
-ALA_40 -4.60223 0.47489 1.80796 0.00157 0 0.13986 -2.07505 0 0 0 0 0 0.00965 0 -0.11171 0 1.32468 -0.03123 0.88605 -2.17556
-GLN_41 -7.2259 0.52771 5.0873 0.00803 0.20295 -0.36335 -3.04844 0 0 0 -0.62655 0 0.31632 2.48862 -0.08887 0 -1.45095 0.03912 0.60057 -3.53345
-PHE_42 -8.37704 0.73787 2.06455 0.02212 0.24428 -0.81205 -1.26158 0 0 0 0 0 0.47026 1.64095 -0.20276 0 1.21829 -0.27774 0.72938 -3.80348
-THR_43 -6.02633 0.52486 6.13913 0.00727 0.07539 -0.09438 -2.40925 0 0 -2.7904 0 0 0.14787 0.18919 -0.74067 0 1.15175 -0.21456 0.68092 -3.35922
-GLU_44 -3.7315 0.25228 3.67186 0.01134 1.25507 -0.42639 -0.80328 0 0 0 0 0 0.02606 2.99747 -0.22045 0 -2.72453 -0.17495 0.48968 0.62267
-HIS_45 -6.04153 0.69522 5.19033 0.00297 0.37023 -0.89934 -1.40308 0 0 -0.99995 0 0 0.05149 2.25009 -0.31069 0 -0.30065 0.08983 0.39371 -0.91137
-THR_46 -6.92943 0.16819 5.22166 0.01203 0.06619 0.09428 -1.14493 0 0 -0.86619 -0.96772 0 -0.04902 0.01929 0.08997 0 1.15175 0.34152 0.43658 -2.35584
-SER_47 -5.45579 0.25488 4.57474 0.0022 0.05495 -0.17557 -1.80647 0 0 0 0 0 0.03354 0.21723 -0.02246 0 -0.28969 0.14762 0.34661 -2.11823
-ALA_48 -5.75051 0.67462 1.70865 0.00118 0 0.13751 -1.76207 0 0 0 0 0 -0.00657 0 -0.47806 0 1.32468 0.02759 0.20523 -3.91775
-ILE_49 -7.29541 0.53297 1.32149 0.02332 0.06835 -0.00869 -2.40303 0 0 0 0 0 -0.06291 0.16695 -0.71479 0 2.30374 -0.15662 0.19625 -6.02838
-LYS_50 -7.70953 0.55812 5.91764 0.00866 0.14422 -0.01141 -5.41468 0 0 0 -0.56545 0 -0.00581 1.25406 0.28853 0 -0.71458 -0.1595 0.27681 -6.13292
-VAL_51 -6.85648 0.57171 0.78539 0.01863 0.04101 -0.07959 -1.90438 0 0 0 0 0 -0.06238 0.2055 -0.79142 0 2.64269 -0.19523 0.35581 -5.26875
-ARG_52 -5.21322 0.33632 4.1215 0.01459 0.35471 0.30368 -2.74503 0 0 0 0 0 -0.02663 2.15533 0.01429 0 -0.09474 -0.23011 0.45935 -0.54995
-GLY_53 -3.29879 0.11059 3.05731 0.00012 0 -0.15723 -1.49112 0 0 0 0 0 0.08211 0 -1.48799 0 0.79816 0.05833 0.43322 -1.89529
-LYS_54 -6.77197 0.97439 6.28767 0.01284 0.25262 0.23024 -5.03056 0 0 -0.88142 -0.63491 0 -0.05841 4.05182 0.10549 0 -0.71458 0.0888 0.41056 -1.6774
-ALA_55 -6.44707 0.6076 2.79461 0.00132 0 0.22313 -1.91437 0 0 0 0 0 -0.01397 0 -0.26387 0 1.32468 0.16237 0.44069 -3.0849
-TYR_56 -7.04055 0.54525 3.47635 0.02153 0.08384 0.21357 -2.30451 0 0 0 0 0 -0.03252 2.41169 0.01966 0.00327 0.58223 0.04735 0.4335 -1.53933
-ILE_57 -8.96769 1.1929 1.70663 0.03233 0.07271 0.03784 -2.08318 0 0 0 0 0 -0.01113 0.27555 -0.73297 0 2.30374 -0.28596 0.4492 -6.01001
-GLN_58 -8.18995 0.60162 4.71835 0.00691 0.21628 -0.07757 -2.98166 0 0 -0.38131 0 0 -0.01675 3.14978 0.26048 0 -1.45095 -0.17379 0.47134 -3.84722
-THR_59 -6.6411 0.64754 3.49212 0.01076 0.08135 -0.34546 -1.00731 0 0 -0.92314 0 0 -0.01436 0.70569 -0.63765 0 1.15175 -0.08999 0.56328 -3.00652
-ARG_60 -5.07699 0.31033 4.93577 0.01499 0.63439 -0.54363 -1.31978 0 0 0 -0.61269 0 -0.0251 3.84472 -0.10782 0 -0.09474 -0.30819 0.6749 2.32617
-HIS_61 -6.85429 0.53918 4.69839 0.00662 0.48243 -0.73321 -0.81363 0 0 -1.40884 0 0 -0.02139 2.9101 -0.29558 0 -0.30065 -0.51748 0.59211 -1.71623
-GLY_62 -2.38662 0.16637 2.73161 8e-05 0 -0.06443 -1.29425 0 0 0 0 0 -0.09319 0 -1.51783 0 0.79816 0.34541 0.26515 -1.04954
-VAL_63 -3.89515 0.28875 1.42533 0.0193 0.05275 0.06969 -1.18043 0 0 -0.47699 0 0 -0.01918 0.00485 -0.36071 0 2.64269 0.47729 0.18735 -0.76447
-ILE_64 -6.93582 0.83061 1.61889 0.0261 0.08178 0.09673 -1.43549 0 0 0 0 0 -0.00346 2.15454 0.09691 0 2.30374 -0.06255 0.39477 -0.83324
-GLU_65 -3.99681 0.36568 3.08585 0.0057 0.27694 0.0376 -1.98646 0 0 -0.40207 0 0 -0.01496 2.85362 0.36529 0 -2.72453 0.25464 0.36408 -1.51542
-SER_66 -6.05608 0.62873 5.31325 0.00173 0.07646 -0.06662 -2.76581 0 0 0 0 0 0.09232 0.4616 -0.13243 0 -0.28969 0.04046 0.26352 -2.43256
-GLU:CtermProteinFull_67 -5.39384 0.50106 7.36677 0.00664 0.34626 0.12369 -5.57115 0 0 0 -1.4533 0 0 4.05182 0 0 -2.72453 -0.1115 0.56382 -2.29425
-SER:NtermProteinFull_68 -1.45703 0.01042 2.22936 0.00248 0.05274 -0.28465 -0.803 0 0 0 0 0 0.05805 0.47944 0 0 -0.28969 0 0.04372 0.04184
-ASP_69 -4.02187 0.16976 4.32418 0.00687 0.28932 -0.19839 -3.86784 0 0 0 0 0 -0.01727 1.4905 0.03865 0 -2.14574 -0.18084 0.39124 -3.72143
-PHE_70 -8.84911 1.13099 2.60306 0.02819 0.51935 -0.13646 -1.41905 0 0 -0.4857 0 0 -0.00745 1.18741 -0.50464 0 1.21829 -0.24989 0.5176 -4.44741
-VAL_71 -6.85274 0.46267 0.84171 0.02459 0.05499 0.05877 -2.07975 0 0 0 0 0 -0.01762 0.06112 -0.36031 0 2.64269 -0.24482 0.29872 -5.10998
-VAL_72 -7.4513 0.95819 1.49646 0.0183 0.04649 0.2263 -2.26909 0 0 0 0 0 -0.04871 0.07047 -0.73992 0 2.64269 -0.36508 0.37597 -5.03922
-ILE_73 -7.86502 0.8615 0.36872 0.02546 0.07677 0.01538 -2.14697 0 0 0 0 0 -0.03513 0.19097 -0.67593 0 2.30374 -0.33129 0.4249 -6.78691
-LYS_74 -8.27709 0.57648 6.55013 0.01772 0.21076 0.46385 -5.85125 0 0 -0.40207 -0.81839 0 -0.05938 1.18881 0.35022 0 -0.71458 -0.03978 0.53668 -6.26789
-ALA_75 -6.50778 0.59417 1.88742 0.00179 0 -0.18468 -2.27855 0 0 0 0 0 0.03069 0 0.17205 0 1.32468 -0.10506 0.52771 -4.53756
-LEU_76 -6.22209 0.44133 2.72028 0.02236 0.09308 -0.41664 -1.09017 0 0 0 0 0 0.01214 0.05899 -0.12667 0 1.66147 -0.34863 0.29798 -2.89655
-GLU_77 -6.32444 0.40117 5.70657 0.00836 0.38801 -0.26459 -1.95445 0 0 -0.87774 0 0 -0.00517 2.43392 0.13778 0 -2.72453 -0.05733 0.29026 -2.84218
-ASP_78 -3.46119 0.26695 3.56387 0.00391 0.2862 -0.14227 -2.66466 0 0 -0.8941 0 0 0.10122 1.71465 0.08786 0 -2.14574 -0.10544 0.35791 -3.03083
-GLY_79 -2.14866 0.03111 2.57059 9e-05 0 -0.20065 -0.55465 0 0 0 0 0 -0.12066 0 -1.48125 0 0.79816 -0.19373 0.34658 -0.95307
-VAL_80 -8.2177 1.00061 2.41131 0.01625 0.03947 0.06473 -2.32743 0 0 0 0 0 0.02579 0.17441 -0.31683 0 2.64269 -0.21906 0.43632 -4.26943
-ASN_81 -5.9839 0.38648 4.91966 0.00437 0.26674 -0.32098 -2.27306 0 0 0 0 0 0.01826 2.18449 0.16934 0 -1.34026 -0.07123 0.41066 -1.62942
-VAL_82 -6.50957 0.50923 0.84169 0.01773 0.04514 0.09878 -2.103 0 0 0 0 0 0.3461 0.00932 -0.52003 0 2.64269 0.00872 0.37763 -4.23558
-ILE_83 -8.41047 0.87609 2.65637 0.03298 0.07615 0.05558 -2.38638 0 0 0 0 0 0.01328 0.31307 -0.76576 0 2.30374 -0.37247 0.45006 -5.15775
-GLY_84 -4.14552 0.27713 2.76853 3e-05 0 -0.1116 -2.50594 0 0 0 0 0 -0.04608 0 1.00375 0 0.79816 0.41537 0.29553 -1.25064
-LEU_85 -8.85239 0.80347 2.70081 0.01768 0.07319 -0.21882 -3.22874 0 0 0 0 0 0.3536 1.85768 -0.31624 0 1.66147 0.62157 0.31119 -4.21553
-THR_86 -6.15996 0.67292 4.96865 0.00536 0.09545 -0.02814 -3.05595 0 0 -0.87413 0 0 0.0035 0.49817 0.33648 0 1.15175 -0.08865 0.77039 -1.70418
-ARG_87 -7.17791 0.3563 6.99185 0.01674 0.54021 -0.21464 -3.23115 0 0 -0.95277 -0.59286 0 -0.02322 2.13616 0.01967 0 -0.09474 -0.09293 0.75023 -1.56905
-GLY_88 -2.11259 0.18721 1.90505 0.00011 0 -0.42037 0.34135 0 0 0 0 0 -0.10784 0 -1.51814 0 0.79816 0.32399 0.20359 -0.3995
-ALA_89 -2.07462 0.06412 1.74867 0.00133 0 -0.37766 0.61402 0 0 0 0 0 0.01251 0 -0.30483 0 1.32468 0.08629 0.05548 1.14999
-ASP_90 -1.83426 0.16472 2.33468 0.00315 0.27508 -0.40261 -0.49942 0 0 0 0 0 0.00628 1.97561 0.64142 0 -2.14574 -0.08465 0.12501 0.55928
-THR_91 -3.76276 0.35319 2.16521 0.01072 0.05573 -0.45058 -0.73507 0 0 0 0 0 -0.03229 0.06463 -0.16101 0 1.15175 0.22845 0.22044 -0.89159
-ARG_92 -5.21941 0.39624 4.28132 0.01647 0.47264 0.01573 -2.31677 0 0 -1.26709 0 0 0.0372 1.2514 -0.05852 0 -0.09474 0.096 0.43537 -1.95416
-PHE_93 -5.6608 0.50448 1.28164 0.04995 0.24038 -0.01452 -0.81107 0 0 -0.39296 0 0 0.02569 3.41336 -0.10082 0 1.21829 -0.15097 0.5253 0.12795
-HIS_94 -5.67391 0.24911 4.42417 0.00681 0.7844 -0.45202 -0.44671 0 0 0 -0.91934 0 0.01216 2.99693 -0.46418 0 -0.30065 0.05579 0.33353 0.6061
-HIS_95 -6.06556 0.35191 5.52023 0.00458 0.32334 -0.22197 -1.47491 0 0 0 -0.8132 0 0.03559 1.42638 -0.53675 0 -0.30065 0.46034 0.19378 -1.09689
-SER_96 -3.15635 0.15366 2.45965 0.00178 0.02883 -0.32391 -0.37082 0 0 0 0 0 -0.0485 1.00288 0.24129 0 -0.28969 0.51395 0.17673 0.38948
-GLU_97 -6.05108 0.21478 6.08607 0.0086 0.59275 0.47175 -4.42662 0 0 0 -1.37865 0 -0.03262 3.42106 0.26271 0 -2.72453 0.37476 0.16508 -3.01594
-LYS_98 -3.18028 0.29388 2.95904 0.00736 0.12297 -0.28563 -1.15111 0 0 0 0 0 0.0749 1.30455 0.03277 0 -0.71458 -0.03675 0.23998 -0.3329
-LEU_99 -8.70237 0.74813 3.1125 0.012 0.05419 0.03598 -3.02114 0 0 0 0 0 0.22758 0.28798 -0.14384 0 1.66147 -0.14522 0.3916 -5.48112
-ASP_100 -4.86667 0.46689 5.38739 0.00492 0.2464 -0.12094 -3.41072 0 0 -0.83617 0 0 0.21347 2.01753 0.17042 0 -2.14574 0.02125 0.58875 -2.26322
-LYS_101 -5.17735 0.34058 4.3724 0.0085 0.14314 -0.51955 -1.83047 0 0 -0.8941 0 0 -0.0924 1.016 -0.01141 0 -0.71458 -0.11376 0.39893 -3.07406
-GLY_102 -3.91936 0.22239 3.38908 7e-05 0 -0.01111 -1.96996 0 0 0 0 0 -0.14089 0 -1.48921 0 0.79816 -0.52408 0.28152 -3.36339
-GLU_103 -7.0011 0.34928 7.04065 0.00463 0.21591 -0.2349 -4.54617 0 0 -0.83617 0 0 0.02006 3.11681 -0.04096 0 -2.72453 -0.51211 0.3786 -4.76999
-VAL_104 -7.34926 0.57477 1.32528 0.018 0.04343 0.0285 -1.97274 0 0 0 0 0 -0.01217 0.09614 -0.79254 0 2.64269 -0.36537 0.25054 -5.51271
-LEU_105 -7.52019 0.55383 1.3665 0.01689 0.09437 0.01145 -2.22184 0 0 0 0 0 0.01648 0.41408 -0.18602 0 1.66147 -0.13285 0.18933 -5.7365
-ILE_106 -8.15254 1.21336 0.64001 0.02567 0.07539 0.15661 -2.25698 0 0 0 0 0 0.2027 0.3032 -0.74139 0 2.30374 -0.14876 0.62053 -5.75847
-ALA_107 -4.61846 0.50803 1.82849 0.00165 0 0.17031 -2.13647 0 0 0 0 0 -0.00865 0 -0.16301 0 1.32468 -0.07314 0.84474 -2.32183
-GLN_108 -6.87579 0.61261 4.82909 0.00788 0.19053 -0.40034 -2.82146 0 0 0 -0.48435 0 0.22628 2.53696 -0.09747 0 -1.45095 0.03616 0.58871 -3.10216
-PHE_109 -8.22459 0.58031 1.91111 0.02208 0.24382 -0.69262 -1.11543 0 0 0 0 0 0.49435 1.7417 -0.14605 0 1.21829 -0.29741 0.76438 -3.50006
-THR_110 -6.28795 0.78676 6.29428 0.00954 0.07324 -0.10309 -2.30671 0 0 -2.53349 0 0 0.08195 0.37824 -0.75723 0 1.15175 -0.16671 0.78139 -2.59804
-GLU_111 -3.87055 0.23418 4.30452 0.01284 1.14136 -0.14221 -1.76557 0 0 0 -0.72266 0 -0.0926 4.96859 -0.28931 0 -2.72453 -0.2693 0.41732 1.20208
-HIS_112 -6.02452 0.80002 5.11913 0.00349 0.43129 -0.79513 -1.30708 0 0 -0.85863 0 0 0.04649 2.15875 -0.3286 0 -0.30065 -0.10594 0.2842 -0.87719
-THR_113 -6.9391 0.1867 5.30808 0.01199 0.06555 -0.08845 -1.18226 0 0 -0.72209 -0.91934 0 -0.05138 0.01783 0.12217 0 1.15175 0.31534 0.35762 -2.36558
-SER_114 -5.424 0.23556 4.60608 0.00188 0.05254 -0.28446 -2.03489 0 0 0 0 0 0.01899 0.21659 -0.01816 0 -0.28969 0.14108 0.3173 -2.46118
-ALA_115 -5.69305 0.66716 1.72149 0.0012 0 0.11062 -1.4901 0 0 0 0 0 -0.00572 0 -0.49166 0 1.32468 0.02168 0.26161 -3.5721
-ILE_116 -7.34386 0.5293 1.30623 0.02419 0.0712 0.01399 -2.37604 0 0 0 0 0 -0.05761 0.17264 -0.74427 0 2.30374 -0.17692 0.1968 -6.08061
-LYS_117 -8.7219 0.6463 7.34057 0.00918 0.14005 -0.0519 -5.35978 0 0 0 -0.44847 0 0.02119 1.43687 0.27353 0 -0.71458 -0.18219 0.29052 -5.32062
-VAL_118 -6.53791 0.49868 0.82839 0.01753 0.04183 -0.12703 -1.9622 0 0 0 0 0 -0.02071 0.12847 -0.7819 0 2.64269 -0.20566 0.43638 -5.04144
-ARG_119 -5.80391 0.23779 5.13231 0.01233 0.19176 -0.00525 -3.33175 0 0 0 -0.46472 0 0.0955 2.3706 -0.07559 0 -0.09474 -0.24806 0.34421 -1.63952
-GLY_120 -3.62419 0.11574 3.20192 0.00034 0 0.00782 -1.01346 0 0 0 0 0 -0.04879 0 -1.48188 0 0.79816 -0.01524 0.36076 -1.69882
-LYS_121 -5.76287 0.50304 4.65722 0.00801 0.13588 -0.16422 -3.11461 0 0 -0.87774 0 0 -0.0335 1.27806 0.00243 0 -0.71458 -0.07322 0.30579 -3.85031
-ALA_122 -6.17511 0.58081 2.53898 0.00135 0 0.18666 -1.9018 0 0 0 0 0 -0.01135 0 -0.48743 0 1.32468 -0.09476 0.21536 -3.82262
-TYR_123 -7.13914 0.81462 3.24941 0.02238 0.12518 0.12056 -2.54006 0 0 0 0 0 0.08436 2.08791 0.03224 0.00858 0.58223 -0.03094 0.44868 -2.13399
-ILE_124 -8.76948 0.97701 1.59303 0.03023 0.07139 0.01339 -1.91063 0 0 0 0 0 -0.04052 0.34664 -0.73297 0 2.30374 -0.21262 0.47982 -5.85097
-GLN_125 -7.51016 0.60337 4.50027 0.00763 0.2366 0.01061 -3.00352 0 0 -0.47699 0 0 -0.05925 3.22824 0.31017 0 -1.45095 -0.07731 0.35452 -3.32677
-THR_126 -6.38795 0.59761 3.39417 0.00971 0.07778 -0.35992 -1.00597 0 0 -0.97501 0 0 0.02843 0.47842 -0.73929 0 1.15175 0.03879 0.50345 -3.18804
-ARG_127 -5.45526 0.33579 5.42066 0.01807 0.39258 -0.28984 -1.00825 0 0 0 -0.38517 0 -0.07641 4.82128 -0.09864 0 -0.09474 -0.23722 0.72998 4.07283
-HIS_128 -7.38134 0.6138 5.02927 0.00712 0.50825 -0.78823 -0.91606 0 0 -1.46588 0 0 -0.05274 3.10148 -0.32954 0 -0.30065 -0.47665 0.55759 -1.89358
-GLY_129 -2.3997 0.13264 2.87043 2e-05 0 -0.08514 -1.33624 0 0 0 0 0 -0.10076 0 -1.51761 0 0.79816 0.35848 0.21352 -1.06621
-VAL_130 -3.46593 0.40717 0.7389 0.01716 0.03959 -0.05541 -0.74951 0 0 0 0 0 -0.04507 0.05037 -0.77212 0 2.64269 0.49404 0.1136 -0.58454
-ILE_131 -6.82452 0.84694 1.23236 0.03298 0.07668 -0.06971 -1.41416 0 0 0 0 0 -0.03159 0.43432 0.00809 0 2.30374 -0.10134 0.33203 -3.17417
-GLU_132 -4.058 0.26993 2.70457 0.00551 0.25736 -0.04314 -1.3723 0 0 0 0 0 0.00467 2.42066 0.12602 0 -2.72453 0.09976 0.34908 -1.96039
-SER_133 -5.74471 0.52984 4.77526 0.00169 0.08275 0.04696 -1.81722 0 0 0 0 0 0.07215 1.09532 0.11013 0 -0.28969 0.09997 0.20703 -0.83052
-GLU_134 -4.05596 0.25423 4.04223 0.0065 0.29532 0.10516 -2.4153 0 0 0 -0.6467 0 0.09464 2.94312 0.38619 0 -2.72453 0.4991 0.26344 -0.95255
-GLY_135 -3.50859 0.28446 3.19041 7e-05 0 -0.16634 -1.02886 0 0 0 0 0 -0.05398 0 0.6099 0 0.79816 0.47148 0.14086 0.73757
-LYS_136 -1.4669 0.05918 1.58262 0.00731 0.12294 -0.14522 0.14333 0 0 0 0 0 0.07062 0.95653 -0.05287 0 -0.71458 -0.12909 0.18203 0.61591
-LYS:CtermProteinFull_137 -1.57212 0.05278 2.22971 0.0097 0.2055 -0.17373 -0.15294 0 0 0 0 0 0 1.24755 0 0 -0.71458 -0.15931 0.37399 1.34655
-SER:NtermProteinFull_138 -1.77631 0.02716 2.60306 0.00243 0.05508 -0.08713 -0.82277 0 0 -0.60716 0 0 0.01479 0.43783 0 0 -0.28969 0 0.05311 -0.38961
-ASP_139 -3.69969 0.10753 4.02591 0.00479 0.25994 0.02031 -3.98002 0 0 0 -0.38517 0 -0.02426 1.48676 0.02888 0 -2.14574 -0.19241 0.33451 -4.15866
-PHE_140 -9.06183 1.24408 2.27011 0.02659 0.47894 -0.04566 -1.43488 0 0 -0.49087 0 0 -0.00746 1.19016 -0.52411 0 1.21829 -0.24852 0.4936 -4.89156
-VAL_141 -6.97764 0.41763 1.05501 0.02 0.05285 0.13495 -2.09494 0 0 0 0 0 -0.02068 0.02957 -0.38353 0 2.64269 -0.23368 0.29215 -5.06562
-VAL_142 -7.89217 1.18553 1.55877 0.01962 0.0464 0.20894 -2.29855 0 0 0 0 0 -0.04005 0.07301 -0.74836 0 2.64269 -0.36646 0.29818 -5.31245
-ILE_143 -8.04427 0.81676 0.45975 0.0277 0.07925 0.05022 -2.20655 0 0 0 0 0 -0.00818 0.24539 -0.70651 0 2.30374 -0.34479 0.36534 -6.96215
-LYS_144 -8.34407 0.72194 6.19736 0.01811 0.22012 0.34516 -5.03683 0 0 0 -0.6467 0 -0.05735 1.23345 0.35277 0 -0.71458 -0.04668 0.43106 -5.32623
-ALA_145 -6.70385 0.68949 2.12993 0.00193 0 -0.25092 -2.53717 0 0 0 0 0 0.03102 0 0.2183 0 1.32468 -0.02928 0.48193 -4.64393
-LEU_146 -7.09422 0.57392 3.33116 0.02186 0.09023 -0.40773 -0.81419 0 0 0 0 0 0.0342 0.04591 -0.10236 0 1.66147 -0.27682 0.45076 -2.48581
-GLU_147 -6.24478 0.41647 5.64119 0.00642 0.33971 0.03913 -2.56329 0 0 -0.92004 0 0 -0.01088 2.46282 0.11758 0 -2.72453 -0.06803 0.45237 -3.05587
-ASP_148 -3.67728 0.26592 3.87234 0.00523 0.27508 -0.12119 -2.76056 0 0 -0.88714 0 0 -0.01192 1.48704 0.07092 0 -2.14574 -0.16122 0.30207 -3.48647
-GLY_149 -2.43574 0.07791 2.55055 9e-05 0 0.02196 -1.20917 0 0 -0.83081 0 0 -0.11414 0 -1.38452 0 0.79816 -0.63506 0.50113 -2.65963
-VAL_150 -8.06135 0.87822 2.33608 0.01522 0.03988 0.23952 -2.56357 0 0 0 0 0 0.14588 0.17523 -0.22722 0 2.64269 -0.68042 0.65011 -4.40973
-ASN_151 -5.99103 0.38736 5.30979 0.0113 0.51458 0.22359 -2.50137 0 0 0 -0.61676 0 0.01585 1.87587 -0.1534 0 -1.34026 -0.19879 0.4294 -2.03387
-VAL_152 -7.04825 0.52181 1.33493 0.01886 0.04479 0.16644 -2.23085 0 0 0 0 0 0.30301 0.02003 -0.5352 0 2.64269 -0.09216 0.39095 -4.46296
-ILE_153 -7.67988 0.88223 3.43789 0.03167 0.07789 -0.12041 -2.26506 0 0 0 0 0 0.08041 0.41383 -0.76761 0 2.30374 -0.40917 0.4432 -3.57128
-GLY_154 -4.32487 0.27979 2.99864 3e-05 0 -0.02297 -3.03682 0 0 0 0 0 -0.06796 0 1.07709 0 0.79816 0.5161 0.35421 -1.4286
-LEU_155 -8.41984 0.72305 2.89218 0.01836 0.07613 -0.24444 -2.87223 0 0 0 0 0 0.33135 1.87917 -0.29765 0 1.66147 0.71405 0.3338 -3.20461
-THR_156 -5.69589 0.67732 5.00578 0.00552 0.09517 0.03598 -3.14657 0 0 -1.40082 0 0 0.06248 0.54974 0.31909 0 1.15175 -0.10615 0.95075 -1.49585
-ARG_157 -7.3031 0.37624 7.00374 0.01805 0.53791 -0.17002 -3.27235 0 0 -0.84835 -0.51883 0 -0.0201 2.12226 0.01057 0 -0.09474 -0.11478 0.86879 -1.40473
-GLY_158 -2.0408 0.1963 1.84916 0.0001 0 -0.39928 0.4063 0 0 0 0 0 -0.06403 0 -1.5183 0 0.79816 0.35228 0.13627 -0.28383
-ALA_159 -1.88334 0.04781 1.62234 0.00139 0 -0.22168 0.53478 0 0 0 0 0 -0.03509 0 -0.35448 0 1.32468 0.10681 0.05189 1.19511
-ASP_160 -2.96075 0.26319 4.07319 0.00358 0.28739 -0.00133 -2.22246 0 0 -0.44911 -0.90977 0 0.06864 2.07741 0.42915 0 -2.14574 -0.17347 0.30915 -1.35094
-THR_161 -3.70323 0.26358 2.30098 0.01208 0.06538 -0.42825 -0.5297 0 0 0 0 0 -0.01578 0.03093 0.24054 0 1.15175 0.33152 0.3969 0.1167
-ARG_162 -4.41512 0.38186 4.83484 0.01333 0.42962 0.32526 -3.36392 0 0 -0.9517 -0.90977 0 0.08369 3.06129 -0.2426 0 -0.09474 0.09244 0.84211 0.0866
-PHE_163 -3.79312 0.48207 1.39245 0.02842 0.5439 -0.16765 -0.27387 0 0 0 0 0 0.03808 3.62419 0.07874 0 1.21829 -0.30075 1.21612 4.08686
-HIS_164 -6.01763 0.35241 4.39703 0.00795 0.78003 -0.37037 -0.48662 0 0 0 -0.91817 0 0.03315 2.91376 -0.46012 0 -0.30065 0.14576 0.65374 0.73028
-HIS_165 -6.48792 0.3429 5.67264 0.00466 0.30276 -0.1535 -1.74342 0 0 0 -0.85183 0 -0.01545 1.58657 -0.42063 0 -0.30065 0.33106 0.26515 -1.46765
-SER_166 -3.39748 0.23878 3.13478 0.0021 0.07033 -0.13175 -1.17142 0 0 0 -0.61676 0 -0.03376 0.16044 0.07959 0 -0.28969 0.3789 0.25538 -1.32055
-GLU_167 -6.45993 0.24744 6.5911 0.00896 0.58548 0.51768 -4.85037 0 0 0 -1.30031 0 -0.06241 3.65972 0.2753 0 -2.72453 0.4401 0.17542 -2.89636
-LYS_168 -3.45638 0.15964 3.5111 0.00859 0.17217 -0.26122 -1.77695 0 0 0 0 0 -0.04759 0.98079 0.15014 0 -0.71458 0.06637 0.07241 -1.13551
-LEU_169 -9.09064 0.68934 3.18298 0.01385 0.07402 -0.03201 -2.35001 0 0 0 0 0 -0.01816 0.88938 -0.24302 0 1.66147 0.07789 0.184 -4.96093
-ASP_170 -5.71632 0.56217 6.71353 0.00487 0.2301 0.05995 -5.57014 0 0 -1.91305 0 0 0.5951 2.40024 0.06457 0 -2.14574 0.08 0.61905 -4.01565
-LYS_171 -5.48489 0.3386 4.6086 0.00995 0.15581 -0.40106 -2.09569 0 0 -0.88714 0 0 -0.06533 0.92691 -0.02281 0 -0.71458 -0.10498 0.5767 -3.15992
-GLY_172 -4.71193 0.30081 3.68317 7e-05 0 -0.03909 -2.45243 0 0 0 0 0 -0.12459 0 -1.48054 0 0.79816 -0.50003 0.38241 -4.14399
-GLU_173 -7.50787 0.2823 7.7471 0.00339 0.17393 -0.00564 -5.70974 0 0 -1.08224 -0.46472 0 -0.00301 3.49064 -0.04165 0 -2.72453 -0.57808 0.43945 -5.98066
-VAL_174 -7.20694 0.62526 1.21417 0.01666 0.04251 0.01905 -1.86116 0 0 0 0 0 -0.03909 0.07673 -0.79086 0 2.64269 -0.38259 0.32748 -5.31609
-LEU_175 -7.93383 0.54579 1.23083 0.01685 0.09829 0.02635 -2.25153 0 0 0 0 0 -0.00786 0.43145 -0.1954 0 1.66147 -0.14292 0.25143 -6.26908
-ILE_176 -8.25942 1.38325 0.6392 0.02626 0.08 0.19092 -2.22025 0 0 0 0 0 0.185 0.35833 -0.71343 0 2.30374 -0.13733 0.68949 -5.47424
-ALA_177 -4.62664 0.51566 1.81892 0.0016 0 0.12439 -2.09869 0 0 0 0 0 -0.014 0 -0.09757 0 1.32468 -0.0164 0.92583 -2.14223
-GLN_178 -7.20706 0.53171 5.01312 0.00609 0.16421 -0.1246 -3.02875 0 0 -0.60716 -0.59286 0 0.34961 2.51893 -0.08026 0 -1.45095 0.06521 0.69276 -3.74999
-PHE_179 -8.32189 0.69395 1.98541 0.02221 0.25319 -0.77069 -1.07159 0 0 0 0 0 0.59912 1.68877 -0.19446 0 1.21829 -0.28749 0.93623 -3.24895
-THR_180 -5.63576 0.5336 5.68321 0.00756 0.0722 0.06467 -1.91096 0 0 -2.16478 0 0 0.1939 0.33882 -0.75801 0 1.15175 -0.14353 0.90932 -1.65802
-GLU_181 -2.9983 0.2046 2.65968 0.0083 0.41292 -0.46056 0.24786 0 0 0 0 0 -0.09904 3.24873 -0.30247 0 -2.72453 -0.2115 0.46689 0.45258
-HIS_182 -6.25632 0.53552 5.15127 0.00364 0.43051 -0.95694 -1.45726 0 0 -0.9248 0 0 -0.02742 2.17262 -0.34614 0 -0.30065 -0.21761 0.24275 -1.95084
-THR_183 -7.1559 0.1829 5.50753 0.01214 0.0669 0.0581 -1.16458 0 0 -0.39163 -0.91817 0 -0.05059 0.02259 0.05438 0 1.15175 0.16561 0.3397 -2.11927
-SER_184 -5.37886 0.26448 4.5105 0.00279 0.05551 -0.23273 -1.87107 0 0 0 0 0 0.04179 0.21525 -0.03166 0 -0.28969 0.14822 0.45187 -2.1136
-ALA_185 -5.71821 0.61593 1.64762 0.0012 0 0.14244 -1.75359 0 0 0 0 0 -0.00839 0 -0.47239 0 1.32468 0.02434 0.38152 -3.81487
-ILE_186 -7.31098 0.42278 1.35123 0.02303 0.07001 0.00777 -2.35802 0 0 0 0 0 -0.06054 0.17334 -0.73385 0 2.30374 -0.15994 0.22639 -6.04504
-LYS_187 -8.1583 0.72929 6.43943 0.0087 0.14491 -0.10198 -5.3926 0 0 0 -0.57253 0 -0.00167 1.27008 0.29438 0 -0.71458 -0.16055 0.39842 -5.81697
-VAL_188 -6.63476 0.47158 0.68892 0.01856 0.04278 -0.04421 -1.9081 0 0 0 0 0 -0.05414 0.1539 -0.75967 0 2.64269 -0.18328 0.4829 -5.08282
-ARG_189 -4.66123 0.17795 4.44357 0.01671 0.43579 0.3626 -3.52569 0 0 0 -1.13819 0 0.00754 1.98055 0.11742 0 -0.09474 -0.17718 0.39186 -1.66303
-GLY_190 -3.8706 0.15387 2.81767 0.00024 0 -0.03509 -1.66014 0 0 -0.39792 0 0 0.10056 0 -1.49495 0 0.79816 0.12909 0.41426 -3.04484
-LYS_191 -7.20172 0.68982 6.19416 0.00911 0.19797 -0.25576 -3.79719 0 0 -0.92004 0 0 -0.0265 2.84289 0.03266 0 -0.71458 -0.05653 0.30051 -2.70519
-ALA_192 -6.46114 0.63208 2.74258 0.00139 0 0.27026 -1.17311 0 0 0 0 0 0.0227 0 -0.50269 0 1.32468 -0.156 0.2913 -3.00794
-TYR_193 -7.14569 0.5851 3.47037 0.02098 0.11491 0.0667 -2.31541 0 0 0 0 0 0.01391 1.92075 0.036 0.02876 0.58223 -0.04553 0.43004 -2.23689
-ILE_194 -8.74246 0.86711 1.5451 0.03033 0.07467 0.04776 -2.05875 0 0 0 0 0 0.0107 0.37578 -0.75492 0 2.30374 -0.244 0.41205 -6.13289
-GLN_195 -8.34666 0.6172 4.6589 0.00682 0.21175 -0.18211 -2.30325 0 0 0 0 0 -0.01728 3.14523 0.27629 0 -1.45095 -0.17445 0.37993 -3.17858
-THR_196 -6.53736 0.50122 3.61081 0.00857 0.08244 -0.30874 -1.59552 0 0 -0.99265 0 0 0.00983 0.42862 -0.65825 0 1.15175 -0.1066 0.4154 -3.99049
-ARG_197 -4.54872 0.24284 3.985 0.01886 0.57178 -0.29661 0.66612 0 0 0 0 0 0.09204 3.50894 -0.10879 0 -0.09474 -0.33154 0.40065 4.10583
-HIS_198 -6.98707 0.42793 4.82463 0.0064 0.48737 -0.63382 -1.33796 0 0 -1.48364 0 0 -0.02746 3.18616 -0.32384 0 -0.30065 -0.50441 0.32307 -2.34328
-GLY_199 -2.46879 0.1667 2.8769 0.00012 0 -0.03414 -1.74711 0 0 0 0 0 -0.05909 0 -1.51722 0 0.79816 0.2516 0.20296 -1.5299
-VAL_200 -3.81834 0.36041 1.31748 0.01881 0.05027 0.07512 -1.06034 0 0 -0.42482 0 0 -0.01474 0.04312 -0.37704 0 2.64269 0.4001 0.16695 -0.62033
-ILE_201 -6.70527 0.56873 1.43865 0.02527 0.07291 0.03706 -1.36974 0 0 0 0 0 0.01253 0.18966 0.25307 0 2.30374 0.07834 0.32781 -2.76722
-GLU_202 -4.08681 0.30392 3.57505 0.00444 0.22588 -0.09265 -3.24591 0 0 -0.37925 0 0 0.03894 3.30255 0.23142 0 -2.72453 0.28666 0.36288 -2.1974
-SER_203 -6.14509 0.50123 5.4166 0.0015 0.06841 0.06012 -3.24024 0 0 -0.39792 0 0 0.03054 0.15499 -0.28 0 -0.28969 -0.01951 0.4756 -3.66345
-GLU_204 -4.71053 0.32491 4.57895 0.00582 0.24698 -0.09429 -2.79786 0 0 0 -0.8763 0 0.00216 3.22749 0.07616 0 -2.72453 -0.05695 0.48825 -2.30974
-GLY_205 -1.95061 0.27019 1.97075 0.0001 0 -0.04922 -0.35375 0 0 0 0 0 -0.08491 0 -0.93471 0 0.79816 0.15037 0.23235 0.04871
-LYS:CtermProteinFull_206 -0.41241 0.14301 0.66579 0.02305 0.4344 -0.05115 -0.20255 0 0 0 0 0 0 1.91172 0 0 -0.71458 0.12126 0.31039 2.22894
-SER:NtermProteinFull_207 -1.19266 0.01254 1.82494 0.0023 0.0697 -0.35066 -0.20916 0 0 0 0 0 0.00028 0.11964 0 0 -0.28969 0 0.02292 0.01015
-ASP_208 -4.14378 0.19419 4.43505 0.00317 0.22183 0.09997 -4.80732 0 0 0 -1.51991 0 0.03446 2.55578 0.14386 0 -2.14574 -0.05963 0.23532 -4.75273
-PHE_209 -8.5482 1.05738 2.30201 0.02593 0.49474 -0.14828 -1.42484 0 0 -0.49098 0 0 -0.00875 1.1278 -0.48553 0 1.21829 -0.17041 0.44322 -4.60763
-VAL_210 -6.94274 0.56132 0.82799 0.02055 0.05258 0.09706 -2.06344 0 0 0 0 0 -0.01662 0.0183 -0.35394 0 2.64269 -0.31021 0.33229 -5.13417
-VAL_211 -7.8665 1.13575 1.39574 0.0181 0.04589 0.22892 -2.27321 0 0 0 0 0 0.00688 0.1396 -0.76449 0 2.64269 -0.39287 0.40408 -5.27943
-ILE_212 -8.38606 0.64977 0.36978 0.02543 0.12329 -0.03608 -2.10123 0 0 0 0 0 0.13221 2.27038 -0.70962 0 2.30374 -0.34636 0.49438 -5.21036
-LYS_213 -8.53742 0.94081 6.21421 0.01652 0.19532 0.52435 -5.60884 0 0 -0.37925 -0.8763 0 -0.04393 1.23091 0.32257 0 -0.71458 -0.10522 0.5015 -6.31935
-ALA_214 -6.65427 0.69339 2.02434 0.002 0 -0.22078 -2.42418 0 0 0 0 0 0.04326 0 0.37982 0 1.32468 0.10155 0.4284 -4.30178
-LEU_215 -7.12753 0.79229 2.41748 0.02124 0.08744 -0.46751 -0.9317 0 0 0 0 0 0.06141 3.18879 -0.16478 0 1.66147 -0.11489 0.31724 -0.25905
-GLU_216 -6.26668 0.4607 5.60518 0.00625 0.32356 0.02385 -2.26573 0 0 -0.90653 0 0 -0.01233 2.56343 0.10669 0 -2.72453 -0.10598 0.43027 -2.76186
-ASP_217 -3.72504 0.26787 3.87826 0.00525 0.27966 -0.09901 -2.65343 0 0 -0.8993 0 0 -0.00464 1.51674 0.07258 0 -2.14574 -0.15592 0.34995 -3.31277
-GLY_218 -2.71624 0.08423 2.75779 0.00013 0 -0.11701 -1.00634 0 0 -0.83468 0 0 -0.09978 0 -1.23773 0 0.79816 -0.45182 0.48475 -2.33853
-VAL_219 -8.29004 0.71734 2.57988 0.01649 0.04393 0.07627 -2.36033 0 0 0 0 0 -0.00751 0.13366 -0.41068 0 2.64269 -0.475 0.51803 -4.81526
-ASN_220 -5.4892 0.25491 4.56887 0.0055 0.25501 -0.23641 -1.99407 0 0 0 0 0 0.12031 1.86206 0.26083 0 -1.34026 -0.15698 0.23351 -1.65592
-VAL_221 -6.87154 0.56126 0.99112 0.01767 0.04638 0.15941 -2.23514 0 0 0 0 0 0.3157 0.01938 -0.53191 0 2.64269 -0.03156 0.33666 -4.57987
-ILE_222 -7.9518 0.88885 2.71151 0.03536 0.07938 0.08127 -2.42635 0 0 0 0 0 0.07837 0.3328 -0.76076 0 2.30374 -0.36048 0.4704 -4.51771
-GLY_223 -4.32948 0.22132 2.94289 3e-05 0 -0.10682 -2.92685 0 0 0 0 0 -0.05426 0 1.06609 0 0.79816 0.46349 0.38038 -1.54505
-LEU_224 -8.79115 0.69085 2.70541 0.01897 0.07748 -0.23824 -3.02052 0 0 0 0 0 0.23917 1.9145 -0.3293 0 1.66147 0.67711 0.37537 -4.01889
-THR_225 -5.69959 0.65231 4.91974 0.00589 0.09259 -0.1002 -2.05708 0 0 -0.43578 0 0 -0.01925 0.79092 0.26915 0 1.15175 -0.11624 0.55654 0.01074
-ARG_226 -6.87495 0.29692 6.74641 0.01582 0.53551 -0.21023 -3.10829 0 0 -0.95988 -0.60202 0 -0.0281 2.09631 -0.00925 0 -0.09474 -0.16838 0.52497 -1.8399
-GLY_227 -2.10516 0.21926 1.99828 0.00011 0 -0.40327 0.40278 0 0 0 0 0 -0.06695 0 -1.51705 0 0.79816 0.26091 0.19117 -0.22175
-ALA_228 -1.95988 0.09783 1.60645 0.00138 0 -0.1753 0.60538 0 0 0 0 0 0.03809 0 -0.3722 0 1.32468 0.05391 0.07567 1.296
-ASP_229 -2.48098 0.19088 4.01986 0.00399 0.71202 0.04982 -1.87272 0 0 0 -1.59689 0 -0.04992 3.61992 -0.67488 0 -2.14574 -0.45077 0.26146 -0.41396
-THR_230 -3.83305 0.19102 2.94943 0.0106 0.05743 -0.62307 -0.43736 0 0 0 0 0 -0.04424 0.03796 -0.07281 0 1.15175 -0.1118 0.34385 -0.3803
-ARG_231 -4.66436 0.21891 5.02176 0.01617 0.46317 0.50248 -4.99202 0 0 -0.43578 -1.59689 0 -0.00748 1.96518 -0.05412 0 -0.09474 0.10171 0.31577 -3.24024
-PHE_232 -5.08098 0.48277 0.59163 0.04468 0.2265 -0.09217 -0.27788 0 0 0 0 0 0.04053 3.38178 -0.11398 0 1.21829 -0.15328 0.35076 0.61866
-HIS_233 -5.46957 0.43995 4.17236 0.00706 0.68252 -0.2511 -0.52236 0 0 0 -0.92653 0 0.01469 3.24388 -0.38925 0 -0.30065 0.10735 0.36413 1.17249
-HIS_234 -6.07549 0.39245 5.58309 0.00449 0.31896 -0.05544 -1.8855 0 0 0 -0.78098 0 -0.02084 1.49733 -0.45899 0 -0.30065 0.34812 0.29893 -1.13454
-SER_235 -3.27769 0.21506 2.82101 0.00227 0.07073 -0.51781 -0.39287 0 0 0 0 0 -0.04546 0.18975 0.17214 0 -0.28969 0.36295 0.19974 -0.48986
-GLU_236 -6.22905 0.19661 6.1775 0.00759 0.5821 0.452 -4.54765 0 0 0 -1.35351 0 -0.07096 3.47521 0.22771 0 -2.72453 0.36717 0.16581 -3.27401
-LYS_237 -3.79543 0.13793 3.49517 0.00748 0.15786 -0.28473 -1.29603 0 0 0 0 0 -0.04057 0.97647 0.13608 0 -0.71458 0.03268 0.14175 -1.04593
-LEU_238 -9.14703 0.76007 3.18657 0.01503 0.07428 -0.02749 -2.58546 0 0 0 0 0 0.00812 0.80132 -0.23653 0 1.66147 0.00387 0.30472 -5.18105
-ASP_239 -5.49307 0.52859 6.29212 0.00471 0.22953 -0.00856 -5.2177 0 0 -1.83991 0 0 0.42177 2.20671 0.1152 0 -2.14574 0.06046 0.71106 -4.13484
-LYS_240 -5.20626 0.3471 4.39775 0.00877 0.15137 -0.46834 -1.63756 0 0 -0.8993 0 0 -0.08957 0.91547 -0.0228 0 -0.71458 -0.09058 0.51616 -2.79238
-GLY_241 -3.73897 0.17329 3.11142 7e-05 0 0.08315 -2.20477 0 0 0 0 0 -0.14735 0 -1.49482 0 0.79816 -0.46649 0.25765 -3.62866
-GLU_242 -7.00821 0.21471 7.53634 0.00391 0.19122 0.21005 -6.13127 0 0 -1.00523 -1.13819 0 -0.01233 3.35446 -0.02702 0 -2.72453 -0.46067 0.34917 -6.6476
-VAL_243 -7.28066 0.51928 1.16938 0.01666 0.04363 0.01944 -1.98245 0 0 0 0 0 -0.03992 0.0519 -0.77872 0 2.64269 -0.33321 0.21358 -5.73841
-LEU_244 -8.37108 0.68879 1.17333 0.01655 0.09665 0.01501 -2.18636 0 0 0 0 0 -0.01466 0.45581 -0.20858 0 1.66147 -0.15878 0.16468 -6.6672
-ILE_245 -8.2209 1.29913 0.74805 0.0277 0.07971 0.15878 -2.22135 0 0 0 0 0 0.17612 0.3732 -0.71362 0 2.30374 -0.14455 0.63397 -5.5
-ALA_246 -4.57612 0.42096 1.80772 0.00153 0 0.15901 -2.15158 0 0 0 0 0 0.00339 0 -0.05706 0 1.32468 -0.01797 0.79302 -2.29243
-GLN_247 -6.78216 0.57397 4.7918 0.00642 0.17072 -0.49487 -2.79097 0 0 0 -0.51883 0 0.22483 2.52612 -0.09486 0 -1.45095 0.06688 0.51143 -3.26047
-PHE_248 -8.31171 0.61489 1.89274 0.02244 0.2444 -0.68488 -1.06949 0 0 0 0 0 0.56028 1.7181 -0.18161 0 1.21829 -0.2851 0.68199 -3.57967
-THR_249 -5.5865 0.55462 5.60088 0.00714 0.06933 0.01932 -1.84064 0 0 -2.75145 0 0 0.21063 0.34799 -0.7461 0 1.15175 -0.14535 0.81438 -2.29401
-GLU_250 -2.9097 0.17496 2.58794 0.00804 0.408 -0.40144 0.1639 0 0 0 0 0 -0.10408 3.26185 -0.2971 0 -2.72453 -0.19088 0.50021 0.47715
-HIS_251 -6.0676 0.55888 5.11938 0.00335 0.41929 -0.88318 -1.50417 0 0 -0.92174 0 0 0.03795 2.2189 -0.30891 0 -0.30065 -0.0929 0.26657 -1.45482
-THR_252 -7.04673 0.16015 5.26395 0.01255 0.0668 -0.12334 -1.00016 0 0 -0.86984 -0.92653 0 -0.04319 0.01722 0.12287 0 1.15175 0.26867 0.36113 -2.5847
-SER_253 -5.42255 0.23067 4.59201 0.00197 0.05347 -0.27315 -2.00298 0 0 0 0 0 0.02476 0.21923 -0.03152 0 -0.28969 0.14101 0.3355 -2.42127
-ALA_254 -5.81526 0.71549 1.67943 0.00126 0 0.09174 -1.53118 0 0 0 0 0 -0.00719 0 -0.49901 0 1.32468 0.0069 0.25005 -3.78309
-ILE_255 -7.33702 0.59591 1.42142 0.02204 0.0688 0.01471 -2.44939 0 0 0 0 0 -0.06198 0.19478 -0.74727 0 2.30374 -0.18369 0.20418 -5.95378
-LYS_256 -8.8417 0.69469 7.75693 0.00774 0.13543 0.40216 -6.2924 0 0 0 -0.30588 0 0.03664 2.33764 0.30925 0 -0.71458 -0.14078 0.36987 -4.24499
-VAL_257 -6.56203 0.4508 0.90874 0.01717 0.04248 0.04547 -1.97943 0 0 0 0 0 -0.0062 0.10292 -0.7776 0 2.64269 -0.15838 0.4134 -4.85997
-ARG_258 -4.12925 0.17995 4.12151 0.01544 0.37391 0.51442 -3.67698 0 0 0 -1.09149 0 -0.02364 1.95394 0.09682 0 -0.09474 -0.16883 0.27816 -1.65079
-GLY_259 -3.91976 0.15956 2.78782 0.00015 0 -0.05509 -1.72068 0 0 -0.38815 0 0 0.01857 0 -1.50037 0 0.79816 0.21823 0.2309 -3.37066
-LYS_260 -7.37828 0.7855 6.29285 0.00909 0.19787 -0.30399 -4.13305 0 0 -0.90653 0 0 -0.05085 2.21273 0.04244 0 -0.71458 -0.00119 0.24434 -3.70366
-ALA_261 -6.40637 0.79126 2.57233 0.00141 0 0.34484 -1.1394 0 0 0 0 0 0.00646 0 -0.55888 0 1.32468 -0.20949 0.29095 -2.98222
-TYR_262 -6.80547 0.43545 3.29119 0.02055 0.09106 -0.02494 -2.08986 0 0 0 0 0 0.00717 2.25006 -0.00189 0.00086 0.58223 -0.01676 0.35127 -1.90908
-ILE_263 -8.59656 0.99372 1.6878 0.02856 0.06941 0.06743 -2.15393 0 0 0 0 0 -0.04482 0.3367 -0.74752 0 2.30374 -0.18094 0.36163 -5.87477
-GLN_264 -7.89452 0.66597 4.3344 0.00589 0.21001 -0.0547 -2.6368 0 0 -0.42482 0 0 -0.04775 3.13434 0.30832 0 -1.45095 -0.10249 0.42192 -3.53118
-THR_265 -6.73048 0.48662 3.63749 0.01092 0.0884 -0.26996 -2.0092 0 0 -0.94149 0 0 0.00526 0.68226 -0.64579 0 1.15175 -0.0815 0.49989 -4.11583
-ARG_266 -5.88574 0.3356 6.22289 0.01813 0.67975 -0.17453 -1.98693 0 0 0 -1.51991 0 -0.06062 3.73869 -0.11546 0 -0.09474 -0.39177 0.62558 1.39094
-HIS_267 -7.6203 0.56919 5.82779 0.00637 0.45986 -0.8663 -1.72672 0 0 -0.94149 -0.91063 0 -0.02512 2.07454 -0.44377 0 -0.30065 -0.42979 0.59338 -3.73366
-GLY_268 -2.8665 0.11003 3.15996 9e-05 0 -0.01639 -1.94315 0 0 0 0 0 -0.06388 0 -1.51595 0 0.79816 0.14034 0.22025 -1.97704
-VAL_269 -3.97285 0.35242 1.67028 0.02118 0.05455 0.07905 -1.30773 0 0 -0.45743 0 0 0.037 0.15316 -0.2446 0 2.64269 0.34989 0.123 -0.49938
-ILE_270 -7.22832 0.76771 1.40288 0.03072 0.07942 -0.05698 -1.38071 0 0 0 0 0 -0.00059 0.17999 0.11588 0 2.30374 0.1408 0.35642 -3.28904
-GLU_271 -3.66682 0.30581 2.92462 0.00448 0.24993 0.19226 -2.43207 0 0 -0.39814 0 0 0.06322 3.20907 0.17209 0 -2.72453 0.16065 0.34969 -1.58973
-SER_272 -5.71205 0.43587 5.14502 0.00143 0.06672 0.12571 -2.97689 0 0 -0.38815 0 0 0.10272 0.18408 -0.23143 0 -0.28969 0.00684 0.49956 -3.03026
-GLU_273 -4.83131 0.39322 5.38284 0.00394 0.57527 -0.3481 -3.01314 0 0 -1.08516 0 0 0.01721 4.5798 0.02941 0 -2.72453 0.00283 0.76352 -0.25419
-GLY_274 -2.21093 0.25495 2.54847 0.0001 0 0.01116 -0.91296 0 0 -1.08516 0 0 -0.08231 0 -0.91557 0 0.79816 0.02756 0.36351 -1.20303
-LYS:CtermProteinFull_275 -0.30165 0.03013 0.41957 0.00873 0.34842 -0.10146 -0.33316 0 0 0 0 0 0 1.19898 0 0 -0.71458 0.00223 0.0794 0.63663
-SER:NtermProteinFull_276 -2.56997 0.03332 3.50151 0.00237 0.05503 -0.09365 -1.12468 0 0 -1.10066 0 0 0.04079 0.48781 0 0 -0.28969 0 0.07496 -0.98286
-ASP_277 -4.81555 0.49573 6.30727 0.00325 0.27275 0.4084 -5.90898 0 0 -0.85427 -1.45056 0 0.1664 3.17264 -0.03226 0 -2.14574 -0.06382 0.18321 -4.26153
-PHE_278 -9.31876 1.06874 3.21899 0.02499 0.4635 -0.48836 -1.52724 0 0 -0.85427 0 0 -0.00752 1.07127 -0.59111 0 1.21829 -0.17096 0.31666 -5.57576
-VAL_279 -6.72053 0.45526 0.77884 0.02482 0.05563 0.0137 -2.01558 0 0 0 0 0 -0.00893 0.12024 -0.38837 0 2.64269 -0.23966 0.33181 -4.95009
-VAL_280 -7.66894 1.10504 1.38487 0.01958 0.04906 0.23842 -2.22901 0 0 0 0 0 -0.03727 0.02791 -0.67891 0 2.64269 -0.30719 0.38919 -5.06454
-ILE_281 -8.18361 0.81298 0.45182 0.02727 0.07909 -0.00932 -2.23361 0 0 0 0 0 -0.04817 0.23999 -0.69391 0 2.30374 -0.32386 0.42701 -7.15059
-LYS_282 -8.179 0.91575 5.14695 0.01703 0.21107 0.31163 -4.10327 0 0 -0.39814 0 0 -0.05139 1.31738 0.32726 0 -0.71458 -0.08574 0.4433 -4.84177
-ALA_283 -6.6257 0.8139 1.89669 0.00199 0 -0.26543 -2.2227 0 0 0 0 0 0.09858 0 0.29934 0 1.32468 0.02164 0.44724 -4.20976
-LEU_284 -7.12587 0.66901 2.44351 0.02349 0.08888 -0.54945 -1.05266 0 0 0 0 0 0.00694 3.40129 -0.14807 0 1.66147 -0.18928 0.36822 -0.40253
-GLU_285 -5.99796 0.4229 5.23463 0.00772 0.37314 -0.02525 -1.81486 0 0 -0.89609 0 0 -0.01105 2.51143 0.10015 0 -2.72453 -0.08714 0.34808 -2.55884
-ASP_286 -3.65651 0.25067 3.85042 0.00494 0.27848 -0.12306 -2.70806 0 0 -0.88222 0 0 -0.00449 1.52373 0.07705 0 -2.14574 -0.14571 0.26255 -3.41796
-GLY_287 -2.49663 0.03832 2.6995 0.00011 0 -0.19583 -1.2104 0 0 -0.77937 0 0 -0.06808 0 -1.34852 0 0.79816 -0.49526 0.50827 -2.54971
-VAL_288 -8.01072 0.76868 2.68801 0.01539 0.04026 -0.02131 -2.63104 0 0 0 0 0 -0.01086 0.1124 -0.31391 0 2.64269 -0.50519 0.61932 -4.60629
-ASN_289 -5.63973 0.19599 4.84902 0.00396 0.25638 -0.43628 -2.30914 0 0 0 0 0 -0.03004 2.00256 0.2514 0 -1.34026 -0.06149 0.3542 -1.90343
-VAL_290 -6.45976 0.50522 0.88004 0.0183 0.04586 0.09664 -2.14047 0 0 0 0 0 0.231 0.02765 -0.51565 0 2.64269 0.01601 0.31556 -4.33691
-ILE_291 -7.71649 0.6371 2.51609 0.03166 0.0779 0.00268 -2.3793 0 0 0 0 0 0.06559 0.40601 -0.74845 0 2.30374 -0.38661 0.35351 -4.83657
-GLY_292 -4.06431 0.24423 2.67821 3e-05 0 -0.04101 -2.32139 0 0 0 0 0 -0.05754 0 1.04048 0 0.79816 0.43485 0.26557 -1.02272
-LEU_293 -8.85805 0.82995 2.63531 0.01733 0.07478 -0.21673 -3.29576 0 0 0 0 0 0.3923 1.8549 -0.31633 0 1.66147 0.65135 0.36417 -4.20533
-THR_294 -5.96356 0.67197 5.19766 0.00556 0.09176 0.10049 -3.52186 0 0 -1.29625 0 0 0.03705 0.65379 0.2718 0 1.15175 -0.10709 1.04223 -1.6647
-ARG_295 -7.01785 0.3196 6.88684 0.01689 0.54548 -0.261 -3.33734 0 0 -0.97078 -0.59466 0 -0.0236 2.07522 -0.03124 0 -0.09474 -0.18044 0.96171 -1.70592
-GLY_296 -2.09527 0.22687 1.9087 0.00011 0 -0.39382 0.40416 0 0 0 0 0 -0.03159 0 -1.51787 0 0.79816 0.28194 0.18808 -0.23054
-ALA_297 -2.03097 0.05719 1.73837 0.00145 0 -0.2677 0.51381 0 0 0 0 0 -0.03777 0 -0.3607 0 1.32468 0.09714 0.04073 1.07622
-ASP_298 -2.81892 0.16764 3.39841 0.00348 0.28821 -0.53193 -0.95357 0 0 -0.44481 0 0 0.0109 2.77872 -0.1055 0 -2.14574 -0.27011 0.07668 -0.54655
-THR_299 -3.99285 0.28523 2.52607 0.01152 0.0638 -0.42918 -0.73763 0 0 0 0 0 -0.04055 0.03014 0.28526 0 1.15175 0.1879 0.15234 -0.50621
-ARG_300 -4.68412 0.33133 4.35003 0.01095 0.20278 -0.1811 -2.10892 0 0 -0.85144 0 0 0.04917 1.77986 -0.18433 0 -0.09474 0.08826 0.3494 -0.94287
-PHE_301 -4.60574 0.48858 0.56466 0.0541 0.2434 -0.27037 -0.03564 0 0 0 0 0 -0.01106 3.42954 -0.09885 0 1.21829 -0.27792 0.54617 1.24516
-HIS_302 -5.06933 0.35926 3.8033 0.00625 0.76857 -0.31757 -0.29911 0 0 0 -0.85483 0 -0.02118 3.14663 -0.46404 0 -0.30065 0.07529 0.48154 1.31414
-HIS_303 -5.7112 0.24949 5.11233 0.0041 0.28099 -0.17402 -1.60324 0 0 0 -0.82073 0 -0.01394 1.44638 -0.50696 0 -0.30065 0.37655 0.26594 -1.39495
-SER_304 -2.96882 0.186 2.61644 0.00227 0.06836 -0.38543 -0.52015 0 0 0 0 0 -0.04228 0.13348 0.05735 0 -0.28969 0.454 0.13643 -0.55203
-GLU_305 -6.26757 0.15821 6.68075 0.007 0.55971 0.50432 -4.78886 0 0 0 -1.12661 0 -0.0691 3.58386 0.25248 0 -2.72453 0.40035 0.14512 -2.68486
-LYS_306 -4.2412 0.26498 4.39874 0.01286 0.23749 -0.12302 -2.59703 0 0 0 0 0 0.01658 2.19962 0.06444 0 -0.71458 -0.02289 0.16531 -0.33871
-LEU_307 -9.32148 0.86242 3.59803 0.01755 0.0683 0.12754 -2.4725 0 0 0 0 0 0.05371 0.67494 -0.1799 0 1.66147 -0.03709 0.26092 -4.68608
-ASP_308 -5.51156 0.53176 6.3928 0.00501 0.23378 -0.07183 -5.26237 0 0 -1.63867 0 0 0.42462 2.18974 0.12542 0 -2.14574 0.08678 0.699 -3.94127
-LYS_309 -5.25318 0.33916 4.48999 0.00872 0.14615 -0.53011 -1.45584 0 0 -0.88222 0 0 -0.09178 0.98673 -0.01555 0 -0.71458 -0.11476 0.56145 -2.5258
-GLY_310 -3.59345 0.12775 2.99204 7e-05 0 0.06546 -1.92444 0 0 0 0 0 -0.13449 0 -1.49458 0 0.79816 -0.50362 0.25991 -3.40717
-GLU_311 -7.33129 0.27075 7.68416 0.00399 0.20618 0.17746 -6.09565 0 0 -0.85931 -1.09149 0 0.00674 3.08888 -0.02713 0 -2.72453 -0.46734 0.32665 -6.83193
-VAL_312 -7.28744 0.46812 1.1096 0.01642 0.04341 -0.00855 -2.00818 0 0 0 0 0 -0.02864 0.04995 -0.78899 0 2.64269 -0.32946 0.19771 -5.92335
-LEU_313 -8.02903 0.66569 1.42252 0.01784 0.10035 0.0379 -2.24747 0 0 0 0 0 0.01111 0.43011 -0.20849 0 1.66147 -0.15268 0.16337 -6.1273
-ILE_314 -8.19731 1.26584 0.73754 0.02814 0.07829 0.15836 -2.24924 0 0 0 0 0 0.22729 0.31741 -0.71208 0 2.30374 -0.13626 0.61969 -5.55858
-ALA_315 -4.63797 0.47673 1.81269 0.00155 0 0.1715 -2.10744 0 0 0 0 0 -0.00785 0 -0.07447 0 1.32468 -0.0206 0.81228 -2.24891
-GLN_316 -7.43125 0.46451 5.37748 0.00623 0.17689 -0.28001 -3.27726 0 0 -0.54566 -0.60202 0 0.24135 2.50525 -0.0883 0 -1.45095 0.06318 0.63483 -4.20573
-PHE_317 -8.71654 0.63667 2.6387 0.02276 0.24499 -0.62969 -2.18216 0 0 -0.55499 0 0 0.53203 1.65054 -0.16704 0 1.21829 -0.29229 0.79495 -4.80377
-THR_318 -5.52899 0.58477 5.67168 0.00716 0.06762 0.03507 -2.04411 0 0 -2.79156 0 0 0.17314 0.33998 -0.76079 0 1.15175 -0.16407 0.8423 -2.41605
-GLU_319 -2.98864 0.17165 2.63454 0.00777 0.40278 -0.43033 0.18893 0 0 0 0 0 -0.10379 3.31625 -0.29993 0 -2.72453 -0.2231 0.51063 0.46224
-HIS_320 -6.24146 0.69636 5.19152 0.00374 0.44828 -0.84552 -1.82012 0 0 -0.92078 0 0 0.07057 2.19897 -0.3017 0 -0.30065 -0.0883 0.29807 -1.61103
-THR_321 -7.01776 0.29759 5.238 0.0139 0.06658 -0.06118 -1.18739 0 0 -0.9 -0.85483 0 -0.03671 0.02046 0.07796 0 1.15175 0.27062 0.40955 -2.51146
-SER_322 -5.49012 0.25986 4.61184 0.00207 0.05466 -0.28292 -1.96471 0 0 0 0 0 0.03935 0.21943 -0.01207 0 -0.28969 0.13401 0.36845 -2.34984
-ALA_323 -5.73696 0.69954 1.74001 0.00125 0 0.10954 -1.57537 0 0 0 0 0 -0.00575 0 -0.46615 0 1.32468 0.04099 0.2626 -3.60562
-ILE_324 -7.41381 0.51966 1.32116 0.02481 0.07218 0.01647 -2.35787 0 0 0 0 0 -0.01927 0.16144 -0.72297 0 2.30374 -0.15257 0.24155 -6.00548
-LYS_325 -8.6597 0.60523 7.09726 0.00851 0.15289 -0.09717 -5.13791 0 0 0 -0.69985 0 -0.009 2.53752 0.2894 0 -0.71458 -0.16084 0.48037 -4.30786
-VAL_326 -6.62924 0.44335 0.77363 0.01797 0.0426 -0.07344 -1.79493 0 0 0 0 0 -0.04558 0.1283 -0.72265 0 2.64269 -0.18126 0.5098 -4.88876
-ARG_327 -4.43719 0.08837 4.35459 0.01519 0.42065 0.2876 -3.3281 0 0 0 -1.13036 0 -0.01948 1.85678 0.16735 0 -0.09474 -0.14742 0.31802 -1.64873
-GLY_328 -3.22201 0.04433 2.63412 0.00027 0 -0.08657 -1.65019 0 0 -0.47259 0 0 -0.0363 0 -1.50342 0 0.79816 0.16878 0.26475 -3.06066
-LYS_329 -6.02639 0.56367 4.35386 0.00805 0.15687 -0.14691 -2.73294 0 0 -0.89609 0 0 -0.04391 1.07333 0.09121 0 -0.71458 0.10018 0.23461 -3.97905
-ALA_330 -6.30408 0.6235 2.575 0.0014 0 0.36584 -1.4696 0 0 0 0 0 0.00404 0 -0.51217 0 1.32468 -0.03224 0.27486 -3.14877
-TYR_331 -7.81063 0.73535 3.84166 0.02264 0.13284 0.25071 -2.3613 0 0 0 -0.97884 0 0.05432 2.24019 0.01684 0.00243 0.58223 -0.05771 0.39213 -2.93715
-ILE_332 -8.85328 1.10018 1.60342 0.02833 0.07056 0.05 -2.07177 0 0 0 0 0 -0.00849 0.37141 -0.73694 0 2.30374 -0.22713 0.43604 -5.93393
-GLN_333 -8.43184 0.7526 5.21344 0.00657 0.21457 0.02076 -3.04631 0 0 -0.45743 -0.97884 0 -0.05614 3.19778 0.32295 0 -1.45095 -0.08191 0.44473 -4.33003
-THR_334 -6.10875 0.55085 3.45934 0.00897 0.07879 -0.33156 -0.86559 0 0 -0.97838 0 0 0.04073 0.3932 -0.72588 0 1.15175 0.02435 0.64135 -2.66084
-ARG_335 -5.2486 0.58026 4.60873 0.01651 0.36897 -0.26515 -0.87487 0 0 0 -0.53992 0 0.02196 2.75558 -0.10613 0 -0.09474 -0.24885 0.78318 1.75692
-HIS_336 -7.80879 0.64816 5.35203 0.00687 0.51259 -0.77981 -1.17117 0 0 -1.538 0 0 -0.02626 3.50985 -0.34261 0 -0.30065 -0.47066 0.51072 -1.89774
-GLY_337 -2.45732 0.1695 2.89223 0.0001 0 -0.08935 -1.26923 0 0 0 0 0 -0.06402 0 -1.51728 0 0.79816 0.38083 0.2146 -0.94177
-VAL_338 -3.63932 0.29935 1.36552 0.01821 0.0515 -0.05297 -1.13434 0 0 -0.42146 0 0 -0.01453 0.00605 -0.33799 0 2.64269 0.54158 0.19862 -0.47709
-ILE_339 -7.08051 0.64937 1.39759 0.02571 0.07427 -0.0702 -1.3919 0 0 0 0 0 0.02113 0.14788 0.21327 0 2.30374 0.06289 0.352 -3.29478
-GLU_340 -4.13419 0.35446 3.10608 0.00525 0.2559 0.14157 -2.14355 0 0 -0.37481 0 0 0.00906 2.49855 0.18732 0 -2.72453 0.24869 0.3393 -2.23092
-SER_341 -6.09298 0.49673 5.33746 0.00153 0.07387 0.23301 -3.27489 0 0 -0.47259 0 0 0.05809 0.26743 -0.18265 0 -0.28969 -0.01168 0.35024 -3.50613
-GLU_342 -4.58999 0.28088 4.68647 0.00447 0.22131 -0.04966 -2.45396 0 0 0 -0.89307 0 0.00013 3.45111 0.4167 0 -2.72453 0.42538 0.36699 -0.85777
-GLY_343 -1.14321 0.09666 1.01691 0.00016 0 -0.03433 -0.42351 0 0 0 0 0 -0.09148 0 -1.18544 0 0.79816 0.71315 0.10802 -0.14489
-LYS:CtermProteinFull_344 -0.30729 0.07026 0.3364 0.00931 0.36971 -0.01156 -0.39807 0 0 0 0 0 0 0.761 0 0 -0.71458 0.21775 0.08548 0.41842
-SER:NtermProteinFull_345 -1.75135 0.10732 2.49786 0.00217 0.07395 -0.27828 -0.84556 0 0 -0.44914 0 0 -0.08578 0.20446 0 0 -0.28969 0 0.11003 -0.70402
-ASP_346 -3.76691 0.10761 4.40261 0.00303 0.25258 -0.43641 -4.27674 0 0 0 -0.51576 0 -0.02609 3.41398 0.03948 0 -2.14574 -0.22649 0.28747 -2.88738
-PHE_347 -8.49771 1.06084 2.31095 0.02602 0.47398 -0.24689 -1.4837 0 0 -0.55962 0 0 -0.01064 1.15358 -0.50234 0 1.21829 -0.32413 0.42552 -4.95586
-VAL_348 -6.98182 0.51556 0.90829 0.02027 0.05167 0.12647 -2.09714 0 0 0 0 0 -0.01441 0.01211 -0.38587 0 2.64269 -0.30679 0.33355 -5.17543
-VAL_349 -7.78963 1.15788 1.44849 0.01764 0.04564 0.16832 -2.29519 0 0 0 0 0 0.02455 0.08591 -0.77273 0 2.64269 -0.4064 0.2928 -5.38002
-ILE_350 -8.46212 0.59973 0.37634 0.02501 0.12128 -0.04066 -2.15999 0 0 0 0 0 0.0911 2.28911 -0.69989 0 2.30374 -0.34368 0.3708 -5.52923
-LYS_351 -8.83736 1.01645 6.48409 0.01668 0.21267 0.55654 -5.6656 0 0 -0.37481 -0.89307 0 -0.05015 1.27789 0.34898 0 -0.71458 -0.06763 0.45501 -6.23491
-ALA_352 -6.64681 0.71446 2.04002 0.00197 0 -0.28093 -2.51652 0 0 0 0 0 0.06852 0 0.24267 0 1.32468 -0.03267 0.46428 -4.62032
-LEU_353 -7.22382 0.90717 3.62505 0.02231 0.08753 -0.01466 -2.14456 0 0 0 0 0 0.04093 3.4455 -0.13461 0 1.66147 -0.22686 0.41309 0.45856
-GLU_354 -6.11855 0.37175 5.67823 0.00692 0.3557 -0.04908 -2.24353 0 0 -0.94535 0 0 -0.01114 2.61434 0.07188 0 -2.72453 -0.07012 0.38315 -2.68032
-ASP_355 -3.65734 0.24322 3.85361 0.00503 0.27404 -0.0921 -2.7261 0 0 -0.87656 0 0 -0.00665 1.50504 0.06875 0 -2.14574 -0.18101 0.23607 -3.49973
-GLY_356 -2.57064 0.05183 2.76312 0.00011 0 -0.13756 -1.15671 0 0 -0.85601 0 0 -0.09258 0 -1.33999 0 0.79816 -0.56779 0.52678 -2.58129
-VAL_357 -8.03883 0.73066 2.49883 0.01643 0.04148 0.01714 -2.40701 0 0 0 0 0 -0.03766 0.1139 -0.29898 0 2.64269 -0.57182 0.58315 -4.71002
-ASN_358 -5.59348 0.23443 4.72284 0.00446 0.25331 -0.2722 -2.0895 0 0 0 0 0 0.05907 2.04467 0.12969 0 -1.34026 -0.12367 0.24151 -1.72914
-VAL_359 -6.78749 0.56771 0.91483 0.01855 0.0459 0.11179 -2.18501 0 0 0 0 0 0.36099 0.01111 -0.49016 0 2.64269 -0.01605 0.37581 -4.42934
-ILE_360 -8.09875 0.82232 2.64051 0.03281 0.0762 0.01251 -2.36263 0 0 0 0 0 0.05833 0.34515 -0.75426 0 2.30374 -0.36993 0.47179 -4.8222
-GLY_361 -4.30628 0.25703 2.91109 2e-05 0 -0.08354 -2.95424 0 0 0 0 0 -0.0486 0 1.02433 0 0.79816 0.43304 0.37566 -1.59333
-LEU_362 -8.67249 0.7633 2.56986 0.01741 0.07522 -0.23793 -2.75042 0 0 0 0 0 0.33016 1.82652 -0.31286 0 1.66147 0.64174 0.42349 -3.66452
-THR_363 -5.97633 0.67772 5.14304 0.00619 0.09804 0.10895 -2.87343 0 0 -1.34323 0 0 0.07748 0.75861 0.23303 0 1.15175 -0.12353 0.91138 -1.15032
-ARG_364 -7.04344 0.30646 6.96106 0.01754 0.5457 -0.22648 -3.33425 0 0 -0.96241 -0.59787 0 -0.01171 2.13411 -0.06702 0 -0.09474 -0.21116 0.85135 -1.73285
-GLY_365 -2.1645 0.23825 2.06139 0.00011 0 -0.42774 0.33129 0 0 0 0 0 -0.04023 0 -1.51708 0 0.79816 0.23856 0.18993 -0.29186
-ALA_366 -2.15727 0.08748 1.882 0.00144 0 -0.2568 0.47268 0 0 0 0 0 0.03449 0 -0.34573 0 1.32468 0.09391 0.06062 1.19751
-ASP_367 -2.1429 0.16679 2.57037 0.0036 0.29322 -0.3466 -0.55245 0 0 -0.52238 0 0 -0.02768 3.03082 -0.41025 0 -2.14574 -0.34827 0.09482 -0.33664
-THR_368 -4.03393 0.26996 2.67338 0.00911 0.05835 -0.46359 -0.32105 0 0 0 0 0 -0.04814 0.01924 0.05429 0 1.15175 0.01334 0.1863 -0.431
-ARG_369 -4.26266 0.30225 3.57431 0.01487 0.41502 0.03072 -1.84337 0 0 -0.82085 0 0 -0.00851 2.19139 -0.06814 0 -0.09474 0.10339 0.35155 -0.11478
-PHE_370 -4.98518 0.48318 0.63247 0.04397 0.22947 -0.14906 -0.13858 0 0 0 0 0 0.01265 3.42474 -0.05206 0 1.21829 -0.1955 0.38415 0.90853
-HIS_371 -5.4317 0.33746 4.12372 0.00666 0.70567 -0.28584 -0.51805 0 0 0 -0.92806 0 0.02402 3.45191 -0.40904 0 -0.30065 0.12847 0.32044 1.225
-HIS_372 -5.89368 0.33214 5.44603 0.00444 0.31424 -0.08798 -1.8081 0 0 0 -0.79105 0 -0.02288 1.48401 -0.45121 0 -0.30065 0.36656 0.27865 -1.12948
-SER_373 -3.20462 0.19932 2.79333 0.00234 0.06984 -0.46827 -0.48382 0 0 0 0 0 -0.04249 0.17819 0.14773 0 -0.28969 0.35686 0.15368 -0.5876
-GLU_374 -6.44071 0.2019 6.35424 0.0092 0.58497 0.51974 -4.76603 0 0 0 -1.4909 0 -0.06145 3.62678 0.18585 0 -2.72453 0.34619 0.09109 -3.56364
-LYS_375 -3.80243 0.18753 3.8506 0.008 0.1659 -0.21956 -1.87717 0 0 0 0 0 -0.03523 1.02509 0.13112 0 -0.71458 0.01127 0.12361 -1.14586
-LEU_376 -9.1884 0.85419 2.95145 0.01658 0.0803 -0.06065 -2.38171 0 0 0 0 0 -0.03088 0.99251 -0.23597 0 1.66147 0.07321 0.26746 -5.00044
-ASP_377 -5.67481 0.56715 6.71375 0.00458 0.23053 0.00131 -5.61383 0 0 -1.91477 0 0 0.63927 2.49799 0.05256 0 -2.14574 0.09933 0.68843 -3.85425
-LYS_378 -5.42164 0.44278 5.46621 0.00931 0.20644 -0.17876 -3.28549 0 0 -0.87656 0 0 -0.08339 1.74651 -0.01257 0 -0.71458 -0.08358 0.56284 -2.22249
-GLY_379 -4.22473 0.22588 3.43733 8e-05 0 0.05851 -2.01731 0 0 0 0 0 -0.13862 0 -1.48757 0 0.79816 -0.43615 0.359 -3.42543
-GLU_380 -7.10038 0.17775 7.85978 0.00357 0.18634 0.22315 -5.92019 0 0 -1.05875 -1.13036 0 -0.00611 3.52072 -0.03281 0 -2.72453 -0.50363 0.40996 -6.09549
-VAL_381 -7.48594 0.64002 1.33385 0.01776 0.04518 0.05017 -1.91478 0 0 0 0 0 -0.0373 0.04857 -0.75672 0 2.64269 -0.36271 0.24633 -5.53288
-LEU_382 -8.58157 0.68 1.20319 0.01828 0.10142 0.01362 -2.21413 0 0 0 0 0 -0.02216 0.44064 -0.24629 0 1.66147 -0.15782 0.19441 -6.90895
-ILE_383 -8.17905 1.2259 0.67213 0.02409 0.0766 0.16631 -2.22292 0 0 0 0 0 0.24309 0.42828 -0.71396 0 2.30374 -0.1533 0.67395 -5.45513
-ALA_384 -4.61166 0.46828 1.83023 0.00155 0 0.15056 -2.18416 0 0 0 0 0 -0.00361 0 -0.04801 0 1.32468 -0.00407 0.86573 -2.21048
-GLN_385 -7.39923 0.68691 5.3302 0.00687 0.1817 -0.27589 -3.28448 0 0 -0.44914 -0.59466 0 0.30097 2.48036 -0.08752 0 -1.45095 0.07547 0.63271 -3.84667
-PHE_386 -8.3284 0.62698 1.97477 0.02219 0.23472 -0.75111 -1.26657 0 0 0 0 0 0.55948 1.72137 -0.16951 0 1.21829 -0.29737 0.77808 -3.67707
-THR_387 -5.44794 0.54743 5.51164 0.007 0.0693 0.04462 -1.98132 0 0 -2.72392 0 0 0.18943 0.32955 -0.75024 0 1.15175 -0.14664 0.7842 -2.41514
-GLU_388 -2.94833 0.17531 2.6003 0.00854 0.41626 -0.41667 0.20075 0 0 0 0 0 -0.09524 3.28155 -0.30216 0 -2.72453 -0.21023 0.48398 0.46953
-HIS_389 -6.04358 0.53783 5.06082 0.00336 0.4212 -0.88243 -1.51618 0 0 -0.91261 0 0 0.04737 2.21828 -0.30622 0 -0.30065 -0.10617 0.27731 -1.50165
-THR_390 -6.8563 0.17411 5.14417 0.01256 0.06414 -0.06963 -1.27638 0 0 -0.84891 -0.92806 0 -0.04768 0.02011 0.02792 0 1.15175 0.24351 0.34647 -2.84222
-SER_391 -5.42724 0.23768 4.53442 0.00187 0.05416 -0.26641 -1.69596 0 0 0 0 0 0.10436 0.21628 -0.00598 0 -0.28969 0.13582 0.31592 -2.08476
-ALA_392 -5.64316 0.64044 1.66022 0.00121 0 0.08598 -1.57652 0 0 0 0 0 -0.0088 0 -0.40656 0 1.32468 0.07859 0.27355 -3.57038
-ILE_393 -7.24624 0.53578 1.42804 0.02287 0.06969 0.0192 -2.40132 0 0 0 0 0 -0.05861 0.18664 -0.73837 0 2.30374 -0.13247 0.2495 -5.76154
-LYS_394 -8.31811 0.58863 6.88387 0.0085 0.14421 -0.01086 -5.31152 0 0 0 -0.61343 0 -0.03181 1.24397 0.31013 0 -0.71458 -0.14775 0.3116 -5.65716
-VAL_395 -6.54017 0.37167 0.8419 0.01685 0.04326 -0.02147 -1.88074 0 0 0 0 0 -0.04579 0.09097 -0.72449 0 2.64269 -0.16045 0.35292 -5.01285
-ARG_396 -4.52337 0.12427 4.17591 0.01696 0.45349 0.2833 -3.1453 0 0 0 -1.02387 0 -0.00686 1.97749 0.15091 0 -0.09474 -0.14261 0.46983 -1.28459
-GLY_397 -3.65667 0.07986 2.77406 0.00026 0 -0.12974 -1.64376 0 0 -0.48793 0 0 -0.02984 0 -1.50421 0 0.79816 0.18739 0.4232 -3.18921
-LYS_398 -6.76622 0.62748 5.35488 0.00805 0.16594 0.01639 -2.69795 0 0 -0.94535 0 0 0.00059 2.36946 0.07948 0 -0.71458 0.10521 0.34133 -2.05528
-ALA_399 -6.48189 0.6033 2.47924 0.00134 0 0.27735 -1.33717 0 0 0 0 0 -0.00413 0 -0.52409 0 1.32468 -0.03888 0.35336 -3.34688
-TYR_400 -7.81928 0.59252 3.82099 0.02366 0.12489 0.26804 -2.4081 0 0 0 -0.97729 0 0.01448 2.91604 0.04519 0.08249 0.58223 -0.04116 0.347 -2.42831
-ILE_401 -8.78164 0.97371 1.82632 0.02947 0.07112 0.03606 -2.09753 0 0 0 0 0 0.02555 0.32155 -0.74922 0 2.30374 -0.22601 0.4076 -5.85927
-GLN_402 -8.53534 0.54434 5.00184 0.00588 0.19814 -0.03254 -2.90836 0 0 -0.42146 -0.97729 0 -0.02826 3.06686 0.26241 0 -1.45095 -0.15887 0.43913 -4.99448
-THR_403 -6.75357 0.62888 3.64611 0.00944 0.08057 -0.37528 -0.83829 0 0 -0.93967 0 0 -0.01597 0.52258 -0.64182 0 1.15175 -0.09455 0.59219 -3.02763
-ARG_404 -4.74602 0.27173 4.75538 0.0183 0.67666 -0.4062 -1.24772 0 0 0 -0.51576 0 -0.04721 4.02851 -0.0933 0 -0.09474 -0.31924 0.81397 3.09437
-HIS_405 -6.77737 0.49919 4.70929 0.00625 0.46901 -0.67892 -0.83532 0 0 -1.41633 0 0 -0.03256 2.91347 -0.30322 0 -0.30065 -0.49508 0.62584 -1.61639
-GLY_406 -2.42286 0.17499 2.80425 9e-05 0 -0.0866 -1.28039 0 0 0 0 0 -0.0968 0 -1.51788 0 0.79816 0.33247 0.23234 -1.06222
-VAL_407 -3.72608 0.35978 1.33989 0.019 0.0514 -0.08648 -1.05963 0 0 -0.4402 0 0 -0.00994 0.02842 -0.39495 0 2.64269 0.43754 0.17267 -0.6659
-ILE_408 -6.91406 0.62877 1.53499 0.02684 0.07282 0.02004 -1.43503 0 0 0 0 0 0.02672 0.20582 0.30508 0 2.30374 0.06672 0.35602 -2.80153
-GLU_409 -4.03501 0.28132 3.07964 0.0048 0.24701 0.09783 -2.27476 0 0 -0.39236 0 0 0.01439 2.47179 0.17534 0 -2.72453 0.31233 0.37039 -2.37181
-SER_410 -6.11858 0.44832 5.36732 0.00162 0.07152 0.1419 -3.22975 0 0 -0.48793 0 0 0.05218 0.16927 -0.24298 0 -0.28969 -0.00559 0.36523 -3.75716
-GLU_411 -4.84562 0.39318 4.7616 0.00699 0.25864 -0.18042 -2.67135 0 0 0 -0.83832 0 0.02049 3.19986 0.09366 0 -2.72453 -0.00625 0.38666 -2.1454
-GLY:CtermProteinFull_412 -1.44868 0.04257 1.42179 0.00012 0 -0.10162 -0.34285 0 0 0 0 0 0 0 0 0 0.79816 0.05342 0.12819 0.5511
-SER:NtermProteinFull_413 -2.0911 0.05785 3.26437 0.00243 0.05638 -0.18087 -1.8677 0 0 -0.68909 0 0 0.16053 0.39674 0 0 -0.28969 0 0.10494 -1.07521
-ASP_414 -3.74589 0.18844 4.40199 0.00491 0.26615 0.11653 -4.80404 0 0 0 -0.36703 0 0.02988 1.45971 0.02718 0 -2.14574 -0.22072 0.52718 -4.26146
-PHE_415 -8.79425 0.95112 2.30577 0.02568 0.50103 -0.2101 -1.24314 0 0 -0.47666 0 0 -0.00551 1.22341 -0.51862 0 1.21829 -0.27 0.56529 -4.72771
-VAL_416 -6.7414 0.35195 0.9207 0.02161 0.05477 0.07776 -2.01097 0 0 0 0 0 -0.01226 0.08076 -0.3613 0 2.64269 -0.19939 0.26681 -4.90827
-VAL_417 -7.70497 1.06952 1.4672 0.01894 0.04707 0.2432 -2.28701 0 0 0 0 0 -0.04341 0.06495 -0.71788 0 2.64269 -0.33532 0.35688 -5.17814
-ILE_418 -8.06682 0.73839 0.44166 0.02647 0.08224 0.03001 -2.16364 0 0 0 0 0 -0.00506 0.29268 -0.70848 0 2.30374 -0.33828 0.39768 -6.96941
-LYS_419 -8.55612 0.7751 6.58558 0.01907 0.22926 0.51374 -5.7234 0 0 -0.39236 -0.83832 0 -0.06107 1.24979 0.34839 0 -0.71458 -0.02879 0.53664 -6.05708
-ALA_420 -6.55987 0.77511 2.0045 0.00186 0 -0.19951 -2.25129 0 0 0 0 0 0.02564 0 0.19752 0 1.32468 -0.04895 0.55798 -4.17232
-LEU_421 -6.68888 0.64471 2.81815 0.0169 0.08433 -0.41201 -0.90214 0 0 0 0 0 0.03869 0.05972 -0.10565 0 1.66147 -0.29522 0.44018 -2.63974
-GLU_422 -5.66788 0.32377 5.00099 0.00734 0.36744 -0.06916 -1.83632 0 0 -0.88101 0 0 0.0014 2.56194 0.06146 0 -2.72453 -0.07424 0.4248 -2.504
-ASP_423 -3.35241 0.23763 3.46235 0.00404 0.2794 -0.10133 -2.55745 0 0 -0.918 0 0 0.19227 1.61244 0.07143 0 -2.14574 -0.184 0.34821 -3.05117
-GLY_424 -2.32732 0.04929 2.4432 0.00011 0 0.02218 -0.7927 0 0 0 0 0 -0.12891 0 -1.4478 0 0.79816 -0.38271 0.4494 -1.3171
-VAL_425 -8.13817 0.93908 2.1355 0.01649 0.04194 -0.06418 -2.2788 0 0 0 0 0 0.00571 0.09858 -0.26067 0 2.64269 -0.41784 0.4977 -4.78197
-ASN_426 -6.66064 0.3818 4.93667 0.00927 0.47425 -0.26459 -1.89283 0 0 0 0 0 0.06641 1.90135 -0.15703 0 -1.34026 -0.23891 0.30802 -2.4765
-VAL_427 -7.14818 0.51692 1.19814 0.01685 0.04237 0.17728 -2.18996 0 0 0 0 0 0.15144 0.05042 -0.60625 0 2.64269 -0.15749 0.27513 -5.03063
-ILE_428 -7.98208 0.7949 2.81558 0.02765 0.11363 -0.23585 -2.32638 0 0 0 0 0 0.04125 2.46727 -0.76341 0 2.30374 -0.37854 0.34829 -2.77395
-GLY_429 -4.0257 0.27636 2.66107 3e-05 0 -0.05761 -2.67372 0 0 0 0 0 -0.05274 0 1.03461 0 0.79816 0.51592 0.24363 -1.27999
-LEU_430 -8.06251 0.62513 3.08905 0.01685 0.07283 -0.19127 -3.31514 0 0 0 0 0 0.36946 1.89658 -0.31483 0 1.66147 0.66203 0.30477 -3.18558
-THR_431 -5.90593 0.58423 5.06406 0.00521 0.09235 -0.1467 -2.76427 0 0 -1.25474 0 0 0.05068 0.60735 0.34908 0 1.15175 -0.10402 0.93578 -1.33518
-ARG_432 -7.07193 0.34187 6.93789 0.01636 0.53213 -0.18326 -3.16877 0 0 -0.95864 -0.62328 0 -0.04042 2.14861 0.00128 0 -0.09474 -0.12249 0.89471 -1.39067
-GLY_433 -2.04281 0.2151 1.83927 0.00012 0 -0.37835 0.37554 0 0 0 0 0 -0.03937 0 -1.51755 0 0.79816 0.30502 0.18544 -0.25943
-ALA_434 -2.07408 0.07265 1.78775 0.00141 0 -0.25491 0.35269 0 0 0 0 0 -0.04803 0 -0.3514 0 1.32468 0.09549 0.07546 0.98171
-ASP_435 -2.08963 0.1441 2.55698 0.00352 0.28619 -0.34774 -0.64623 0 0 -0.47216 0 0 -0.04194 2.756 -0.25587 0 -2.14574 -0.31273 0.09769 -0.46758
-THR_436 -3.56964 0.23555 2.36468 0.0105 0.05947 -0.51645 -0.07366 0 0 0 0 0 -0.05282 0.02222 0.08862 0 1.15175 0.04007 0.21195 -0.02777
-ARG_437 -4.1119 0.31091 3.51636 0.01528 0.31763 -0.03516 -1.80537 0 0 -0.78258 0 0 -0.00601 1.64755 -0.0531 0 -0.09474 0.13106 0.7286 -0.22147
-PHE_438 -3.84018 0.45366 1.36744 0.02478 0.48814 -0.17208 -0.20035 0 0 0 0 0 0.01608 3.022 -0.1844 0 1.21829 -0.03678 0.84343 3.00005
-HIS_439 -5.53075 0.22875 3.93509 0.00768 0.83428 -0.30295 -0.26402 0 0 0 -0.97616 0 -0.04639 2.76805 -0.47663 0 -0.30065 0.19804 0.39202 0.46635
-HIS_440 -6.36453 0.27053 5.51987 0.00438 0.30787 -0.33997 -1.69139 0 0 0 -0.77174 0 0.10466 1.50836 -0.49826 0 -0.30065 0.37124 0.2939 -1.58572
-SER_441 -3.19217 0.3023 2.40417 0.00164 0.08905 -0.43444 -0.82938 0 0 0 0 0 0.07896 0.95518 0.01289 0 -0.28969 0.11489 0.31156 -0.47506
-GLU_442 -6.01351 0.16917 6.2205 0.00611 0.51155 0.434 -4.3779 0 0 0 -1.38517 0 -0.03311 3.71031 0.1911 0 -2.72453 0.21186 0.2414 -2.83823
-LYS_443 -4.02099 0.25799 3.27417 0.01508 0.26568 -0.48834 -1.22239 0 0 0 0 0 0.02181 2.82843 0.14868 0 -0.71458 0.15016 0.20001 0.71571
-LEU_444 -8.6615 0.79223 3.07418 0.01341 0.06447 -0.08981 -2.99825 0 0 0 0 0 0.19246 0.38369 -0.25765 0 1.66147 -0.10354 0.35017 -5.57867
-ASP_445 -4.74294 0.42423 5.21198 0.00444 0.25561 -0.03926 -3.18147 0 0 -1.03709 0 0 0.10333 1.92819 0.16636 0 -2.14574 -0.01418 0.57518 -2.49134
-LYS_446 -5.07293 0.333 4.26269 0.01021 0.16351 -0.46895 -1.76408 0 0 -0.918 0 0 -0.08672 0.87254 -0.0202 0 -0.71458 -0.09272 0.36579 -3.13044
-GLY_447 -3.97478 0.2746 3.2839 8e-05 0 0.0739 -1.9764 0 0 0 0 0 -0.13493 0 -1.4929 0 0.79816 -0.47916 0.35172 -3.27581
-GLU_448 -7.08963 0.22305 7.61258 0.00298 0.16748 0.10954 -5.63286 0 0 -1.03709 -1.02387 0 0.01257 3.41827 -0.02747 0 -2.72453 -0.47215 0.5657 -5.89543
-VAL_449 -7.29167 0.52035 1.18444 0.01628 0.04348 0.02896 -1.97029 0 0 0 0 0 -0.03795 0.05204 -0.76776 0 2.64269 -0.34087 0.36359 -5.55672
-LEU_450 -7.6025 0.43475 1.4386 0.01513 0.09657 0.04116 -2.21741 0 0 0 0 0 -0.01093 0.43478 -0.23268 0 1.66147 -0.14936 0.1465 -5.94394
-ILE_451 -8.18776 1.26225 0.70696 0.02727 0.07915 0.1716 -2.22157 0 0 0 0 0 0.15547 0.33923 -0.71842 0 2.30374 -0.14668 0.60118 -5.62758
-ALA_452 -4.59056 0.48569 1.82546 0.00161 0 0.14652 -2.07326 0 0 0 0 0 -0.01133 0 -0.07645 0 1.32468 -0.01943 0.83765 -2.14941
-GLN_453 -7.34353 0.523 5.21748 0.007 0.18119 -0.13049 -2.81779 0 0 -0.68909 -0.59787 0 0.37506 2.47351 -0.08076 0 -1.45095 0.06381 0.64579 -3.62364
-PHE_454 -8.13912 0.63077 1.90117 0.02235 0.24139 -0.72015 -1.26776 0 0 0 0 0 0.56131 1.70937 -0.16274 0 1.21829 -0.30467 0.8285 -3.48131
-THR_455 -5.67929 0.72316 5.7795 0.00912 0.07186 0.06476 -1.67758 0 0 -2.5634 0 0 0.21605 0.45603 -0.75022 0 1.15175 -0.13852 0.78738 -1.54938
-GLU_456 -3.09703 0.18934 2.73811 0.00781 0.40453 -0.42167 0.1845 0 0 0 0 0 -0.09748 3.26018 -0.30517 0 -2.72453 -0.20099 0.40297 0.34057
-HIS_457 -6.46006 0.74443 5.38295 0.00349 0.43978 -0.92062 -1.24857 0 0 -0.85052 0 0 0.05457 2.20071 -0.31995 0 -0.30065 -0.10861 0.2835 -1.09956
-THR_458 -7.13223 0.20358 5.34839 0.01266 0.0658 -0.0467 -1.11172 0 0 -0.75423 -0.97616 0 -0.03956 0.01946 0.10708 0 1.15175 0.26066 0.38819 -2.50301
-SER_459 -5.57533 0.23593 4.69851 0.00202 0.05459 -0.23746 -2.08416 0 0 0 0 0 0.03196 0.21966 -0.008 0 -0.28969 0.144 0.31852 -2.48945
-ALA_460 -5.78943 0.76584 1.74955 0.00118 0 0.1036 -1.60539 0 0 0 0 0 -0.00464 0 -0.48003 0 1.32468 0.03864 0.22104 -3.67497
-ILE_461 -7.21612 0.40773 1.37962 0.02167 0.06987 0.00337 -2.36725 0 0 0 0 0 -0.00436 0.15629 -0.70924 0 2.30374 -0.1548 0.19397 -5.9155
-LYS_462 -8.53879 0.76142 7.63927 0.01502 0.17878 0.047 -6.63876 0 0 0 -0.65329 0 -0.01329 2.78446 0.24502 0 -0.71458 -0.18074 0.42205 -4.64643
-VAL_463 -6.92137 0.60839 0.74605 0.01821 0.04235 -0.04337 -1.8971 0 0 0 0 0 -0.05376 0.11078 -0.77043 0 2.64269 -0.21642 0.48862 -5.24535
-ARG_464 -4.61557 0.17513 4.50821 0.01629 0.44719 0.3717 -3.88347 0 0 0 -1.13909 0 0.01079 1.99053 0.08381 0 -0.09474 -0.15478 0.40977 -1.87423
-GLY_465 -3.37504 0.12261 2.87464 0.00016 0 -0.15992 -1.56242 0 0 0 0 0 0.17977 0 -1.49521 0 0.79816 0.24437 0.49141 -1.88147
-LYS_466 -6.14868 0.73105 4.67694 0.00808 0.14877 -0.18676 -2.97919 0 0 -0.88101 0 0 -0.06366 1.11683 0.06292 0 -0.71458 0.05661 0.34662 -3.82609
-ALA_467 -6.36377 0.56408 2.5778 0.00135 0 0.1564 -1.64542 0 0 0 0 0 -0.00791 0 -0.46057 0 1.32468 -0.10912 0.22356 -3.73893
-TYR_468 -6.86015 0.53894 3.39611 0.02106 0.09241 0.10266 -2.30298 0 0 0 0 0 -0.02205 2.14941 0.02209 0.01436 0.58223 -0.04694 0.36064 -1.95219
-ILE_469 -8.84165 1.08294 1.54372 0.02822 0.07004 0.02558 -1.91585 0 0 0 0 0 -0.03648 0.41793 -0.74644 0 2.30374 -0.26184 0.40261 -5.92748
-GLN_470 -7.84568 0.62935 4.49436 0.00654 0.21411 -0.01976 -2.84085 0 0 -0.4402 0 0 -0.05455 3.26011 0.32442 0 -1.45095 -0.09313 0.41164 -3.40459
-THR_471 -6.48599 0.59367 3.45743 0.01042 0.07808 -0.34975 -0.77309 0 0 -0.90397 0 0 -0.01724 0.4457 -0.7766 0 1.15175 0.05161 0.48455 -3.03345
-ARG_472 -5.80465 0.41296 5.94804 0.0154 0.49033 -0.0059 -1.80249 0 0 0 -0.80818 0 0.11557 3.50208 -0.13704 0 -0.09474 -0.27506 0.62328 2.1796
-HIS_473 -7.454 0.57882 5.14951 0.00662 0.485 -0.75094 -0.83051 0 0 -1.44999 0 0 0.00652 3.01047 -0.2829 0 -0.30065 -0.53668 0.57661 -1.79212
-GLY_474 -2.4678 0.17744 2.85797 0.00011 0 -0.06075 -1.18626 0 0 0 0 0 -0.09142 0 -1.5175 0 0.79816 0.38354 0.30616 -0.80035
-VAL_475 -3.80806 0.32587 1.41842 0.01886 0.05184 0.10027 -1.09903 0 0 -0.37771 0 0 -0.01348 0.00969 -0.33448 0 2.64269 0.55962 0.23426 -0.27124
-ILE_476 -6.76878 0.59536 1.46735 0.02915 0.0847 -0.02698 -1.36783 0 0 0 0 0 0.0171 2.2333 0.01519 0 2.30374 -0.0374 0.44616 -1.00894
-GLU_477 -3.85885 0.34706 3.00737 0.00588 0.2624 0.12328 -1.98463 0 0 -0.37459 0 0 -0.01516 2.56597 0.20707 0 -2.72453 0.13521 0.43072 -1.87281
-SER_478 -5.77198 0.52796 4.97173 0.00164 0.07172 -0.10709 -2.42678 0 0 0 0 0 0.08084 0.50936 -0.14428 0 -0.28969 0.04844 0.22648 -2.30166
-GLU:CtermProteinFull_479 -4.3565 0.3182 5.40981 0.00703 0.37948 -0.22005 -3.83101 0 0 0 -0.82639 0 0 3.60409 0 0 -2.72453 -0.00473 0.30098 -1.94362
-SER:NtermProteinFull_480 -2.00919 0.01993 2.93385 0.00273 0.06732 -0.08964 -1.18997 0 0 -0.51328 0 0 -0.02428 0.35994 0 0 -0.28969 0 0.14423 -0.58806
-ASP_481 -4.1879 0.2656 5.27858 0.00489 0.23684 0.38852 -4.60999 0 0 0 -0.88782 0 -0.00416 1.72965 0.03005 0 -2.14574 -0.15824 0.34835 -3.71136
-PHE_482 -8.81841 1.24862 2.50708 0.02781 0.48384 0.03423 -1.26047 0 0 -0.45644 0 0 -0.00984 1.37942 -0.42835 0 1.21829 -0.18713 0.40594 -3.85541
-VAL_483 -6.95426 0.49946 0.96248 0.02256 0.05482 0.09497 -1.99419 0 0 0 0 0 -0.02204 0.08707 -0.36708 0 2.64269 -0.17294 0.31466 -4.83181
-VAL_484 -7.87991 1.13848 1.44337 0.01957 0.04848 0.22145 -2.20453 0 0 0 0 0 -0.02478 0.02199 -0.69638 0 2.64269 -0.31903 0.32512 -5.26349
-ILE_485 -7.9207 0.99933 0.74714 0.02628 0.07737 0.0583 -2.19478 0 0 0 0 0 -0.01096 0.22067 -0.71668 0 2.30374 -0.33745 0.39192 -6.35583
-LYS_486 -7.40455 0.63061 4.95928 0.01323 0.1837 0.18858 -3.85416 0 0 0 0 0 -0.04911 1.27655 0.32226 0 -0.71458 -0.12021 0.35842 -4.20999
-ALA_487 -5.92603 0.5838 1.9955 0.00197 0 -0.12516 -2.25747 0 0 0 0 0 0.00219 0 0.38822 0 1.32468 0.11776 0.3338 -3.56073
-LEU_488 -6.114 0.50228 3.38935 0.02179 0.0913 -0.09119 -2.31527 0 0 -0.20332 0 0 0.03996 0.04217 -0.18859 0 1.66147 -0.14824 0.32683 -2.98546
-GLU_489 -6.2187 0.42049 5.83345 0.00784 0.38909 -0.36818 -2.23903 0 0 -0.86956 0 0 0.0521 2.42782 0.12017 0 -2.72453 -0.14275 0.35098 -2.96082
-ASP_490 -3.32629 0.22418 3.42931 0.0029 0.26908 -0.16794 -2.537 0 0 -0.86533 0 0 0.05942 1.71492 0.04677 0 -2.14574 -0.14904 0.49561 -2.94916
-GLY_491 -2.24153 0.08103 2.34064 8e-05 0 -0.14037 -0.9498 0 0 0 0 0 -0.14896 0 -1.50735 0 0.79816 -0.24161 0.46274 -1.54699
-VAL_492 -8.09476 0.94986 1.99367 0.01626 0.03811 0.15082 -2.15972 0 0 0 0 0 0.25223 0.13945 -0.30825 0 2.64269 -0.22344 0.55706 -4.04602
-ASN_493 -8.12689 0.48961 6.88532 0.01785 0.52195 0.07788 -1.68691 0 0 0 -0.56521 0 -0.00892 1.90646 -0.23706 0 -1.34026 -0.06226 0.6373 -1.49113
-VAL_494 -7.13011 0.72963 1.35009 0.01804 0.04331 0.14612 -1.88044 0 0 0 0 0 0.33649 0.01181 -0.48109 0 2.64269 -0.00562 0.49507 -3.724
-ILE_495 -7.88794 0.84439 3.46026 0.02911 0.07325 -0.1066 -2.12887 0 0 0 0 0 -0.01107 0.31169 -0.77372 0 2.30374 -0.38199 0.4445 -3.82324
-GLY_496 -4.3581 0.3207 3.00153 2e-05 0 -0.02353 -3.17497 0 0 0 0 0 -0.07015 0 1.11013 0 0.79816 0.54746 0.30519 -1.54356
-LEU_497 -8.52804 0.83974 3.14158 0.01961 0.07761 -0.2966 -3.10664 0 0 0 0 0 0.44252 1.8746 -0.32741 0 1.66147 0.73716 0.3812 -3.08321
-THR_498 -6.31052 0.86372 5.33572 0.00534 0.09295 -0.02631 -2.83753 0 0 -1.39834 0 0 0.00482 0.93043 0.24529 0 1.15175 -0.1377 0.95528 -1.1251
-ARG_499 -7.17954 0.31894 7.11014 0.01593 0.51373 -0.18365 -3.13932 0 0 -0.89678 -0.58499 0 -0.03107 2.16776 -0.04839 0 -0.09474 -0.21727 0.80046 -1.4488
-GLY_500 -2.0602 0.22212 1.9988 0.00013 0 -0.36652 0.41802 0 0 0 0 0 -0.04369 0 -1.5166 0 0.79816 0.22254 0.10283 -0.22442
-ALA_501 -2.06398 0.0721 1.86192 0.0014 0 -0.23903 0.34228 0 0 0 0 0 -0.02108 0 -0.35852 0 1.32468 0.05888 0.04184 1.02051
-ASP_502 -1.99667 0.17343 2.53864 0.00322 0.28601 -0.25065 -0.59707 0 0 -0.50948 0 0 -0.07539 3.47372 -0.56519 0 -2.14574 -0.40289 0.0989 0.03085
-THR_503 -4.25727 0.4962 2.90606 0.01274 0.05863 -0.43559 -0.38514 0 0 0 0 0 0.03642 0.03188 -0.07311 0 1.15175 -0.06657 0.22873 -0.29529
-ARG_504 -4.6164 0.37811 3.89666 0.03417 0.50831 0.08931 -1.89091 0 0 -0.88885 0 0 -0.00877 3.2845 -0.06448 0 -0.09474 0.0805 0.89399 1.6014
-PHE_505 -4.63909 0.65192 2.01284 0.02669 0.5365 -0.16887 -0.78191 0 0 0 0 0 0.03648 3.25617 -0.02292 0 1.21829 -0.13556 0.97157 2.9621
-HIS_506 -6.05085 0.36934 4.42403 0.00715 0.75262 -0.30903 -0.55602 0 0 0 -0.9782 0 0.03043 3.00561 -0.44809 0 -0.30065 0.11363 0.39382 0.4538
-HIS_507 -6.80251 0.44055 5.835 0.00504 0.34487 -0.20217 -1.65653 0 0 0 -0.84771 0 -0.02633 1.47156 -0.43259 0 -0.30065 0.33393 0.40059 -1.43696
-SER_508 -3.23399 0.09209 2.88677 0.00412 0.07929 -0.06636 -1.07289 0 0 0 -0.56521 0 -0.03716 0.30102 0.34749 0 -0.28969 0.4081 0.51248 -0.63393
-GLU_509 -6.65112 0.49339 6.40757 0.00838 0.60061 0.44376 -4.49618 0 0 0 -1.27843 0 -0.06071 3.64969 0.31426 0 -2.72453 0.4876 0.32614 -2.47957
-LYS_510 -3.41243 0.24792 2.72744 0.00895 0.15574 -0.45366 -0.97104 0 0 0 0 0 -0.04217 1.05058 0.10705 0 -0.71458 0.09997 0.08746 -1.10877
-LEU_511 -8.57231 0.84499 3.18096 0.0208 0.08762 0.01856 -3.07941 0 0 0 0 0 0.08245 3.12263 -0.25459 0 1.66147 -0.14117 0.31442 -2.71359
-ASP_512 -4.52366 0.3541 5.01484 0.00266 0.2186 -0.12487 -3.15906 0 0 -0.9949 0 0 0.00194 2.13034 0.13977 0 -2.14574 -0.01957 0.43041 -2.67513
-LYS_513 -4.91937 0.37352 5.23257 0.01134 0.18179 -0.15381 -3.51725 0 0 -1.06865 0 0 0.05989 2.62809 -0.02755 0 -0.71458 0.11109 0.41292 -1.39
-GLY_514 -3.92084 0.1692 3.26746 7e-05 0 0.14352 -2.04067 0 0 0 0 0 -0.13136 0 -1.47513 0 0.79816 -0.37701 0.67382 -2.89278
-GLU_515 -6.94374 0.32566 7.5414 0.00369 0.19276 -0.03006 -5.4667 0 0 -0.9949 -0.42614 0 -0.00517 3.26435 -0.04282 0 -2.72453 -0.58448 0.53234 -5.35834
-VAL_516 -7.01284 0.48106 1.41032 0.01475 0.04137 0.04085 -2.00704 0 0 0 0 0 -0.05401 0.06414 -0.78769 0 2.64269 -0.37579 0.2311 -5.31109
-LEU_517 -7.5957 0.57729 1.41187 0.01537 0.0917 0.01988 -2.25631 0 0 0 0 0 -0.03857 0.44997 -0.18359 0 1.66147 -0.14614 0.17348 -5.81927
-ILE_518 -8.29056 1.33918 0.80241 0.02873 0.07802 0.17787 -2.23387 0 0 0 0 0 0.15001 0.40745 -0.73312 0 2.30374 -0.14835 0.58806 -5.53043
-ALA_519 -4.56856 0.44534 1.81101 0.00156 0 0.14588 -2.06686 0 0 0 0 0 0.01616 0 -0.05813 0 1.32468 -0.02145 0.82001 -2.15036
-GLN_520 -7.09776 0.52289 4.74552 0.00738 0.19081 -0.37609 -2.85702 0 0 0 -0.60424 0 0.35875 2.47584 -0.09174 0 -1.45095 0.07572 0.67602 -3.42486
-PHE_521 -8.71193 0.94196 2.61331 0.0226 0.242 -0.77235 -2.35252 0 0 -0.51328 0 0 0.64847 1.65031 -0.18326 0 1.21829 -0.26978 0.82445 -4.64174
-THR_522 -5.42474 0.66251 5.4077 0.01111 0.07701 0.05966 -1.47804 0 0 -1.78745 0 0 0.09426 0.64172 -0.76804 0 1.15175 -0.10775 0.7374 -0.7229
-GLU_523 -3.07766 0.18686 2.73636 0.00893 0.41831 -0.38733 0.07733 0 0 0 0 0 -0.08907 3.11098 -0.29437 0 -2.72453 -0.15493 0.3981 0.20897
-HIS_524 -6.23042 0.73855 5.13648 0.00387 0.44383 -0.9512 -1.35886 0 0 -0.87155 0 0 -0.03767 2.18323 -0.33284 0 -0.30065 -0.20821 0.27934 -1.5061
-THR_525 -6.91641 0.19239 5.17413 0.01237 0.06704 -0.16027 -1.02585 0 0 -0.01913 -0.9782 0 -0.05813 0.02576 0.10488 0 1.15175 0.17258 0.37928 -1.8778
-SER_526 -5.26087 0.21949 4.43402 0.00191 0.05288 -0.33274 -1.87187 0 0 0 0 0 0.04124 0.216 -0.04204 0 -0.28969 0.1697 0.34715 -2.31481
-ALA_527 -5.68375 0.6828 1.60237 0.0013 0 0.03778 -1.43858 0 0 0 0 0 -0.01073 0 -0.46111 0 1.32468 0.0191 0.25232 -3.67382
-ILE_528 -7.52975 0.62725 1.26339 0.02432 0.07161 -0.021 -2.46359 0 0 0 0 0 -0.0548 0.20495 -0.72887 0 2.30374 -0.15011 0.20566 -6.24719
-LYS_529 -7.63806 0.52107 5.967 0.00932 0.14425 0.19525 -5.49271 0 0 0 -0.57825 0 0.03199 1.31303 0.27661 0 -0.71458 -0.16817 0.471 -5.66225
-VAL_530 -6.4666 0.53056 0.78297 0.01976 0.04501 -0.07026 -1.86648 0 0 0 0 0 -0.03498 0.13794 -0.74116 0 2.64269 -0.18395 0.50565 -4.69885
-ARG_531 -7.17726 0.53852 5.88186 0.04169 0.96187 -0.2261 -1.81862 0 0 0 0 0 0.03012 3.902 -0.04417 0 -0.09474 -0.20884 0.85583 2.64215
-GLY_532 -2.88875 0.08623 2.49086 0.00021 0 -0.01051 -0.4721 0 0 0 0 0 -0.02082 0 -1.47378 0 0.79816 0.03709 0.86152 -0.59188
-LYS_533 -6.05802 0.45576 5.47657 0.0083 0.13656 -0.4694 -3.48608 0 0 -0.86956 0 0 0.02466 1.4192 0.02219 0 -0.71458 -0.1427 0.28521 -3.91188
-ALA_534 -6.29704 0.57106 2.70015 0.0013 0 0.38071 -2.14241 0 0 0 0 0 0.00659 0 -0.54816 0 1.32468 -0.21651 0.29674 -3.92287
-TYR_535 -7.38905 0.59809 3.56792 0.02049 0.14229 0.10292 -2.31964 0 0 0 0 0 0.0083 2.07501 -0.01597 0.0542 0.58223 0.01042 0.38289 -2.17989
-ILE_536 -9.02573 0.91318 1.1986 0.02166 0.10588 0.06632 -2.20863 0 0 0 0 0 -0.01788 2.45353 -0.74444 0 2.30374 -0.15839 0.40186 -4.69031
-GLN_537 -8.40007 0.6398 4.89148 0.00687 0.20966 -0.059 -2.8236 0 0 -0.43434 0 0 -0.03659 3.35627 0.313 0 -1.45095 -0.15824 0.43681 -3.5089
-THR_538 -6.66366 0.63083 3.63673 0.01102 0.0805 -0.39529 -0.81238 0 0 -0.91037 0 0 0.03358 0.53789 -0.65474 0 1.15175 -0.0781 0.53454 -2.8977
-ARG_539 -5.42657 0.45525 5.84913 0.01924 0.44788 -0.62966 -1.19212 0 0 0 -0.21152 0 0.10762 2.98965 -0.11856 0 -0.09474 -0.27006 0.82301 2.74856
-HIS_540 -7.12544 0.50055 4.99176 0.00602 0.47185 -0.73553 -1.22792 0 0 -1.42268 0 0 -0.04991 2.85212 -0.31571 0 -0.30065 -0.44426 0.6597 -2.14011
-GLY_541 -2.42412 0.17178 2.86586 0.00011 0 -0.078 -1.29051 0 0 0 0 0 -0.04414 0 -1.51751 0 0.79816 0.38106 0.20731 -0.93002
-VAL_542 -3.6415 0.30728 1.30864 0.01988 0.05177 0.03508 -1.0013 0 0 -0.37819 0 0 -0.01823 0.00971 -0.35657 0 2.64269 0.51954 0.24352 -0.25769
-ILE_543 -7.1217 0.66017 1.27791 0.02788 0.07378 -0.06858 -1.50404 0 0 0 0 0 -0.03255 0.35743 0.16931 0 2.30374 0.01541 0.39899 -3.44226
-GLU_544 -4.09043 0.43248 3.20691 0.0063 0.27773 0.15202 -2.03195 0 0 -0.27813 0 0 0.10703 2.45314 0.14117 0 -2.72453 0.20358 0.45557 -1.6891
-SER_545 -5.33385 0.32231 5.14218 0.00209 0.10255 0.20916 -2.45195 0 0 0 0 0 0.1543 1.66262 0.31994 0 -0.28969 0.0923 0.62603 0.55799
-GLU:CtermProteinFull_546 -3.17845 0.07798 4.37472 0.00732 0.36368 0.05962 -2.95001 0 0 0 -0.80274 0 0 3.57467 0 0 -2.72453 0.03812 0.75655 -0.40306
-SER:NtermProteinFull_547 -1.68367 0.05205 2.42154 0.00257 0.07359 -0.16428 -1.12545 0 0 0 0 0 -0.09283 0.20034 0 0 -0.28969 0 0.05501 -0.55081
-ASP_548 -4.37892 0.44729 5.28756 0.00365 0.27237 -0.08949 -5.01257 0 0 -0.81191 -0.21152 0 -0.00045 3.2371 -0.09287 0 -2.14574 -0.09146 0.12835 -3.45862
-PHE_549 -8.81819 1.03595 3.23646 0.02547 0.46973 -0.10377 -2.01577 0 0 -1.32423 0 0 0.0134 1.06576 -0.57572 0 1.21829 -0.20769 0.27428 -5.70603
-VAL_550 -6.84731 0.41308 0.77647 0.02684 0.05569 0.05117 -2.06539 0 0 0 0 0 -0.00609 0.16647 -0.4036 0 2.64269 -0.20607 0.34268 -5.05338
-VAL_551 -7.81974 1.09107 1.32863 0.02045 0.05019 0.18522 -2.24189 0 0 0 0 0 -0.02335 0.00828 -0.64901 0 2.64269 -0.23588 0.45385 -5.18948
-ILE_552 -8.00623 0.83331 0.34319 0.0303 0.07362 -0.02573 -2.20067 0 0 0 0 0 0.03779 0.19574 -0.72486 0 2.30374 -0.31119 0.51597 -6.93503
-LYS_553 -8.41499 0.86508 6.64029 0.01218 0.18877 0.631 -5.80387 0 0 -0.27813 -0.80274 0 -0.01418 1.38489 0.32117 0 -0.71458 -0.11955 0.59441 -5.51024
-ALA_554 -6.12459 0.7483 2.16325 0.00161 0 -0.21058 -2.35603 0 0 0 0 0 -0.0014 0 0.35099 0 1.32468 0.05119 0.63597 -3.41663
-LEU_555 -6.27835 0.54082 2.35546 0.01913 0.08159 -0.39 -0.47948 0 0 0 0 0 -0.04689 0.10097 -0.04499 0 1.66147 0.0017 1.12807 -1.35049
-GLU_556 -5.96958 1.18929 6.3333 0.00507 0.26982 0.43627 -2.88045 0 0 -0.85953 -0.51788 0 -0.01538 3.5775 -0.14354 0 -2.72453 0.06429 1.64927 0.41392
-ASP_557 -6.26629 0.83735 7.16122 0.00706 0.25123 0.02956 -3.20151 0 0 -0.64266 -0.60387 0 0.44193 1.83149 0.05165 0 -2.14574 -0.10388 36.6009 34.2484
-GLY_558 -3.24916 0.41063 3.25923 0.00146 0 -0.06132 0.2789 0 0 0 0 0 -0.098 0 -1.51203 0 0.79816 0.09442 43.9471 43.8694
-VAL_559 -6.96924 1.53401 1.26165 0.03645 0.05653 0.00318 -0.40788 0 0 0 0 0 0.05682 0.17784 -0.05633 0 2.64269 0.13946 9.00009 7.47528
-ASN_560 -7.46721 0.63176 6.31227 0.02342 0.78917 0.16633 -0.34364 0 0 -0.93362 -0.64241 0 0.09279 1.79262 -0.95269 0 -1.34026 0.14809 1.53101 -0.19235
-VAL_561 -6.71163 0.66944 1.15371 0.01756 0.04156 -0.11301 -1.81584 0 0 0 0 0 -0.0786 0.11325 -0.27908 0 2.64269 0.01845 0.89961 -3.4419
-ILE_562 -8.19714 1.29953 2.69031 0.0365 0.06126 -0.15016 -2.13754 0 0 0 0 0 0.12186 0.93073 -0.70107 0 2.30374 -0.42646 1.15183 -3.01661
-GLY_563 -4.10642 0.26732 2.70528 1e-05 0 -0.16552 -2.65691 0 0 0 0 0 -0.07514 0 1.00552 0 0.79816 0.56035 1.17741 -0.48994
-LEU_564 -7.54711 0.54934 2.90053 0.01736 0.07686 -0.33584 -2.84585 0 0 0 0 0 0.26997 1.97591 -0.32335 0 1.66147 0.68591 0.53184 -2.38295
-THR_565 -6.1341 0.52425 5.22794 0.00468 0.09752 -0.04939 -2.94928 0 0 -1.17536 0 0 0.03964 0.76046 0.25206 0 1.15175 -0.13224 1.02992 -1.35216
-ARG_566 -6.86346 0.30462 6.87685 0.01437 0.53145 -0.15497 -3.31292 0 0 -0.99885 -0.66135 0 -0.03795 2.12883 -0.00793 0 -0.09474 -0.16927 0.98794 -1.4574
-GLY_567 -2.15239 0.26996 1.98342 0.00014 0 -0.40301 0.40677 0 0 0 0 0 -0.05922 0 -1.51769 0 0.79816 0.28747 0.21701 -0.16938
-ALA_568 -2.14625 0.0821 1.86539 0.00142 0 -0.26831 0.36379 0 0 0 0 0 -0.03443 0 -0.36655 0 1.32468 0.0734 0.03307 0.9283
-ASP_569 -2.13856 0.18005 2.60516 0.00365 0.29501 -0.31744 -0.63573 0 0 -0.4979 0 0 -0.05858 2.93538 -0.27087 0 -2.14574 -0.32627 0.09285 -0.279
-THR_570 -3.56364 0.14038 2.34514 0.00927 0.0621 -0.40618 -0.24602 0 0 0 0 0 -0.05946 0.02497 0.14279 0 1.15175 0.04756 0.3095 -0.04183
-ARG_571 -4.65381 0.30258 4.15226 0.01737 0.44112 -0.074 -1.97052 0 0 -0.67746 0 0 -0.0097 1.08628 -0.01186 0 -0.09474 0.21102 0.50043 -0.78103
-PHE_572 -6.24132 0.99096 1.62684 0.03208 0.13374 -0.46433 -0.32053 0 0 0 0 0 0.33592 2.92662 0.08385 0 1.21829 0.12014 0.97823 1.42049
-HIS_573 -6.1668 0.41508 4.50299 0.00742 0.64218 -0.31271 -0.14819 0 0 0 -0.97065 0 0.2765 3.78556 -0.3534 0 -0.30065 0.3999 1.27565 3.05288
-HIS_574 -7.27832 0.61307 6.06765 0.00504 0.30559 -0.30088 -2.05887 0 0 0 -0.78127 0 -0.00076 1.68069 -0.40673 0 -0.30065 0.40531 0.95769 -1.09244
-SER_575 -5.45986 1.10139 4.50729 0.00266 0.07265 -0.18072 -0.9143 0 0 0 -0.64241 0 -0.06281 0.65715 0.22681 0 -0.28969 0.25125 0.93941 0.20882
-GLU_576 -6.8294 0.23937 6.61479 0.01295 0.76766 0.09916 -4.01616 0 0 0 -1.35951 0 0.05253 3.52812 0.17617 0 -2.72453 0.66462 0.62049 -2.15374
-LYS_577 -7.25065 0.7 7.72837 0.01185 0.32087 -0.14111 -3.45032 0 0 -1.64121 0 0 0.00526 4.03048 -0.00438 0 -0.71458 0.13112 0.34921 0.07489
-LEU_578 -7.41395 0.54249 2.17926 0.01098 0.04658 -0.36263 -0.55125 0 0 0 0 0 0.02066 0.31348 -0.13972 0 1.66147 -0.33019 0.65533 -3.36749
-ASP_579 -6.53009 0.69423 7.64631 0.00463 0.30271 -0.25772 -4.29036 0 0 0 -0.72973 0 0.1495 1.84263 0.56935 0 -2.14574 0.14933 0.6459 -1.94904
-LYS_580 -6.01367 0.44066 5.14344 0.01964 0.34052 -0.42413 -2.07281 0 0 -0.64266 0 0 -0.07368 2.92173 0.0265 0 -0.71458 -0.04944 0.45069 -0.6478
-GLY_581 -3.34545 0.17148 2.94705 0.00011 0 0.05953 -1.59885 0 0 0 0 0 -0.1398 0 -1.4901 0 0.79816 -0.57823 0.34291 -2.83318
-GLU_582 -7.0223 0.47974 7.58246 0.00491 0.21045 -0.30185 -4.00742 0 0 0 0 0 0.012 2.69638 -0.06315 0 -2.72453 -0.41365 0.33584 -3.21113
-VAL_583 -6.72275 0.42931 0.95768 0.01655 0.04073 0.02646 -1.90951 0 0 0 0 0 -0.0061 0.04865 -0.7943 0 2.64269 -0.27967 0.30549 -5.24475
-LEU_584 -7.8432 0.69065 1.2228 0.01386 0.09576 0.02325 -2.16127 0 0 0 0 0 -0.00552 0.49285 -0.17223 0 1.66147 -0.12726 0.27761 -5.83124
-ILE_585 -8.31715 1.42111 0.71068 0.03011 0.07448 0.15163 -2.2492 0 0 0 0 0 0.19165 0.30432 -0.73959 0 2.30374 -0.1462 0.75997 -5.50444
-ALA_586 -4.55086 0.35174 1.81568 0.00149 0 0.16944 -2.14395 0 0 0 0 0 0.08 0 -0.09556 0 1.32468 -0.06015 0.83961 -2.26788
-GLN_587 -7.22053 0.62037 5.07488 0.00747 0.18992 -0.42036 -3.02077 0 0 0 -0.58499 0 0.30278 2.45894 -0.09761 0 -1.45095 0.07456 0.53461 -3.53168
-PHE_588 -8.66914 0.56053 2.10531 0.02124 0.24844 -0.68373 -1.7495 0 0 0 0 0 0.65879 1.72066 -0.19048 0 1.21829 -0.23119 0.78684 -4.20392
-THR_589 -5.56186 0.63877 5.52481 0.00913 0.06837 0.0756 -1.62951 0 0 -2.89447 0 0 0.14243 0.78302 -0.75926 0 1.15175 -0.04691 0.82952 -1.66863
-GLU_590 -2.90794 0.14465 2.60753 0.00844 0.41235 -0.36138 0.20392 0 0 0 0 0 -0.09718 3.10674 -0.29847 0 -2.72453 -0.11645 0.42645 0.40413
-HIS_591 -6.16709 0.64878 5.25507 0.00348 0.41858 -0.68806 -1.27429 0 0 -0.89116 0 0 -0.01099 2.22268 -0.24282 0 -0.30065 0.08054 0.22038 -0.72556
-THR_592 -6.89572 0.18428 5.25269 0.01493 0.06895 -0.15916 -1.18309 0 0 -1.00447 -0.97065 0 -0.04765 0.02393 0.2587 0 1.15175 0.43285 0.31845 -2.5542
-SER_593 -5.40523 0.32556 4.61403 0.00216 0.0587 -0.32434 -2.10728 0 0 0 0 0 -0.03461 0.22523 -0.09089 0 -0.28969 0.09867 0.2818 -2.6459
-ALA_594 -5.44009 0.50324 1.60273 0.00121 0 0.06225 -1.25982 0 0 0 0 0 0.05961 0 -0.50818 0 1.32468 -0.02606 0.24477 -3.43567
-ILE_595 -7.58853 0.70019 0.90465 0.02418 0.07066 0.03851 -2.27945 0 0 0 0 0 -0.0273 0.15743 -0.70255 0 2.30374 -0.14783 0.32801 -6.2183
-LYS_596 -7.54768 0.46074 6.91007 0.01248 0.1436 -0.20436 -4.78831 0 0 0 -0.70234 0 0.308 1.78294 0.30333 0 -0.71458 -0.13135 0.65773 -3.50973
-VAL_597 -6.64487 0.97774 0.13352 0.02055 0.03912 -0.06558 -2.23313 0 0 0 0 0 -0.05681 0.44562 -0.76245 0 2.64269 -0.15632 0.88676 -4.77315
-ARG_598 -8.80309 1.68013 8.11246 0.02771 0.22614 -0.44845 -3.65702 0 0 -0.00773 -0.08273 0 0.01076 2.0726 -0.17972 0 -0.09474 -0.24857 58.7703 57.378
-GLY_599 -3.35353 0.1177 3.85932 0.00016 0 -0.21141 -2.80658 0 0 -0.36549 0 0 0.02296 0 -1.48532 0 0.79816 -0.03653 58.512 55.0514
-LYS_600 -6.06126 0.9787 5.61439 0.01157 0.18929 -0.22499 -4.05111 0 0 -0.85953 0 0 -0.05197 2.66152 0.22404 0 -0.71458 0.19793 0.56599 -1.51999
-ALA_601 -5.88132 0.48735 2.60563 0.00123 0 0.3658 -1.26668 0 0 0 0 0 -0.00648 0 -0.50981 0 1.32468 0.15076 0.58021 -2.14862
-TYR_602 -6.5564 0.57299 2.65988 0.02 0.13407 0.17935 -2.1429 0 0 0 0 0 -0.03075 2.51889 -0.0757 0.03339 0.58223 0.12831 0.49789 -1.47874
-ILE_603 -8.33625 0.9467 1.23355 0.03146 0.08775 -0.02001 -1.9677 0 0 0 0 0 0.04081 0.52821 -0.76705 0 2.30374 -0.08885 0.61203 -5.39562
-GLN_604 -7.836 0.56144 4.54308 0.00777 0.24674 -0.14394 -2.99636 0 0 -0.37819 0 0 0.00287 3.2948 0.33447 0 -1.45095 -0.17036 0.63165 -3.35297
-THR_605 -6.27614 0.61904 3.49327 0.00925 0.0768 -0.32517 -0.9911 0 0 -0.94021 0 0 0.06544 0.43922 -0.7334 0 1.15175 -0.00128 0.67796 -2.73455
-ARG_606 -3.95464 0.18964 3.26676 0.02086 0.54677 -0.36468 -0.04573 0 0 0 0 0 0.10337 2.97458 -0.12126 0 -0.09474 -0.19864 0.56641 2.8887
-HIS_607 -7.92025 0.60408 5.56739 0.00685 0.51092 -0.76792 -1.36829 0 0 -1.35566 0 0 -0.05345 3.21002 -0.33246 0 -0.30065 -0.39995 0.36601 -2.23337
-GLY_608 -2.51654 0.15061 2.9581 5e-05 0 -0.08709 -1.3407 0 0 0 0 0 -0.05782 0 -1.51697 0 0.79816 0.30756 0.18287 -1.12176
-VAL_609 -4.145 0.59469 0.95362 0.01763 0.03873 -0.15278 -1.05596 0 0 -0.41608 0 0 -0.05079 0.06733 -0.74401 0 2.64269 0.4285 0.25282 -1.56862
-ILE_610 -7.32778 0.962 1.52734 0.03297 0.08717 -0.14496 -1.32019 0 0 0 0 0 0.02574 0.68539 -0.29547 0 2.30374 -0.15241 0.46091 -3.15554
-GLU_611 -3.78671 0.25703 3.31204 0.00524 0.24388 0.1211 -2.74374 0 0 -0.36727 0 0 -0.00902 2.42601 0.10634 0 -2.72453 -0.0124 0.34808 -2.82397
-SER_612 -5.63849 0.63668 5.2719 0.00129 0.06851 0.07607 -3.44781 0 0 -0.36549 0 0 -0.00081 0.42133 -0.12657 0 -0.28969 0.02924 0.27552 -3.08832
-GLU:CtermProteinFull_613 -4.11875 0.12115 5.20104 0.00547 0.33721 -0.61239 -3.63707 0 0 0 0 0 0 3.35486 0 0 -2.72453 0.02728 0.30438 -1.74136
-SER:NtermProteinFull_614 -1.82817 0.0715 1.88527 0.00144 0.02329 -0.16688 -0.70461 0 0 0 0 0 0.02293 0.72721 0 0 -0.28969 0 0.03198 -0.22572
-ASP_615 -4.18252 0.43175 4.81514 0.00357 0.26368 0.12927 -5.08464 0 0 -0.86422 -0.51573 0 0.02781 3.37157 -0.11648 0 -2.14574 -0.10187 0.13918 -3.82922
-PHE_616 -8.77723 0.87076 3.01015 0.02471 0.44563 -0.13006 -2.17705 0 0 -1.27968 0 0 0.00032 1.06711 -0.58258 0 1.21829 -0.20423 0.35651 -6.15734
-VAL_617 -6.86066 0.41581 0.76006 0.0218 0.05474 0.04334 -2.06993 0 0 0 0 0 -0.00476 0.04972 -0.36 0 2.64269 -0.26387 0.34926 -5.22179
-VAL_618 -7.38245 0.98315 1.40062 0.01969 0.04783 0.17905 -2.26013 0 0 0 0 0 -0.00827 0.0437 -0.70975 0 2.64269 -0.33262 0.26602 -5.11047
-ILE_619 -8.23066 0.79995 0.40551 0.02791 0.08087 0.01295 -2.20432 0 0 0 0 0 0.01584 0.17696 -0.72904 0 2.30374 -0.33869 0.37499 -7.304
-LYS_620 -8.8221 1.09371 5.57497 0.01346 0.25716 0.33322 -4.00091 0 0 -0.36727 0 0 -0.05359 2.09169 0.31905 0 -0.71458 -0.07981 0.62822 -3.72677
-ALA_621 -6.87191 0.89463 2.05564 0.00209 0 -0.17664 -2.45138 0 0 0 0 0 0.07831 0 0.09203 0 1.32468 -0.20699 0.65739 -4.60213
-LEU_622 -7.30269 0.9793 2.46712 0.02289 0.08911 -0.46779 -0.86913 0 0 0 0 0 0.03426 3.53428 -0.09042 0 1.66147 -0.38693 0.4974 0.16887
-GLU_623 -6.14774 0.43175 5.56101 0.00709 0.35575 0.01925 -2.18883 0 0 -0.93526 0 0 -0.01039 2.58118 0.08001 0 -2.72453 -0.04199 0.43347 -2.57923
-ASP_624 -3.61404 0.18398 3.84434 0.00507 0.28514 0.0032 -3.00353 0 0 -0.88358 0 0 -0.01715 1.53392 0.05919 0 -2.14574 -0.15885 0.31535 -3.59272
-GLY_625 -1.7545 0.02324 2.17616 0.00011 0 0.02161 -1.41691 0 0 -0.89211 0 0 -0.09379 0 -1.30509 0 0.79816 -0.44438 0.47855 -2.40894
-VAL_626 -7.56318 0.70085 2.10849 0.01441 0.0399 0.13698 -2.42735 0 0 0 0 0 0.0294 0.0869 -0.40101 0 2.64269 -0.48714 0.52702 -4.59203
-ASN_627 -5.90459 0.25139 4.73974 0.00822 0.45744 -0.07928 -1.91226 0 0 0 0 0 0.02151 1.93914 -0.04958 0 -1.34026 -0.16496 0.32829 -1.70521
-VAL_628 -6.97069 0.49992 1.35356 0.01777 0.04475 0.21411 -2.14346 0 0 0 0 0 0.25465 0.02414 -0.51938 0 2.64269 -0.06452 0.37479 -4.27168
-ILE_629 -7.725 0.77287 3.59714 0.0292 0.07027 -0.12017 -2.14306 0 0 0 0 0 -0.00131 0.30671 -0.76779 0 2.30374 -0.38177 0.41004 -3.64913
-GLY_630 -4.15078 0.23041 2.87546 2e-05 0 0.00659 -3.07933 0 0 0 0 0 -0.06118 0 1.07264 0 0.79816 0.47076 0.31332 -1.52392
-LEU_631 -7.96986 0.57554 3.0306 0.01694 0.07268 -0.19862 -3.17404 0 0 0 0 0 0.36804 1.83659 -0.31292 0 1.66147 0.65756 0.32991 -3.1061
-THR_632 -5.92242 0.63796 5.11108 0.00624 0.09423 -0.04797 -2.79381 0 0 -1.24768 0 0 0.1228 0.5417 0.33762 0 1.15175 -0.10448 0.96504 -1.14791
-ARG_633 -7.31847 0.40086 7.42159 0.01914 0.56567 -0.14475 -3.87273 0 0 -0.93483 -0.62655 0 -0.03054 2.11612 0.01888 0 -0.09474 -0.09766 0.95862 -1.61939
-GLY_634 -2.09994 0.24962 1.93069 0.00013 0 -0.41776 0.37276 0 0 0 0 0 -0.05943 0 -1.51793 0 0.79816 0.33665 0.19187 -0.21518
-ALA_635 -1.95082 0.06483 1.73812 0.00142 0 -0.22018 0.46553 0 0 0 0 0 -0.03723 0 -0.3663 0 1.32468 0.08586 0.04251 1.14841
-ASP_636 -2.8053 0.22386 3.7453 0.00355 0.29251 -0.19879 -1.67413 0 0 -0.47937 -0.52652 0 0.04859 2.45832 -0.03139 0 -2.14574 -0.2645 0.19967 -1.15392
-THR_637 -3.69959 0.30807 2.3596 0.01041 0.05921 -0.5467 -0.22669 0 0 0 0 0 -0.01694 0.04334 0.03807 0 1.15175 0.07911 0.35038 -0.08995
-ARG_638 -4.87907 0.31985 4.81677 0.01714 0.57939 0.08469 -2.90962 0 0 -0.76831 -0.52652 0 -0.00383 2.23956 -0.0712 0 -0.09474 0.04402 0.64411 -0.50775
-PHE_639 -4.04174 0.4104 1.56506 0.02982 0.53203 -0.19119 -0.38567 0 0 0 0 0 0.15661 4.14419 -0.00744 0 1.21829 -0.17859 0.84969 4.10145
-HIS_640 -5.98693 0.36157 4.18523 0.00564 0.70305 -0.27934 -0.66619 0 0 0 -1.00925 0 0.00085 3.18129 -0.43985 0 -0.30065 0.18168 0.59895 0.53605
-HIS_641 -6.31197 0.32354 5.66419 0.00437 0.32532 -0.18289 -2.05669 0 0 0 -0.62495 0 -0.00915 1.45759 -0.46607 0 -0.30065 0.39954 0.33141 -1.4464
-SER_642 -3.37851 0.12683 2.76374 0.00172 0.02852 -0.25718 -0.77645 0 0 0 0 0 -0.06417 0.83233 0.38847 0 -0.28969 0.31252 0.15574 -0.15614
-GLU_643 -5.84947 0.24974 6.28254 0.0062 0.47527 0.40003 -4.94908 0 0 0 -1.32728 0 -0.02382 4.13287 0.32668 0 -2.72453 0.3795 0.17675 -2.44462
-LYS_644 -3.22484 0.11665 3.00544 0.00626 0.11079 -0.15967 -1.42529 0 0 0 0 0 0.10392 1.05602 0.08777 0 -0.71458 0.0523 0.34264 -0.64259
-LEU_645 -8.39156 0.56946 2.89807 0.01276 0.05207 -0.19194 -2.16842 0 0 0 0 0 0.02783 0.34803 -0.0074 0 1.66147 -0.04655 0.43299 -4.80319
-ASP_646 -6.94683 0.70069 7.98231 0.00339 0.2393 -0.56132 -6.50723 0 0 -2.06045 0 0 0.59905 2.54165 0.24618 0 -2.14574 0.17823 1.22798 -4.50279
-LYS_647 -5.31708 0.24558 4.68665 0.01231 0.25307 -0.55739 -1.74927 0 0 -0.88358 0 0 -0.03819 1.67401 -0.02688 0 -0.71458 0.02568 1.18445 -1.20521
-GLY_648 -3.88937 0.1073 3.38843 5e-05 0 0.02054 -2.38917 0 0 0 0 0 0.00314 0 -1.47183 0 0.79816 -0.57474 0.38554 -3.62196
-GLU_649 -8.11161 0.76353 8.71189 0.01474 0.34314 -0.66228 -4.86169 0 0 -0.60997 -0.08273 0 0.36045 2.71869 -0.0073 0 -2.72453 -0.50585 0.97219 -3.68132
-VAL_650 -7.45355 0.6826 1.23655 0.0201 0.0445 0.04333 -1.93671 0 0 0 0 0 0.09426 0.03794 -0.7842 0 2.64269 -0.24431 1.06573 -4.55106
-LEU_651 -7.54224 0.54166 1.48483 0.01762 0.10699 0.0454 -2.2905 0 0 0 0 0 0.07316 0.41298 -0.22028 0 1.66147 -0.1106 0.43899 -5.3805
-ILE_652 -8.17843 0.9376 0.58316 0.02526 0.08254 0.23019 -2.03484 0 0 0 0 0 0.08243 0.34907 -0.71004 0 2.30374 -0.14062 0.79443 -5.67551
-ALA_653 -4.59343 0.4657 1.77277 0.00151 0 0.18332 -2.08157 0 0 0 0 0 -0.00115 0 -0.15159 0 1.32468 -0.06154 0.93523 -2.20606
-GLN_654 -7.47233 0.58699 4.97329 0.0064 0.17148 -0.23317 -2.87609 0 0 0 -0.66135 0 0.36704 2.42708 -0.07943 0 -1.45095 0.06099 0.59597 -3.5841
-PHE_655 -9.09888 0.77258 2.35504 0.02225 0.25145 -0.73885 -1.38967 0 0 0 0 0 0.60436 1.66521 -0.19622 0 1.21829 -0.2701 0.94033 -3.86419
-THR_656 -5.80187 0.76746 5.80349 0.00937 0.0693 0.06013 -1.58401 0 0 -2.57554 0 0 0.06496 0.44034 -0.77683 0 1.15175 -0.0688 0.94754 -1.49271
-GLU_657 -2.7561 0.1794 2.34883 0.00546 0.27652 -0.36179 0.23126 0 0 0 0 0 -0.06133 2.71755 -0.28074 0 -2.72453 -0.2112 0.39701 -0.23967
-HIS_658 -6.06984 0.77544 5.05431 0.0035 0.43549 -0.73819 -1.42221 0 0 -0.90693 0 0 0.05346 2.15707 -0.3419 0 -0.30065 -0.11801 0.2606 -1.15786
-THR_659 -6.99907 0.20401 5.32813 0.01242 0.0668 0.02204 -1.25553 0 0 -0.73377 -1.00925 0 -0.03121 0.01726 0.13941 0 1.15175 0.32348 0.42045 -2.34309
-SER_660 -5.3973 0.23395 4.56919 0.00185 0.05387 -0.22638 -2.01159 0 0 0 0 0 0.03226 0.2177 -0.02973 0 -0.28969 0.12929 0.38037 -2.3362
-ALA_661 -5.60418 0.55939 1.67626 0.00123 0 0.06386 -1.50843 0 0 0 0 0 -0.00238 0 -0.48767 0 1.32468 0.01514 0.27343 -3.68867
-ILE_662 -7.22988 0.4454 1.26326 0.02094 0.06878 0.03186 -2.3935 0 0 0 0 0 -0.05535 0.17298 -0.7448 0 2.30374 -0.17541 0.27105 -6.02093
-LYS_663 -7.60664 0.55905 6.89568 0.00921 0.20545 0.15744 -5.49395 0 0 0 -0.79612 0 -0.02816 2.7182 0.31763 0 -0.71458 -0.13952 0.58684 -3.32948
-VAL_664 -6.61508 0.47401 0.79406 0.02015 0.04451 0.04813 -1.91695 0 0 0 0 0 -0.04942 0.15984 -0.74502 0 2.64269 -0.15036 0.59397 -4.69947
-ARG_665 -4.7743 0.20526 4.60788 0.01811 0.46988 0.38239 -3.44721 0 0 0 -1.07076 0 -0.01332 1.95017 0.14775 0 -0.09474 -0.13794 0.39886 -1.35797
-GLY_666 -3.62418 0.07923 2.63088 0.0002 0 -0.0231 -1.70621 0 0 -0.455 0 0 0.03314 0 -1.49428 0 0.79816 0.16735 0.38709 -3.20673
-LYS_667 -7.20122 0.86214 5.16176 0.00744 0.13487 -0.08612 -2.92861 0 0 -0.93526 0 0 -0.05467 1.19626 0.02726 0 -0.71458 -0.1061 0.31771 -4.31911
-ALA_668 -6.65755 0.63962 2.73217 0.00133 0 0.42867 -1.3538 0 0 0 0 0 -0.0053 0 -0.45813 0 1.32468 -0.16916 0.32769 -3.18979
-TYR_669 -7.77036 0.79341 3.91508 0.02218 0.15251 0.24192 -2.53286 0 0 0 -0.98293 0 -0.01726 2.07691 0.03459 0.00266 0.58223 -0.01354 0.34209 -3.15337
-ILE_670 -8.94899 1.19748 1.49377 0.02865 0.07063 0.04066 -1.9993 0 0 0 0 0 0.05036 0.31625 -0.72541 0 2.30374 -0.23467 0.40408 -6.00275
-GLN_671 -8.33838 0.72213 5.21236 0.00567 0.19132 -0.03424 -2.9416 0 0 -0.41608 -0.98293 0 -0.041 3.05046 0.32956 0 -1.45095 -0.12046 0.42921 -4.38493
-THR_672 -6.64241 0.6796 3.65973 0.00946 0.07781 -0.39694 -0.94829 0 0 -0.95933 0 0 0.05252 0.47506 -0.71237 0 1.15175 -0.0085 0.5384 -3.02352
-ARG_673 -4.92855 0.45807 4.51673 0.01636 0.3724 -0.31356 -1.08461 0 0 0 -0.51573 0 0.02126 2.84432 -0.1015 0 -0.09474 -0.24139 0.57333 1.52239
-HIS_674 -7.62328 0.6869 5.25644 0.00695 0.51138 -0.7735 -1.00119 0 0 -1.43981 0 0 -0.03792 3.35272 -0.41759 0 -0.30065 -0.39349 0.42095 -1.75209
-GLY_675 -2.44132 0.15967 2.84284 7e-05 0 -0.12226 -1.42841 0 0 0 0 0 0.00781 0 -1.51436 0 0.79816 0.50682 0.3413 -0.8497
-VAL_676 -3.63162 0.29751 1.41926 0.01777 0.05297 0.00748 -1.14268 0 0 -0.38131 0 0 -0.01685 0.00499 -0.36265 0 2.64269 0.55353 0.45915 -0.07977
-ILE_677 -6.90917 0.7104 1.54486 0.02335 0.07921 -0.01226 -1.34559 0 0 0 0 0 -0.02111 2.17819 0.05633 0 2.30374 -0.06763 0.66631 -0.79337
-GLU_678 -4.15979 0.45802 3.31837 0.00593 0.27415 0.1814 -2.32724 0 0 -0.3697 0 0 -0.00097 2.76395 0.32293 0 -2.72453 0.22776 0.50172 -1.528
-SER_679 -6.2887 0.5652 5.55401 0.00163 0.07174 0.167 -3.11799 0 0 -0.455 0 0 0.03221 0.14612 -0.34385 0 -0.28969 -0.0965 0.58085 -3.47297
-GLU_680 -4.83821 0.32635 4.83376 0.00456 0.21925 -0.03746 -2.6018 0 0 0 -0.88857 0 -0.00617 3.34886 0.1289 0 -2.72453 -0.13321 0.57316 -1.79509
-GLY:CtermProteinFull_681 -1.32601 0.04084 1.4037 0.00011 0 -0.08083 -0.479 0 0 0 0 0 0 0 0 0 0.79816 0.09772 0.11919 0.57387
-SER:NtermProteinFull_682 -2.16956 0.03738 2.40393 0.00141 0.02357 0.0396 -0.82394 0 0 -0.66657 0 0 -0.00252 0.72725 0 0 -0.28969 0 0.06385 -0.65528
-ASP_683 -4.29509 0.24971 4.67455 0.00494 0.25773 0.01027 -4.27577 0 0 0 -0.44115 0 0.00055 1.59896 0.02222 0 -2.14574 -0.10603 0.13328 -4.31159
-PHE_684 -8.71939 0.94725 2.44224 0.02622 0.49303 -0.24729 -1.18293 0 0 -0.54602 0 0 -0.01097 1.21012 -0.49184 0 1.21829 -0.16944 0.21724 -4.81351
-VAL_685 -6.9419 0.43235 0.85984 0.02565 0.0559 0.1167 -1.94142 0 0 0 0 0 -0.00962 0.17256 -0.39024 0 2.64269 -0.17697 0.26874 -4.88572
-VAL_686 -7.89801 1.15192 1.50585 0.01961 0.05151 0.16 -2.17746 0 0 0 0 0 -0.03241 0.0035 -0.6376 0 2.64269 -0.26073 0.38302 -5.08812
-ILE_687 -8.12793 0.7761 0.59502 0.02462 0.07668 0.02345 -2.17933 0 0 0 0 0 -0.00744 0.21594 -0.7314 0 2.30374 -0.31539 0.38123 -6.96471
-LYS_688 -8.11559 0.41778 6.34113 0.01424 0.18819 0.59576 -5.64388 0 0 -0.37459 -0.82639 0 -0.04257 1.27175 0.32662 0 -0.71458 -0.117 0.40416 -6.27497
-ALA_689 -6.4105 0.68252 1.87686 0.0019 0 -0.06304 -2.26716 0 0 0 0 0 -0.01109 0 0.37503 0 1.32468 0.08793 0.43971 -3.96316
-LEU_690 -6.80169 0.58812 2.79738 0.02291 0.08973 -0.5081 -1.06801 0 0 0 0 0 0.04097 0.04049 -0.16058 0 1.66147 -0.16558 0.4043 -3.0586
-GLU_691 -6.01173 0.39077 5.27098 0.00785 0.39559 -0.18372 -1.9593 0 0 -0.86734 0 0 0.02511 2.42576 0.10696 0 -2.72453 -0.11026 0.40285 -2.83101
-ASP_692 -3.23734 0.18917 3.34839 0.00294 0.27152 -0.111 -2.47391 0 0 -0.901 0 0 0.05136 1.70696 0.06618 0 -2.14574 -0.12057 0.45813 -2.89491
-GLY_693 -2.02454 0.06464 2.29112 9e-05 0 -0.24085 -0.99326 0 0 0 0 0 -0.13463 0 -1.50655 0 0.79816 -0.20761 0.4601 -1.49334
-VAL_694 -8.13594 1.04984 2.15279 0.01662 0.04028 -0.0886 -2.10978 0 0 0 0 0 0.04003 0.12683 -0.36312 0 2.64269 -0.2288 0.42581 -4.43136
-ASN_695 -6.10196 0.36233 4.73866 0.00398 0.25941 -0.49944 -2.2691 0 0 0 0 0 -0.02845 1.95747 0.28535 0 -1.34026 -0.06601 0.3791 -2.31892
-VAL_696 -6.67518 0.52123 0.89844 0.01734 0.04419 0.09241 -2.13838 0 0 0 0 0 0.17723 0.0243 -0.59392 0 2.64269 0.01084 0.31761 -4.66121
-ILE_697 -8.3371 0.9029 2.95796 0.02797 0.1081 -0.07707 -2.26613 0 0 0 0 0 0.01326 2.49632 -0.77057 0 2.30374 -0.39238 0.34992 -2.68307
-GLY_698 -4.27558 0.25973 2.93742 2e-05 0 -0.03172 -3.10374 0 0 0 0 0 -0.06805 0 1.11841 0 0.79816 0.50576 0.29117 -1.56843
-LEU_699 -8.25787 0.75379 3.03547 0.01792 0.07387 -0.23294 -2.96013 0 0 0 0 0 0.48829 1.86628 -0.30519 0 1.66147 0.69724 0.37478 -2.78702
-THR_700 -5.92516 0.60836 5.0099 0.00685 0.09441 -0.05029 -2.64985 0 0 -1.24007 0 0 0.0632 0.70329 0.25793 0 1.15175 -0.12515 1.00352 -1.09132
-ARG_701 -7.15715 0.33119 7.00527 0.01709 0.53829 -0.09496 -3.35021 0 0 -0.94079 -0.60424 0 -0.03413 2.15414 -0.03424 0 -0.09474 -0.18859 0.93131 -1.52177
-GLY_702 -2.06954 0.21949 1.91403 0.00011 0 -0.38247 0.34339 0 0 0 0 0 -0.04104 0 -1.51714 0 0.79816 0.25446 0.16618 -0.31438
-ALA_703 -2.18515 0.07766 1.88943 0.00148 0 -0.19075 0.35711 0 0 0 0 0 -0.05125 0 -0.35279 0 1.32468 0.09382 0.07272 1.03695
-ASP_704 -1.97193 0.15257 2.45171 0.00358 0.29259 -0.23471 -0.65768 0 0 -0.46221 0 0 -0.05268 3.0845 -0.41308 0 -2.14574 -0.33957 0.10559 -0.18707
-THR_705 -3.7737 0.25912 2.52132 0.00965 0.05805 -0.51979 -0.17077 0 0 0 0 0 -0.04992 0.02604 0.07022 0 1.15175 -0.00253 0.22403 -0.19653
-ARG_706 -5.23059 0.41599 4.73183 0.01885 0.50442 0.26332 -3.26499 0 0 -1.56057 0 0 0.03799 2.6094 -0.06148 0 -0.09474 0.11733 0.77782 -0.73542
-PHE_707 -4.10894 0.40011 2.18352 0.02624 0.60623 0.0866 -1.65064 0 0 -0.7827 0 0 -0.01072 2.97577 -0.24371 0 1.21829 -0.06883 0.79083 1.42205
-HIS_708 -5.97916 0.22883 4.45387 0.00612 0.71143 -0.24716 -0.43205 0 0 0 -0.93784 0 0.02127 3.09861 -0.43903 0 -0.30065 0.21059 0.3139 0.70872
-HIS_709 -6.37206 0.41785 5.66975 0.00449 0.31886 -0.06484 -1.80403 0 0 0 -0.92045 0 -0.0191 1.48934 -0.46895 0 -0.30065 0.37096 0.23789 -1.44095
-SER_710 -3.12809 0.16415 2.62226 0.00235 0.06878 -0.39431 -0.47044 0 0 0 0 0 -0.03631 0.18309 0.171 0 -0.28969 0.40417 0.16446 -0.5386
-GLU_711 -5.8168 0.22205 5.93745 0.00595 0.52615 0.28834 -4.04032 0 0 0 -0.92045 0 -0.06967 3.49231 0.26692 0 -2.72453 0.41952 0.23531 -2.17777
-LYS_712 -3.10493 0.22353 2.99867 0.01144 0.28359 -0.04262 -1.67709 0 0 0 0 0 -0.00992 2.7248 -0.00971 0 -0.71458 -0.05078 0.26919 0.90159
-LEU_713 -8.62244 0.99615 3.23299 0.01248 0.05779 -0.07841 -3.04746 0 0 0 0 0 0.31804 0.3507 -0.07053 0 1.66147 -0.14917 0.35343 -4.98496
-ASP_714 -4.21932 0.23857 4.4973 0.0031 0.26647 -0.20555 -2.77456 0 0 0 0 0 0.01326 1.95542 0.17204 0 -2.14574 -0.02511 0.56313 -1.66098
-LYS_715 -5.13237 0.35487 4.29477 0.00818 0.14209 -0.46353 -1.95568 0 0 -0.901 0 0 -0.08892 1.00487 -0.00576 0 -0.71458 -0.20737 0.34295 -3.32148
-GLY_716 -3.75897 0.22085 3.24613 8e-05 0 -0.00086 -2.04083 0 0 0 0 0 -0.14129 0 -1.49421 0 0.79816 -0.52939 0.35948 -3.34086
-GLU_717 -7.63451 0.31797 8.51871 0.00447 0.20736 0.29605 -6.6736 0 0 0 -1.79238 0 -0.00454 3.12861 -0.04171 0 -2.72453 -0.48284 0.48512 -6.39582
-VAL_718 -7.38448 0.51379 1.45313 0.01673 0.04325 0.00323 -1.9442 0 0 0 0 0 -0.04678 0.10614 -0.77316 0 2.64269 -0.37218 0.27653 -5.46531
-LEU_719 -7.59416 0.44736 1.44137 0.01584 0.10052 0.01991 -2.18933 0 0 0 0 0 -0.01683 0.42323 -0.20601 0 1.66147 -0.13437 0.17766 -5.85334
-ILE_720 -8.20965 1.31764 0.70997 0.02608 0.07626 0.17064 -2.22548 0 0 0 0 0 0.18474 0.33479 -0.72003 0 2.30374 -0.13555 0.6105 -5.55635
-ALA_721 -4.60401 0.51495 1.85214 0.00152 0 0.16383 -2.11351 0 0 0 0 0 -0.00217 0 -0.08515 0 1.32468 -0.03339 0.81573 -2.16539
-GLN_722 -7.43421 0.50733 5.15949 0.00682 0.18115 -0.02567 -3.18234 0 0 -0.66657 -0.62328 0 0.39365 2.53431 -0.08872 0 -1.45095 0.06029 0.65991 -3.96879
-PHE_723 -8.94343 0.85996 2.26099 0.02312 0.24388 -0.73445 -1.35332 0 0 0 0 0 0.63193 1.63135 -0.18648 0 1.21829 -0.28546 0.83517 -3.79846
-THR_724 -5.63189 0.57041 5.65944 0.00784 0.06999 0.05468 -1.95789 0 0 -2.72091 0 0 0.18412 0.34675 -0.75264 0 1.15175 -0.12845 0.79667 -2.35013
-GLU_725 -2.98388 0.1855 2.62649 0.00857 0.41734 -0.42538 0.19949 0 0 0 0 0 -0.10363 3.36108 -0.30082 0 -2.72453 -0.20503 0.45954 0.51474
-HIS_726 -6.10078 0.60121 5.07589 0.00347 0.42708 -0.89679 -1.49214 0 0 -0.93193 0 0 0.04852 2.21478 -0.31642 0 -0.30065 -0.12737 0.29324 -1.50189
-THR_727 -6.99544 0.1741 5.24006 0.01169 0.06491 -0.02929 -1.1945 0 0 -0.84819 -0.93784 0 -0.03993 0.02262 0.0324 0 1.15175 0.23024 0.38422 -2.73321
-SER_728 -5.5101 0.24237 4.58528 0.00237 0.05304 -0.21582 -1.8486 0 0 0 0 0 0.10322 0.22052 -0.00823 0 -0.28969 0.13721 0.39951 -2.12891
-ALA_729 -5.67597 0.68652 1.68672 0.00116 0 0.10824 -1.68246 0 0 0 0 0 -0.01095 0 -0.39729 0 1.32468 0.08234 0.32038 -3.55662
-ILE_730 -7.52377 0.57973 1.30607 0.02427 0.07102 0.00745 -2.39249 0 0 0 0 0 -0.05701 0.19247 -0.74373 0 2.30374 -0.13202 0.21192 -6.15236
-LYS_731 -8.11737 0.64789 6.36683 0.00875 0.14214 -0.27195 -5.18373 0 0 0 -0.43072 0 0.00621 1.28648 0.29573 0 -0.71458 -0.16478 0.41111 -5.718
-VAL_732 -6.66469 0.39283 0.89274 0.01713 0.04144 -0.10629 -1.92763 0 0 0 0 0 -0.04485 0.21764 -0.77533 0 2.64269 -0.18669 0.50503 -4.99599
-ARG_733 -5.30088 0.30687 4.54212 0.01346 0.21016 0.11777 -2.73225 0 0 0 -0.42614 0 0.00028 2.48257 -0.05558 0 -0.09474 -0.24446 0.38443 -0.79639
-GLY_734 -3.57332 0.09192 2.78947 0.0002 0 -0.12266 -1.46303 0 0 -0.39679 0 0 -0.02526 0 -1.49022 0 0.79816 -0.00528 0.29874 -3.09807
-LYS_735 -6.0877 0.67329 4.49819 0.00869 0.16579 -0.22687 -2.799 0 0 -0.86734 0 0 -0.0366 1.12847 0.11772 0 -0.71458 0.03271 0.22317 -3.88405
-ALA_736 -6.28886 0.56822 2.34866 0.00141 0 0.26793 -1.37178 0 0 0 0 0 -0.00538 0 -0.53948 0 1.32468 -0.03479 0.25189 -3.47749
-TYR_737 -7.28151 0.50103 3.39119 0.02164 0.10473 0.23214 -2.18357 0 0 0 0 0 -0.02788 2.74127 -0.0078 0.00135 0.58223 -0.03635 0.31165 -1.64988
-ILE_738 -9.25975 1.00034 1.43351 0.02479 0.10982 0.02876 -2.24125 0 0 0 0 0 0.0536 2.37127 -0.74808 0 2.30374 -0.18975 0.35069 -4.76232
-GLN_739 -8.29708 0.65782 4.78215 0.00754 0.23274 -0.18266 -2.9745 0 0 -0.37771 0 0 -0.0268 3.19887 0.28777 0 -1.45095 -0.18498 0.48056 -3.84724
-THR_740 -6.5899 0.60722 3.6877 0.00928 0.07934 -0.39131 -0.79969 0 0 -0.9816 0 0 0.05442 0.39449 -0.66111 0 1.15175 -0.09868 0.64527 -2.89282
-ARG_741 -5.5796 0.37592 5.77397 0.02831 0.45167 -0.0044 -1.35608 0 0 0 -0.88782 0 -0.06343 4.83376 -0.07662 0 -0.09474 -0.25636 1.05787 4.20247
-HIS_742 -7.4348 0.53349 5.16071 0.00715 0.50003 -0.78914 -0.76633 0 0 -1.43804 0 0 -0.00933 2.7803 -0.36971 0 -0.30065 -0.43547 0.85852 -1.70327
-GLY_743 -2.467 0.14639 2.86337 0.0001 0 -0.0914 -1.32533 0 0 0 0 0 -0.05954 0 -1.51753 0 0.79816 0.37123 0.18642 -1.09513
-VAL_744 -3.84418 0.29069 1.44903 0.024 0.05346 -0.0006 -1.16215 0 0 -0.43434 0 0 -0.01238 0.00166 -0.36113 0 2.64269 0.49067 0.15659 -0.70598
-ILE_745 -7.07911 0.68377 1.33107 0.03154 0.07602 0.09009 -1.55894 0 0 0 0 0 0.05901 0.25928 0.26411 0 2.30374 0.04737 0.38311 -3.10895
-GLU_746 -4.09356 0.31403 2.59562 0.0055 0.25885 0.05778 -1.7721 0 0 0 0 0 -0.00508 2.41858 0.1386 0 -2.72453 0.24785 0.38625 -2.17221
-SER_747 -5.80796 0.44325 4.94158 0.00166 0.07688 0.11705 -3.26252 0 0 -0.39679 0 0 -0.01197 0.27911 -0.15813 0 -0.28969 0.04835 0.2862 -3.73297
-GLU_748 -3.96022 0.21403 3.58999 0.00564 0.24471 -0.18034 -1.27165 0 0 0 0 0 0.00297 2.57123 -0.00199 0 -2.72453 0.00305 0.25627 -1.25085
-GLY:CtermProteinFull_749 -1.10807 0.05759 1.12878 0.00014 0 -0.07036 -0.26614 0 0 0 0 0 0 0 0 0 0.79816 0.0013 0.0763 0.61769
-GLU:NtermProteinFull_750 -1.54263 0.0457 1.25606 0.00661 0.34656 -0.0827 -0.49026 0 0 0 0 0 -0.01156 2.58619 0 0 -2.72453 0 0.02399 -0.58658
-VAL_751 -6.08357 0.8555 0.52003 0.0241 0.0461 -0.49092 -0.4556 0 0 0 0 0 -0.06918 0.14163 -0.16281 0 2.64269 -0.2878 0.18155 -3.13827
-GLN_752 -4.2847 0.2812 3.18462 0.01338 0.37076 0.11848 -1.58724 0 0 0 0 0 0.03359 4.46512 -0.03926 0 -1.45095 -0.11922 0.35121 1.33698
-LEU_753 -8.49092 0.84031 0.95424 0.01572 0.06283 -0.40232 -0.70625 0 0 0 0 0 0.02602 0.70095 -0.25554 0 1.66147 0.18428 0.52423 -4.88497
-VAL_754 -5.03577 0.35344 2.99638 0.02413 0.055 -0.02516 -2.56914 0 0 0 0 0 0.00955 0.0182 -0.52337 0 2.64269 0.00835 0.466 -1.57969
-GLU_755 -8.36533 0.74071 9.40274 0.01643 1.08574 0.35356 -5.67282 0 0 -2.58789 0 0 0.09605 4.77257 -0.05549 0 -2.72453 -0.14111 0.41762 -2.66176
-SER_756 -2.95803 0.08149 3.42907 0.00133 0.0658 0.11161 -1.29462 0 0 0 0 0 -0.00797 0.05656 -0.54275 0 -0.28969 -0.2844 0.33102 -1.30058
-GLY_757 -2.08006 0.21727 1.21768 0.0001 0 -0.01929 0.33854 0 0 0 0 0 -0.14861 0 -1.49865 0 0.79816 -0.06727 0.15471 -1.08741
-GLY_758 -2.37561 0.39763 0.65872 0.00012 0 -0.11065 -0.19307 0 0 0 0 0 -0.05672 0 -1.0267 0 0.79816 0.14207 0.15161 -1.61443
-GLY_759 -2.35088 0.05745 2.13518 4e-05 0 0.09683 -1.70133 0 0 0 0 0 -0.0383 0 -1.51645 0 0.79816 0.43032 0.19512 -1.89386
-LEU_760 -3.39917 0.37905 0.85322 0.02037 0.0954 -0.2145 -0.2941 0 0 0 0 0 -0.04396 0.4845 -0.31202 0 1.66147 0.2936 0.33618 -0.13995
-VAL_761 -7.06475 1.02508 1.41143 0.02266 0.04536 -0.09299 -1.64763 0 0 0 0 0 0.13412 0.04071 -0.78496 0 2.64269 -0.25794 0.48541 -4.0408
-GLN_762 -2.91181 0.55437 2.18323 0.00747 0.19268 -0.19015 -1.5708 0 0 0 0 0 -0.02492 2.52479 0.05841 0 -1.45095 -0.34355 1.24565 0.27441
-PRO_763 -4.07184 0.83874 1.99503 0.00291 0.0702 -0.27932 -0.63352 0 0 0 0 0 -0.09806 0.1406 -0.93536 0 -1.64321 -0.18113 1.23024 -3.56473
-GLY_764 -2.16108 0.06843 2.07686 6e-05 0 -0.04535 -1.3136 0 0 0 0 0 -0.12573 0 -1.46054 0 0.79816 -0.45302 0.34847 -2.26735
-GLY_765 -3.05024 0.1891 3.24976 6e-05 0 -0.02372 -2.55277 0 0 0 0 0 -0.05859 0 -0.98277 0 0.79816 -0.41784 0.14107 -2.70778
-SER_766 -3.25748 0.26921 2.43038 0.00124 0.02285 -0.03284 -1.08152 0 0 0 -0.76023 0 0.01301 0.72347 -0.24906 0 -0.28969 0.0041 0.38732 -1.81925
-LEU_767 -6.99874 0.74584 1.81372 0.01995 0.07078 0.02877 -1.73165 0 0 0 0 0 -0.03154 0.37117 -0.07564 0 1.66147 0.27746 0.43411 -3.41429
-ARG_768 -5.94271 0.35451 3.80204 0.01235 0.23546 -0.63186 -0.61039 0 0 0 0 0 -0.02608 2.26074 0.19045 0 -0.09474 0.33851 0.209 0.09727
-LEU_769 -8.2778 0.73013 1.32372 0.02234 0.05842 0.02904 -2.38326 0 0 0 0 0 0.00502 0.07999 -0.36588 0 1.66147 -0.08919 0.19265 -7.01335
-SER_770 -4.67327 0.4163 4.06996 0.00308 0.05616 0.17293 -2.15677 0 0 0 0 0 -0.01552 0.53487 0.30838 0 -0.28969 -0.03872 0.26003 -1.35227
-CYS:disulfide_771 -6.64539 0.71586 2.90663 0.00449 0.04904 -0.02578 -2.53608 0 0 0 0 -0.57398 -0.03099 0.53832 -0.07631 0 3.25479 0.62416 0.85286 -0.94239
-ALA_772 -3.86318 0.22349 2.65371 0.0013 0 0.20564 -2.03243 0 0 0 0 0 -0.0275 0 0.154 0 1.32468 0.49434 0.67166 -0.19429
-ALA_773 -3.89629 0.43453 1.10359 0.00155 0 -0.12807 -1.12243 0 0 0 0 0 0.04888 0 0.15189 0 1.32468 0.13033 0.42664 -1.5247
-SER_774 -3.1269 0.18387 3.09277 0.00179 0.04757 0.04251 -1.36576 0 0 0 0 0 0.02988 0.41282 -0.24211 0 -0.28969 0.16087 0.26247 -0.78991
-GLY_775 -1.32352 0.04334 0.65512 6e-05 0 -0.10424 0.01404 0 0 0 0 0 -0.13512 0 -1.49658 0 0.79816 -0.32636 0.09574 -1.77937
-PHE_776 -7.59923 1.02487 1.58714 0.02531 0.50215 0.23378 -0.7639 0 0 -0.7545 0 0 0.02146 1.81249 -0.47739 0 1.21829 -0.46192 0.20342 -3.42804
-ASN_777 -5.10769 0.64179 4.74388 0.00494 0.29903 -0.48614 -1.61585 0 0 0 -0.66375 0 -0.01257 2.02479 0.24879 0 -1.34026 -0.098 0.60207 -0.75897
-ILE_778 -9.01547 1.22675 2.70366 0.02285 0.07379 -0.49947 -0.51571 0 0 -1.07405 0 0 -0.0024 0.85475 0.29294 0 2.30374 -0.09298 0.74023 -2.98138
-LYS_779 -5.81231 0.70741 5.99359 0.01264 0.32016 -0.20773 -2.11735 0 0 0 -0.74269 0 -0.02855 2.27343 -0.02413 0 -0.71458 -0.41915 0.53148 -0.22779
-ASP_780 -4.07405 0.55918 6.2 0.00379 0.31553 -0.05372 -5.48883 0 0 -0.25714 -1.40644 0 -0.02934 1.92681 -0.22197 0 -2.14574 -0.54706 0.50862 -4.71037
-THR_781 -6.54771 1.56938 3.59613 0.00359 0.03244 -0.28819 -1.56106 0 0 -1.33792 0 0 0.00137 4.84052 -0.52419 0 1.15175 -0.27303 1.84085 2.50393
-TYR_782 -8.71368 1.31368 4.44999 0.03305 0.27883 -0.20335 -3.01657 0 0 0 -0.72973 0 -0.00136 2.01746 -0.04687 0.01236 0.58223 -0.06664 1.98067 -2.10993
-ILE_783 -7.20284 0.42541 1.59639 0.02586 0.07873 -0.03958 -2.26001 0 0 0 0 0 -0.02206 0.97548 -0.75006 0 2.30374 -0.28556 0.63496 -4.51952
-HIS_784 -9.99043 0.37463 6.21751 0.00504 0.35877 -0.12887 -2.60723 0 0 0 -1.04584 0 0.40818 2.0054 -0.05308 0 -0.30065 -0.27179 0.49701 -4.53137
-TRP_785 -12.1264 0.78998 3.65646 0.01897 0.25958 -0.37734 -3.20299 0 0 0 0 0 -0.04489 1.3495 0.13487 0 2.26099 0.20508 0.63875 -6.43741
-VAL_786 -8.10657 0.51598 1.49175 0.01266 0.03754 -0.04259 -2.03476 0 0 0 0 0 -0.05648 0.15928 -0.72121 0 2.64269 0.10403 0.69082 -5.30686
-ARG_787 -9.69686 0.97897 6.9271 0.01607 0.3644 0.58565 -5.54164 0 0 0 -2.64695 0 0.02058 2.42893 -0.1902 0 -0.09474 -0.22238 0.58813 -6.48294
-GLN_788 -8.09143 0.46944 6.2132 0.01055 0.28719 0.57797 -5.27193 0 0 -0.6965 -2.82857 0 0.02508 2.72897 0.03272 0 -1.45095 0.40544 0.58025 -7.00857
-ALA_789 -3.97306 0.68838 2.41577 0.00138 0 0.01172 -1.36071 0 0 0 0 0 -0.0209 0 -0.14658 0 1.32468 0.13057 1.4689 0.54015
-PRO_790 -2.62229 0.47444 1.20806 0.0031 0.07277 -0.227 0.11038 0 0 0 0 0 -0.05438 0.11308 -0.7134 0 -1.64321 -0.4441 1.35641 -2.36613
-GLY_791 -1.12903 0.05596 1.14328 6e-05 0 -0.0809 -0.27217 0 0 0 0 0 -0.09906 0 -1.39859 0 0.79816 -0.56397 0.36749 -1.17877
-LYS_792 -3.74379 0.34485 3.29155 0.0127 0.27699 -0.11199 -1.57564 0 0 -0.6965 0 0 -0.00538 1.20466 0.04237 0 -0.71458 -0.25671 0.26901 -1.66246
-GLY_793 -2.63999 0.14727 1.91107 0.00011 0 -0.13079 -0.14054 0 0 0 0 0 -0.04617 0 -0.83548 0 0.79816 0.20877 0.16566 -0.56191
-LEU_794 -7.59028 0.5894 -0.08093 0.01763 0.06135 -0.52667 -0.49196 0 0 0 0 0 -0.01583 0.25941 -0.27164 0 1.66147 -0.18848 0.19303 -6.38351
-GLU_795 -4.7811 0.15934 4.84565 0.00566 0.30087 0.49465 -3.43775 0 0 0 -1.07958 0 -0.02514 3.11744 0.1119 0 -2.72453 -0.00576 0.27149 -2.74684
-TRP_796 -11.6555 1.07149 3.19781 0.02348 0.12986 -0.28631 -0.49312 0 0 0 -1.04584 0 0.00482 2.05028 -0.19344 0 2.26099 -0.09581 0.44317 -4.58817
-VAL_797 -8.11603 0.7684 1.18523 0.0263 0.05344 0.02885 -2.11514 0 0 0 0 0 0.04748 0.0014 -0.51996 0 2.64269 -0.20394 0.61561 -5.58567
-ALA_798 -6.30443 0.46015 1.59726 0.00136 0 0.12808 -1.94819 0 0 0 0 0 0.1344 0 -0.52318 0 1.32468 0.09065 0.56122 -4.478
-ARG_799 -9.36709 0.8023 7.04029 0.02487 0.38539 -0.30767 -3.67549 0 0 0 -0.60387 0 -0.00959 3.03695 -0.09813 0 -0.09474 -0.01999 15.9563 13.0696
-ILE_800 -9.13257 1.11222 1.32184 0.03147 0.08989 -0.07345 -2.29422 0 0 0 0 0 0.18051 0.35363 -0.04088 0 2.30374 0.00753 16.061 9.92065
-TYR_801 -10.0439 1.11597 5.37674 0.06946 0.29245 -0.33939 -2.49363 0 0 0 0 0 0.60147 3.14726 -0.22078 0.00109 0.58223 0.48831 1.60861 0.18591
-PRO_802 -6.28123 0.9442 2.13086 0.00278 0.03633 -0.28275 0.35169 0 0 0 0 0 0.01359 0.32177 -0.62927 0 -1.64321 0.38993 2.28185 -2.36344
-THR_803 -4.7419 0.46186 3.65943 0.01885 0.06899 -0.33362 -0.11974 0 0 0 0 0 -0.03457 0.07575 0.14379 0 1.15175 -0.02667 1.508 1.8319
-ASN_804 -6.3862 0.4968 5.06397 0.00944 0.54446 -0.62964 -0.62868 0 0 -0.7165 0 0 0.32716 1.67203 -0.21097 0 -1.34026 0.23107 0.69201 -0.87532
-GLY_805 -2.89225 0.1593 2.14004 0.0001 0 -0.11847 -0.60352 0 0 0 0 0 -0.1189 0 -1.21134 0 0.79816 -0.20176 0.44757 -1.60106
-TYR_806 -7.75348 0.73949 5.3044 0.03825 0.24657 -0.65892 -2.10321 0 0 -0.7165 0 0 0.201 3.80651 -0.04824 0.29476 0.58223 -0.61042 0.79087 0.1133
-THR_807 -5.40511 0.92866 2.99418 0.00893 0.0898 -0.29802 -1.90771 0 0 0 -0.73651 0 0.32594 0.16255 -0.26323 0 1.15175 -0.37714 1.7137 -1.61221
-ARG_808 -7.46748 0.64726 5.96343 0.03471 0.53901 0.09867 -2.49793 0 0 0 -0.51788 0 0.00322 10.118 -0.23023 0 -0.09474 -0.29527 17.826 24.1267
-TYR_809 -9.28786 1.00768 3.61901 0.04072 0.40867 -0.28263 -1.15331 0 0 -1.18033 -0.73651 0 0.01916 1.83348 -0.21981 0.14464 0.58223 -0.22596 17.3822 11.9514
-ALA_810 -4.97897 0.52631 3.24544 0.00128 0 0.11637 -2.93349 0 0 0 0 0 0.00359 0 -0.1735 0 1.32468 -0.4972 0.86225 -2.50323
-ASP_811 -1.88657 0.12616 1.94824 0.00343 0.29956 -0.15446 0.50505 0 0 0 0 0 -0.09312 1.36225 -0.01476 0 -2.14574 -0.44025 0.28506 -0.20515
-SER_812 -2.4238 0.29233 2.66128 0.00191 0.05882 -0.03327 -0.6919 0 0 -0.67899 0 0 -0.03157 0.13235 -0.31136 0 -0.28969 -0.36995 0.30278 -1.38105
-VAL_813 -8.19204 1.03285 2.48454 0.01598 0.04285 -0.2086 -2.33607 0 0 0 0 0 0.00388 0.08715 -0.15809 0 2.64269 -0.19902 0.35908 -4.4248
-LYS_814 -4.06998 0.24798 3.23946 0.00889 0.13538 -0.21308 -0.16142 0 0 0 0 0 -0.04102 1.0577 0.00099 0 -0.71458 -0.16541 0.22769 -0.4474
-GLY_815 -1.18312 0.07359 1.14829 6e-05 0 -0.03059 0.1756 0 0 0 0 0 -0.12167 0 -1.49437 0 0.79816 -0.61604 0.09217 -1.15793
-ARG_816 -7.5959 0.66762 7.81037 0.02109 0.49939 0.52248 -5.55623 0 0 -1.05965 -1.57027 0 0.03015 2.34598 -0.19416 0 -0.09474 -0.14553 0.23537 -4.084
-PHE_817 -10.1353 1.33193 1.50098 0.03075 0.18725 -0.42834 -0.62054 0 0 0 0 0 0.16338 3.72644 -0.33244 0 1.21829 0.08031 0.48067 -2.79663
-THR_818 -4.01199 0.35809 3.1514 0.00931 0.05353 0.02039 -2.38284 0 0 0 0 0 -0.00903 0.13366 -0.17278 0 1.15175 -0.06255 0.40983 -1.35123
-ILE_819 -8.81211 1.80814 0.75844 0.06833 0.08462 -0.3847 -0.77872 0 0 -1.18033 0 0 0.04517 1.71819 -0.48654 0 2.30374 -0.00553 0.67508 -4.18621
-SER_820 -3.90704 0.39797 2.95455 0.00149 0.05635 0.03798 -1.92253 0 0 0 0 0 -0.01186 0.11721 -0.55532 0 -0.28969 -0.04154 0.65519 -2.50723
-ALA_821 -3.5741 0.24349 -0.16721 0.00137 0 -0.03571 -0.13333 0 0 0 0 0 -0.0063 0 -0.53453 0 1.32468 -0.00891 0.1808 -2.70975
-ASP_822 -6.16265 0.59844 8.72679 0.00961 0.75995 0.00853 -9.068 0 0 -0.43002 -0.72464 0 -0.02865 1.98544 -0.49314 0 -2.14574 0.04176 0.22939 -6.69295
-THR_823 -3.31333 0.15474 2.87521 0.01187 0.06639 -0.26675 0.39025 0 0 0 0 0 0.00099 0.05582 0.07872 0 1.15175 0.08002 0.27666 1.56233
-SER_824 -2.23482 0.12126 3.07289 0.00171 0.04929 -0.0485 -1.20319 0 0 0 -0.72464 0 0.23003 0.21272 0.01729 0 -0.28969 -0.2129 0.31371 -0.69486
-LYS_825 -4.68833 0.63559 6.4103 0.00863 0.22918 -0.53137 -4.01246 0 0 -0.43002 0 0 -0.0325 2.1716 -0.16103 0 -0.71458 -0.36961 0.43685 -1.04775
-ASN_826 -6.67776 0.45635 5.72603 0.01207 0.63124 -0.03908 -3.15087 0 0 -1.82855 0 0 -0.03932 1.82797 -0.97259 0 -1.34026 -0.37596 0.4647 -5.30602
-THR_827 -7.20368 0.62616 3.95082 0.00817 0.05111 -0.27345 -1.91173 0 0 0 0 0 0.05226 0.13086 -0.19465 0 1.15175 -0.19937 0.39801 -3.41374
-ALA_828 -5.25834 0.44364 1.79538 0.00123 0 0.18862 -2.38668 0 0 0 0 0 0.03797 0 0.13512 0 1.32468 0.15012 0.28056 -3.2877
-TYR_829 -9.72717 0.66912 5.29983 0.02453 0.29211 -0.47591 -2.03364 0 0 0 0 0 0.08415 1.44277 -0.29748 0.06665 0.58223 -0.02416 0.41802 -3.67895
-LEU_830 -9.18697 0.48989 1.71619 0.0152 0.09628 0.05495 -2.07525 0 0 0 0 0 -0.06952 0.37255 -0.14297 0 1.66147 0.01002 0.39627 -6.66188
-GLN_831 -6.56102 0.29898 5.79017 0.01282 0.48377 -0.26021 -2.5326 0 0 0 0 0 -0.05422 2.27235 0.25167 0 -1.45095 0.2978 0.24203 -1.20941
-MET_832 -10.6002 1.28833 2.2383 0.01713 0.11103 -0.05735 -2.33122 0 0 0 0 0 -0.01035 1.87775 0.1861 0 1.65735 0.45415 0.40395 -4.76501
-ASN_833 -4.88107 0.37089 4.83329 0.00383 0.20644 -0.22232 -2.10584 0 0 0 -0.76023 0 -0.00209 1.43978 0.25702 0 -1.34026 0.4429 0.3398 -1.41786
-SER_834 -3.89691 0.18018 4.173 0.00433 0.09534 -0.20459 -1.30306 0 0 -0.38066 0 0 -0.04887 1.11795 0.08496 0 -0.28969 0.29541 0.14056 -0.03207
-LEU_835 -9.02753 0.84548 2.4707 0.02762 0.03807 -0.4436 -2.98555 0 0 0 0 0 0.07399 0.80273 -0.10867 0 1.66147 -0.12041 0.47811 -6.28762
-ARG_836 -5.75018 0.50307 5.68483 0.01418 0.28824 -0.5592 -1.69743 0 0 -0.97631 0 0 -0.00174 2.07317 -0.04313 0 -0.09474 -0.20536 0.54147 -0.22314
-ALA_837 -2.52122 0.33846 2.03792 0.00142 0 -0.17861 -0.21411 0 0 0 0 0 -0.07107 0 -0.37313 0 1.32468 -0.22266 0.25309 0.37479
-GLU_838 -2.15299 0.30573 2.18028 0.00622 0.29235 -0.35821 0.2439 0 0 0 0 0 -0.04838 2.83474 -0.25869 0 -2.72453 -0.59084 0.19742 -0.07299
-ASP_839 -6.29401 0.41022 8.03858 0.00367 0.30839 0.40263 -7.28321 0 0 -0.97631 -2.32062 0 0.07954 2.41609 -0.29138 0 -2.14574 -0.65856 0.46541 -7.84528
-THR_840 -5.06629 0.61236 3.62927 0.01017 0.05778 -0.06906 -0.95966 0 0 -0.90961 0 0 -0.04106 0.14863 0.12744 0 1.15175 -0.37797 0.61639 -1.06987
-ALA_841 -6.48443 0.75852 2.2072 0.0015 0 -0.08615 -1.59036 0 0 0 0 0 0.28434 0 -0.42438 0 1.32468 0.18864 0.48465 -3.33579
-VAL_842 -7.37252 0.65379 2.67144 0.01592 0.04275 -0.07202 -2.41774 0 0 0 0 0 -0.06312 0.00702 -0.46047 0 2.64269 -0.03805 0.51532 -3.87498
-TYR_843 -11.3026 0.70792 3.09622 0.02079 0.18968 -0.04806 -2.65507 0 0 0 -0.81702 0 -0.01911 2.2266 -0.20644 0.03164 0.58223 -0.33228 0.40731 -8.11822
-TYR_844 -10.5908 0.7542 4.15531 0.02377 0.29302 -0.04611 -2.89473 0 0 0 -0.57406 0 0.20293 1.63279 -0.22575 0.0557 0.58223 -0.21513 0.58165 -6.26503
-CYS:disulfide_845 -6.29811 0.39498 2.85104 0.00235 0.02983 0.06551 -2.73965 0 0 -1.02622 0 -0.57398 -0.04308 0.43299 0.10391 0 3.25479 -0.07588 0.94622 -2.67529
-SER_846 -6.2922 0.43607 4.37782 0.00189 0.07224 -0.03492 -2.36209 0 0 0 0 0 0.08279 0.20096 -0.42854 0 -0.28969 -0.02696 0.41031 -3.85232
-ARG_847 -10.8793 1.02747 6.98014 0.04501 0.48677 0.19004 -3.19974 0 0 0 -1.3153 0 0.30262 4.14691 -0.22796 0 -0.09474 -0.18968 0.88691 -1.84086
-TRP_848 -10.6793 0.64871 5.40051 0.02663 0.26892 -0.31274 -0.75474 0 0 0 0 0 0.09882 2.44073 -0.13971 0 2.26099 0.32416 1.04027 0.62324
-GLY_849 -3.22904 0.36347 3.22948 2e-05 0 -0.13775 -1.10285 0 0 -0.57254 0 0 0.00635 0 1.03753 0 0.79816 0.79122 0.5907 1.77475
-GLY_850 -1.99319 0.05038 3.21575 2e-05 0 0.13945 -1.48026 0 0 -1.55731 0 0 -0.04621 0 -1.48008 0 0.79816 0.33842 0.56945 -1.44544
-ASP_851 -2.32265 0.26138 2.65304 0.00359 0.32169 -0.39447 -0.77406 0 0 0 0 0 -0.02471 1.65905 -0.15151 0 -2.14574 -0.02614 0.52583 -0.41471
-GLY_852 -1.08765 0.05441 0.74364 7e-05 0 -0.11409 -0.00688 0 0 0 0 0 -0.10978 0 0.54886 0 0.79816 0.20069 0.31205 1.33948
-PHE_853 -6.53083 1.41745 1.77276 0.02574 0.14884 -0.20667 0.56024 0 0 0 0 0 0.10096 2.41065 -0.23259 0 1.21829 0.55331 0.32394 1.56209
-TYR_854 -9.27402 1.57225 5.25544 0.04713 0.29391 -0.40163 -0.5743 0 0 -1.16468 0 0 0.00468 3.58731 -0.25516 0.11384 0.58223 0.22668 0.75979 0.77349
-ALA_855 -5.29021 0.49882 1.55473 0.00116 0 -0.20877 -0.21142 0 0 0 0 0 0.1459 0 0.12232 0 1.32468 -0.00816 0.66492 -1.40602
-MET_856 -9.73943 1.01641 3.9061 0.00552 0.07049 0.19868 -0.5898 0 0 -1.32042 0 0 -0.02476 1.56248 -0.00046 0 1.65735 0.4233 0.3616 -2.47293
-ASP_857 -6.21826 0.5731 6.37399 0.00209 0.43648 0.06406 -4.83728 0 0 -0.57254 -1.3153 0 0.14457 3.75441 -0.04803 0 -2.14574 0.13885 0.67 -2.9796
-TYR_858 -8.01277 0.78279 4.13683 0.02066 0.21446 -0.56733 -1.55473 0 0 0 0 0 -0.00209 1.45981 -0.17496 0.00472 0.58223 -0.25015 0.8583 -2.50223
-TRP_859 -11.0061 0.76653 1.93781 0.02039 0.26711 -0.0636 -0.79752 0 0 -0.34143 0 0 0.03704 1.67621 -0.1675 0 2.26099 -0.02663 0.77749 -4.65918
-GLY_860 -3.59665 0.54658 3.20066 0.00017 0 0.2397 -2.24403 0 0 0 0 0 -0.03813 0 -0.65482 0 0.79816 0.02396 0.45354 -1.27086
-GLN_861 -4.31321 0.19881 4.82649 0.01167 0.79908 0.03572 -1.45018 0 0 -0.80295 0 0 -0.04274 4.78657 -0.18114 0 -1.45095 -0.22362 0.56299 2.75655
-GLY_862 -3.67019 0.48299 2.64005 1e-05 0 -0.25961 -1.60021 0 0 -0.75872 0 0 -0.11339 0 -1.46082 0 0.79816 0.09663 0.55767 -3.28743
-THR_863 -5.56869 0.78334 4.12047 0.01426 0.05788 -0.1213 -2.19058 0 0 0 0 0 -0.03032 0.16143 -0.19073 0 1.15175 0.33867 0.26817 -1.20563
-LEU_864 -5.11149 0.4437 1.21241 0.01967 0.0961 -0.20102 -1.41533 0 0 0 0 0 0.17992 0.41639 -0.31157 0 1.66147 -0.0335 0.58133 -2.46191
-VAL_865 -7.39845 0.88117 1.00533 0.01702 0.04503 -0.02627 -1.87347 0 0 0 0 0 -0.05063 0.07634 -0.75656 0 2.64269 -0.26718 0.7618 -4.94319
-THR_866 -5.64991 0.53746 2.75211 0.01217 0.08739 -0.06529 -1.54674 0 0 0 0 0 0.20198 1.01129 -0.11094 0 1.15175 -0.18679 0.56337 -1.24214
-VAL_867 -7.1914 1.00278 0.84945 0.01633 0.04171 -0.45926 -0.71889 0 0 -0.90961 0 0 -0.03652 0.1185 -0.77832 0 2.64269 -0.19457 0.31889 -5.29823
-SER:CtermProteinFull_868 -2.67698 0.33648 2.54436 0.002 0.12878 -0.20092 -1.40774 0 0 0 0 0 0 0.06612 0 0 -0.28969 -0.19952 0.24453 -1.45259
-ASP:NtermProteinFull_869 -2.15469 0.08546 3.34857 0.00412 0.6926 -0.38324 -1.78908 0 0 0 -0.43271 0 0.01607 1.47689 0 0 -2.14574 0 0.24815 -1.03361
-ILE_870 -7.62369 0.69499 2.27786 0.02104 0.07623 -0.34552 -0.64567 0 0 0 0 0 -0.05 0.43211 -0.65767 0 2.30374 -0.25031 0.62194 -3.14495
-GLN_871 -4.84864 0.23447 5.1687 0.01161 0.92644 -0.27536 -2.86911 0 0 -1.06933 -0.43271 0 0.05278 3.64002 0.21399 0 -1.45095 -0.29734 0.55595 -0.43947
-MET_872 -8.72134 0.92687 2.18607 0.0189 0.1214 -0.59742 -1.07874 0 0 0 0 0 0.03299 2.53978 0.22528 0 1.65735 -0.05059 0.40049 -2.33896
-THR_873 -3.48951 0.20596 3.29617 0.00886 0.06418 0.10467 -1.77783 0 0 0 0 0 0.01087 0.05178 0.23714 0 1.15175 0.26322 0.36889 0.49614
-GLN_874 -8.07403 0.50063 4.77648 0.02694 0.29095 -0.42544 -0.20166 0 0 0 0 0 -0.02889 4.41589 0.24901 0 -1.45095 0.24693 0.29504 0.62091
-SER_875 -2.82971 0.44674 2.9341 0.00224 0.08123 -0.02195 -1.47217 0 0 0 0 0 0.0906 0.37633 -0.39801 0 -0.28969 0.11805 0.69678 -0.26545
-PRO_876 -3.66623 0.77684 2.72388 0.00365 0.11233 -0.24834 0.85812 0 0 0 0 0 0.02544 0.06856 -0.89016 0 -1.64321 0.01161 0.87998 -0.98753
-SER_877 -2.28121 0.20711 2.46295 0.00148 0.04933 -0.05144 -0.97974 0 0 0 0 0 0.12361 0.10054 -0.18597 0 -0.28969 -0.45321 0.49893 -0.79732
-SER_878 -3.30699 0.39471 2.79961 0.00215 0.08398 -0.26653 -0.3296 0 0 0 0 0 0.00685 0.26063 -0.48695 0 -0.28969 -0.42597 0.32804 -1.22975
-LEU_879 -6.14499 0.54544 1.43956 0.01913 0.23187 -0.05797 -1.78506 0 0 0 0 0 0.0233 1.05293 0.56971 0 1.66147 0.23872 0.2979 -1.90797
-SER_880 -2.87122 0.16006 2.08492 0.00135 0.02629 -0.37605 -0.5588 0 0 0 0 0 -0.02263 0.60266 0.41446 0 -0.28969 0.42937 0.26004 -0.13923
-ALA_881 -4.73464 0.4872 2.43238 0.00129 0 0.03936 -2.08196 0 0 0 0 0 0.05335 0 -0.5198 0 1.32468 0.07497 0.23365 -2.6895
-SER_882 -5.20497 0.47646 5.81134 0.00159 0.02207 -0.44382 -4.88189 0 0 -0.73033 0 0 0.0712 1.12977 -0.22082 0 -0.28969 -0.15357 0.48133 -3.93134
-VAL_883 -4.62252 0.57089 1.55145 0.01763 0.04274 -0.27059 -0.89596 0 0 0 0 0 -0.08283 0.06126 -0.12759 0 2.64269 -0.38053 0.58246 -0.91088
-GLY_884 -2.69793 0.0956 2.68701 7e-05 0 -0.02949 -0.72533 0 0 0 0 0 -0.12342 0 -1.49883 0 0.79816 -0.5188 0.28251 -1.73046
-ASP_885 -4.95794 0.26577 5.71821 0.0043 0.2341 -0.21291 -4.34436 0 0 -0.73033 0 0 0.04384 1.77872 0.08143 0 -2.14574 -0.40536 0.18034 -4.48993
-ARG_886 -3.53947 0.17498 2.42151 0.01477 0.32398 -0.43281 -0.66467 0 0 0 0 0 -0.03092 2.14431 0.00472 0 -0.09474 -0.19051 0.28817 0.41932
-VAL_887 -6.24944 0.67534 0.67571 0.01952 0.04378 0.0172 -1.89705 0 0 0 0 0 -0.02992 0.11123 -0.72575 0 2.64269 -0.22573 0.29331 -4.64911
-THR_888 -2.75035 0.24484 1.33026 0.00871 0.05761 -0.42383 -0.60206 0 0 0 0 0 0.03862 0.04963 -0.09222 0 1.15175 -0.10833 0.2185 -0.87687
-ILE_889 -7.59863 0.80608 1.01666 0.0211 0.0721 -0.09645 -2.34463 0 0 0 0 0 0.05818 0.28349 -0.74281 0 2.30374 -0.12035 0.40886 -5.93265
-THR_890 -4.66923 0.3222 3.37429 0.00784 0.05462 -0.00073 -2.0705 0 0 0 0 0 -0.03985 0.05131 -0.21156 0 1.15175 -0.13655 0.50098 -1.66542
-CYS:disulfide_891 -7.07052 0.72625 3.19655 0.00324 0.04311 0.05193 -2.06851 0 0 0 0 -0.31708 -0.03141 0.32549 -0.13191 0 3.25479 0.71763 0.77088 -0.52955
-ARG_892 -5.75988 0.35805 6.13145 0.01469 0.38155 0.65567 -5.33364 0 0 0 -1.49497 0 -0.00264 2.07317 -0.01536 0 -0.09474 0.5922 0.6376 -1.85686
-ALA_893 -4.85783 0.84472 1.63056 0.00149 0 -0.01216 -0.90462 0 0 0 0 0 -0.01119 0 0.20453 0 1.32468 -0.07235 0.47295 -1.37921
-SER_894 -3.22499 0.16037 3.75906 0.00287 0.05846 -0.00467 -1.12294 0 0 -1.06933 0 0 -0.01342 0.17563 -0.12055 0 -0.28969 -0.27353 0.48316 -1.47959
-GLN_895 -6.22181 0.98906 5.20392 0.00507 0.14821 -0.45548 -1.53685 0 0 0 0 0 0.03084 2.59657 -0.06805 0 -1.45095 -0.33952 0.88443 -0.21456
-ASP_896 -4.27201 0.52002 5.74829 0.00768 0.44697 0.14769 -5.84697 0 0 -1.54527 0 0 -0.04111 4.03164 -0.02433 0 -2.14574 -0.30654 1.5213 -1.75839
-VAL_897 -7.03491 1.21382 0.97734 0.11461 0.06205 0.0234 -1.06097 0 0 -0.35436 0 0 -0.01486 2.65389 -0.14458 0 2.64269 -0.20807 1.90243 0.77246
-ASN_898 -4.7168 0.65673 4.77811 0.19049 0.43428 -0.43591 -2.34982 0 0 -0.94237 0 0 -0.11924 3.97174 0.32511 0 -1.34026 0.91881 13.5039 14.8748
-THR_899 -4.83178 0.67593 2.49828 0.17601 0.07351 -0.60432 -0.70979 0 0 -0.21581 0 0 0.05591 1.79654 0.04163 0 1.15175 1.50897 28.377 29.9938
-ALA_900 -5.27634 0.30618 2.21899 0.00309 0 -0.34315 -1.06564 0 0 0 0 0 0.08953 0 0.11232 0 1.32468 1.26708 15.9823 14.619
-VAL_901 -7.6767 0.72349 1.5114 0.01952 0.04159 -0.3384 -2.10567 0 0 0 0 0 -0.0455 0.11999 -0.78918 0 2.64269 0.4474 0.45072 -4.99866
-ALA_902 -5.81489 0.39311 2.29972 0.00129 0 0.33235 -2.27804 0 0 0 0 0 0.01568 0 0.15121 0 1.32468 -0.01957 0.3413 -3.25316
-TRP_903 -13.8238 1.39828 3.71505 0.01936 0.248 -0.52344 -3.31787 0 0 0 0 0 0.01505 1.13011 -0.03794 0 2.26099 0.29091 0.27352 -8.35175
-TYR_904 -11.7477 1.28692 4.61186 0.02977 0.32511 -0.13364 -2.61562 0 0 -0.97899 0 0 -0.00086 1.53209 -0.40926 0.00415 0.58223 -0.02034 0.51252 -7.02179
-GLN_905 -7.38829 0.53299 4.70989 0.00723 0.21006 -0.2071 -2.98449 0 0 0 -1.02851 0 0.00105 2.79342 0.28651 0 -1.45095 -0.06081 0.54406 -4.03492
-GLN_906 -7.95048 0.36149 5.98637 0.0104 0.21834 0.43599 -4.28499 0 0 -0.5723 -2.25451 0 -0.01285 2.5607 0.24265 0 -1.45095 0.20276 0.41731 -6.09008
-LYS_907 -5.18563 0.50717 4.75119 0.01039 0.14265 -0.47471 -2.70536 0 0 0 0 0 0.05299 0.97307 -0.05324 0 -0.71458 0.03265 1.30449 -1.35891
-PRO_908 -2.03062 0.41663 1.43826 0.00391 0.06919 -0.17799 -0.30782 0 0 0 0 0 -0.07675 0.27817 -0.86823 0 -1.64321 -0.34278 1.70989 -1.53135
-GLY_909 -1.14241 0.05431 1.3284 6e-05 0 -0.19935 -0.04265 0 0 0 0 0 -0.07891 0 -1.39007 0 0.79816 -0.63744 0.72761 -0.58229
-LYS_910 -3.90767 0.21797 3.84467 0.01298 0.61634 -0.15666 -2.08893 0 0 -0.5723 0 0 0.21562 2.03589 0.0066 0 -0.71458 -0.4286 0.35022 -0.56845
-ALA_911 -3.89552 0.77396 1.15839 0.00128 0 -0.01325 -0.14189 0 0 0 0 0 0.02054 0 -0.09705 0 1.32468 -0.32546 1.11323 -0.08109
-PRO_912 -7.13261 0.86659 1.90618 0.00315 0.07214 -0.27829 -0.29901 0 0 0 0 0 -0.02058 0.20703 -1.13163 0 -1.64321 -0.59646 1.44767 -6.59901
-LYS_913 -3.76606 0.28638 3.50603 0.00646 0.10577 0.13268 -2.09563 0 0 0 0 0 0.08115 0.94452 0.01774 0 -0.71458 -0.38583 0.63881 -1.24256
-LEU_914 -9.10177 0.82848 0.12827 0.01768 0.08169 -0.4312 -0.2196 0 0 0 0 0 0.03299 0.49495 -0.22731 0 1.66147 -0.19558 0.28777 -6.64216
-LEU_915 -9.18487 0.84281 1.43545 0.01716 0.0645 -0.23551 -1.81942 0 0 0 0 0 0.08193 0.41585 -0.17945 0 1.66147 0.22549 0.53112 -6.14346
-ILE_916 -9.27309 1.21014 2.70085 0.03598 0.06749 -0.17954 -1.54757 0 0 0 0 0 -0.02715 0.28028 -0.46643 0 2.30374 0.27967 0.57417 -4.04146
-TYR_917 -8.95542 0.97192 3.01306 0.0204 0.40831 0.05003 -2.2995 0 0 0 0 0 0.03169 2.44334 -0.38088 0.0001 0.58223 -0.17672 0.50992 -3.7815
-SER_918 -4.38682 0.53829 3.12601 0.00351 0.03277 -0.25114 0.00816 0 0 0 0 0 -0.03899 0.10871 0.11042 0 -0.28969 0.01778 0.59829 -0.42268
-ALA_919 -4.3956 0.4311 2.13105 0.00315 0 -0.08368 -0.98866 0 0 0 0 0 0.01097 0 0.27472 0 1.32468 0.78715 0.97231 0.46719
-SER_920 -3.46876 0.32256 2.78104 0.00275 0.06152 -0.10842 -0.68133 0 0 0 0 0 0.09929 0.06151 -0.46759 0 -0.28969 1.70956 0.97884 1.00129
-PHE_921 -6.31874 0.69386 3.72543 0.02596 0.25794 0.13727 -1.94595 0 0 0 0 0 0.06338 1.65404 -0.12938 0 1.21829 1.01111 0.44952 0.84273
-LEU_922 -5.19304 0.82217 1.38733 0.02096 0.14737 -0.0392 -0.64103 0 0 0 0 0 -0.05878 2.79187 -0.16962 0 1.66147 -0.03093 0.3954 1.09398
-TYR_923 -8.9128 0.96506 3.72061 0.02676 0.06507 0.13055 -1.87478 0 0 0 0 0 -0.00813 2.08557 0.06461 0.00299 0.58223 -0.26505 0.4609 -2.95641
-SER_924 -2.26712 0.20287 1.7424 0.00188 0.05284 -0.02935 0.65621 0 0 0 0 0 -0.07996 0.3531 0.08521 0 -0.28969 -0.43475 0.23109 0.22472
-GLY_925 -1.21334 0.02795 0.97007 6e-05 0 0.03019 0.04027 0 0 0 0 0 -0.13272 0 -1.48635 0 0.79816 -0.55066 0.09722 -1.41915
-VAL_926 -6.49148 1.48931 0.70624 0.01904 0.03627 0.17514 -0.98634 0 0 0 0 0 0.01967 0.06418 -0.41314 0 2.64269 -0.45819 1.28798 -1.90863
-PRO_927 -4.76512 0.93618 2.44471 0.00285 0.0689 -0.19954 -0.56899 0 0 0 0 0 -0.0168 0.15475 -1.14563 0 -1.64321 -0.29467 1.63848 -3.38809
-SER_928 -1.77196 0.24208 1.33848 0.00161 0.05124 -0.16234 0.62167 0 0 0 0 0 -0.08458 0.10683 -0.23615 0 -0.28969 -0.46098 0.60245 -0.04134
-ARG_929 -8.74619 0.63754 7.34662 0.01777 0.50823 0.0102 -2.99743 0 0 0 -1.40256 0 -0.05664 2.16911 -0.09333 0 -0.09474 -0.43349 0.51625 -2.61865
-PHE_930 -9.14582 0.78651 1.40168 0.02354 0.24863 -0.42863 -1.02851 0 0 0 0 0 -0.05669 1.85513 -0.14077 0 1.21829 -0.23888 0.47443 -5.03108
-SER_931 -3.36486 0.24445 2.99817 0.00253 0.0467 0.08822 -2.1623 0 0 0 0 0 0.03167 0.8952 -0.1625 0 -0.28969 -0.05519 0.2365 -1.49109
-GLY_932 -2.60137 0.47413 1.56551 6e-05 0 -0.11841 -0.94215 0 0 0 0 0 -0.0413 0 0.62228 0 0.79816 0.52184 0.17548 0.45424
-SER_933 -2.63178 0.08596 3.18002 0.00134 0.0613 -0.0187 -1.50165 0 0 0 0 0 0.0366 0.06561 -0.55376 0 -0.28969 0.39687 0.29836 -0.86951
-ARG_934 -4.39549 0.15908 4.04376 0.02408 0.41054 -0.1632 -1.81678 0 0 -0.10175 0 0 0.24332 4.511 -0.10034 0 -0.09474 -0.15423 0.54297 3.10822
-SER_935 -2.31961 0.12647 2.69919 0.00246 0.07109 0.04304 -1.64147 0 0 0 0 0 0.01482 0.07895 -0.03245 0 -0.28969 0.39923 0.49514 -0.35284
-GLY_936 -1.92729 0.10829 2.37177 5e-05 0 -0.29347 0.05857 0 0 0 0 0 -0.18563 0 -1.3339 0 0.79816 0.35879 0.26029 0.21562
-THR_937 -4.16216 0.12915 3.21947 0.00695 0.0818 -0.23156 -1.01792 0 0 0 0 0 -0.01459 0.0021 -0.23845 0 1.15175 -0.26023 0.26995 -1.06374
-ASP_938 -5.36888 0.34765 6.12445 0.00324 0.25703 0.29324 -4.95595 0 0 0 -1.49497 0 0.02126 2.88178 -0.14352 0 -2.14574 -0.21035 0.30795 -4.08281
-PHE_939 -9.18473 0.54661 3.0577 0.02517 0.28157 -0.0475 -3.02745 0 0 0 0 0 0.18623 1.53722 -0.29468 0 1.21829 -0.13259 0.39214 -5.44201
-THR_940 -5.22136 0.58117 3.85584 0.00971 0.05207 -0.21999 -1.95104 0 0 0 0 0 0.32249 0.16898 -0.20108 0 1.15175 -0.08551 0.55838 -0.97858
-LEU_941 -8.56839 1.11288 1.39654 0.01644 0.08404 -0.10298 -2.25745 0 0 0 0 0 -0.0375 0.6746 -0.30497 0 1.66147 0.01215 0.54408 -5.76909
-THR_942 -5.5579 0.38247 4.09409 0.00942 0.05485 -0.17605 -2.20006 0 0 0 0 0 0.23896 0.05479 -0.21882 0 1.15175 0.02053 0.37649 -1.76948
-ILE_943 -8.28484 0.73587 1.9199 0.02095 0.08205 -0.06346 -1.65275 0 0 0 0 0 0.09781 0.31074 -0.51242 0 2.30374 -0.01427 0.59006 -4.46662
-SER_944 -3.25929 0.08892 2.82477 0.0028 0.05344 -0.06324 -0.82037 0 0 0 0 0 -0.05873 0.18789 -0.0029 0 -0.28969 -0.35697 0.60778 -1.0856
-SER_945 -4.22559 0.24915 3.88956 0.00381 0.0792 -0.21417 -1.146 0 0 -0.49068 0 0 -0.05904 0.06239 -0.05606 0 -0.28969 0.5063 0.52333 -1.16751
-LEU_946 -9.59949 1.05268 2.49502 0.02032 0.08736 -0.03112 -3.22027 0 0 0 0 0 -0.01845 0.26711 -0.15707 0 1.66147 0.6252 0.68235 -6.1349
-GLN_947 -7.49344 1.04013 6.57259 0.01142 0.63499 -0.447 -2.23248 0 0 -1.32702 0 0 0.0341 1.56923 -0.03147 0 -1.45095 -0.30659 1.6571 -1.76939
-PRO_948 -4.44892 0.79804 1.75726 0.00209 0.0425 -0.42187 -0.54842 0 0 0 0 0 -0.12901 0.8785 -0.24233 0 -1.64321 -0.25106 1.84536 -2.36107
-GLU_949 -3.65757 0.42413 4.47549 0.0067 0.93344 -0.64059 -1.47336 0 0 0 0 0 -0.0466 3.55181 -0.11935 0 -2.72453 -0.28029 0.66907 1.11836
-ASP_950 -7.42948 0.65973 8.19208 0.00631 0.35917 0.07879 -7.08665 0 0 -1.57195 -1.40256 0 0.06148 2.18211 -0.34461 0 -2.14574 -0.53105 0.39457 -8.57779
-PHE_951 -4.80225 0.37497 2.74293 0.0221 0.16496 -0.23073 -0.56024 0 0 0 0 0 0.06469 1.65293 0.1281 0 1.21829 -0.05465 0.40813 1.12924
-ALA_952 -5.63779 0.45503 2.29048 0.00138 0 -0.30536 -1.2421 0 0 0 0 0 0.15454 0 -0.44654 0 1.32468 0.44786 0.31905 -2.63877
-THR_953 -6.47012 0.60099 3.34804 0.00709 0.0506 -0.06423 -2.37775 0 0 0 0 0 -0.00772 0.07373 -0.04128 0 1.15175 0.16539 0.35815 -3.20535
-TYR_954 -11.535 1.08398 3.4353 0.02551 0.26931 0.3185 -3.56761 0 0 -0.7356 -1.02851 0 0.00724 1.50896 -0.3245 0.06715 0.58223 -0.07642 0.4383 -9.53116
-TYR_955 -10.3897 0.67008 4.02085 0.0228 0.26911 -0.10056 -1.71452 0 0 0 0 0 0.55468 1.25563 -0.1973 0.08698 0.58223 -0.21271 0.59434 -4.5581
-CYS:disulfide_956 -6.87346 0.702 2.49613 0.00563 0.05849 -0.21223 -1.81012 0 0 0 0 -0.31708 -0.00417 2.09676 0.05115 0 3.25479 -0.1109 0.87098 0.20797
-GLN_957 -9.59571 1.26505 5.90374 0.01107 0.2821 -0.12703 -2.26383 0 0 0 0 0 0.29068 3.97317 -0.05348 0 -1.45095 0.0271 0.64974 -1.08834
-GLN_958 -9.95005 0.81252 7.29716 0.01009 1.25303 0.2786 -4.4791 0 0 -2.07595 -1.30605 0 0.00517 4.93845 0.09032 0 -1.45095 -0.04434 1.47165 -3.14943
-HIS_959 -7.71736 0.32187 4.74302 0.01721 1.02854 -0.78494 -0.57847 0 0 0 0 0 -0.02832 3.18986 -0.58788 0 -0.30065 0.08931 1.45795 0.85014
-TYR_960 -9.39003 1.03405 4.15662 0.13741 0.29406 -0.17031 -0.76446 0 0 -1.53681 0 0 0.02862 5.63327 -0.09674 0.06139 0.58223 0.53437 1.38045 1.88412
-THR_961 -5.17882 0.28651 3.14396 0.00819 0.07423 -0.09873 -1.07742 0 0 -0.82227 -0.38949 0 -0.00737 0.04872 -0.57378 0 1.15175 0.26561 1.37563 -1.79328
-THR_962 -4.77308 0.98186 2.36204 0.00711 0.05227 -0.62219 0.24939 0 0 0 0 0 0.02566 0.11136 -0.12544 0 1.15175 0.03404 1.18307 0.63785
-PRO_963 -4.53365 1.08799 1.91878 0.00411 0.12719 0.09356 -0.23746 0 0 -0.65048 0 0 0.35957 0.04133 -0.72204 0 -1.64321 0.01805 1.70749 -2.42878
-PRO_964 -6.50953 0.78868 2.39688 0.00548 0.12561 -0.25592 -0.8604 0 0 0 0 0 0.06213 0.20257 -0.86594 0 -1.64321 -0.33367 1.62522 -5.26209
-THR_965 -5.65802 0.63822 5.23647 0.00404 0.09312 0.14758 -2.05593 0 0 0 -0.91656 0 0.01049 0.19477 -0.20596 0 1.15175 -0.33088 1.17 -0.52091
-PHE_966 -8.79816 0.74444 1.14399 0.01924 0.21524 -0.34913 -0.47638 0 0 0 0 0 0.06095 1.55446 -0.38788 0 1.21829 -0.21321 0.70844 -4.55971
-GLY_967 -3.51526 0.33306 2.7449 0.00031 0 -0.11286 -0.56995 0 0 0 0 0 -0.05109 0 -0.43741 0 0.79816 -0.06566 0.42095 -0.45487
-GLN_968 -1.62977 0.04512 1.54639 0.00689 0.19298 -0.05724 -0.01011 0 0 0 0 0 -0.06039 2.31831 -0.25996 0 -1.45095 -0.15419 0.22319 0.71027
-GLY_969 -3.28247 0.3957 1.8826 9e-05 0 -0.19718 0.04054 0 0 0 0 0 -0.03596 0 -1.4939 0 0.79816 0.00258 0.11116 -1.77868
-THR_970 -6.9842 0.96804 4.41553 0.03909 0.09517 -0.18588 -2.12903 0 0 0 0 0 0.00602 1.74196 -0.22024 0 1.15175 0.22472 0.56215 -0.31492
-LYS_971 -5.86241 0.30638 5.30242 0.01245 0.42105 0.40856 -3.53179 0 0 0 -0.75182 0 -0.05998 4.75393 0.34087 0 -0.71458 0.12965 0.86953 1.62426
-VAL_972 -6.71866 0.47807 0.61851 0.01618 0.04681 -0.25747 -1.24769 0 0 0 0 0 0.04804 0.01369 -0.45984 0 2.64269 -0.10138 0.44709 -4.47395
-GLU_973 -5.16647 0.29485 4.96382 0.00645 0.25824 0.28386 -3.66833 0 0 0 -0.75182 0 0.21971 2.43525 0.06085 0 -2.72453 -0.22808 0.40093 -3.61526
-ILE_974 -6.7296 1.17131 0.20402 0.03264 0.06496 -0.09564 -0.40186 0 0 0 0 0 -0.05025 0.81294 -0.77225 0 2.30374 -0.23542 0.83538 -2.86003
-LYS:CtermProteinFull_975 -5.00436 0.32777 5.52465 0.01247 0.35297 -0.49789 -3.93172 0 0 0 0 0 0 2.51433 0 0 -0.71458 -0.21212 1.18632 -0.44217
-#END_POSE_ENERGIES_TABLE ./data/my_lab_test.pdb
-
diff --git a/LICENSE b/LICENSE
new file mode 100644
index 0000000..f288702
--- /dev/null
+++ b/LICENSE
@@ -0,0 +1,674 @@
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diff --git a/README.md b/README.md
index ac6aab1..933c27d 100644
--- a/README.md
+++ b/README.md
@@ -1,13 +1,13 @@
-# PyRosetta Basic
+# PyRosetta基础中文教程
-PyRosetta Basic中文教程，讲解Rosetta的基本原理以及在PyRosetta中的应用实例。
+PyRosetta的官方Notebook在很久之前就正式发布了，这次由晶泰科技团队带来的PyRosetta基础中文教程具有更好的易读性、更全面的用法介绍以及更多的实例展示。在这个教程中，读者通过动手实操一步步了解Rosetta的底层逻辑与建模思想，可以从零了解如何使用API组件去一步步搭建设计蛋白质、多肽的计算流程，同时教程中从零翻译了大量的PyRosetta API接口以备不时之需。
@文档贡献者：
1. 吴炜坤 @晶泰人工智能研发中心
2. 黄健 @晶泰人工智能研发中心
3. 张博文 @晶泰人工智能研发中心
-4. 槐喆 @晶泰人工智能研发中心 实习生
+4. 槐喆 @晶泰人工智能研发中心
@校对：
@@ -15,177 +15,167 @@ PyRosetta Basic中文教程，讲解Rosetta的基本原理以及在PyRosetta中
2. 郭宁 @晶泰人工智能研发中心
3. 张晨虹 @晶泰人工智能研发中心
-
-
@外援支持:
1. 刘源 博士后 北京大学王初课题组
-## 大纲内容:
-
-### 零、安装与入门介绍
-
-0.0 [Installation](https://github.com/guyujun/chinese-pyrosetta/blob/master/0_0_Installation.ipynb)
-
-0.1 [Python_Basic](https://github.com/guyujun/chinese-pyrosetta/blob/master/0_1_Python_Basic.ipynb)
-
-0.2 Utils
-
-
+## 大纲内容
-### 一、Pose与Structure IO: 负责介绍PyRosetta对结构文件的处理，以及Pose对象的重要作用
+### 零、PyRosetta与Pymol服务器的安装配置:
-负责人:@吴炜坤 进度: 100%
+负责人:@吴炜坤
-> 相关的官方章节: http://nbviewer.jupyter.org/github/RosettaCommons/PyRosetta.notebooks/blob/master/notebooks/02.00-Introduction-to-PyRosetta.ipynb
+- 0.0 [安装与配置](https://nbviewer.jupyter.org/github/guyujun/chinese-pyrosetta/blob/master/1_PoseIO/0_0_Installation.ipynb)
-- 1.0 [Pose Object Abstract](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_0_Pose_Abstract.ipynb)
-- 1.1 [Pose IO](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_1_Pose_IO.ipynb)
-- 1.2 [PymolMover](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_2_PyMover_PyRosetta.ipynb)
+### 一、Pose与Structure IO:
-- 1.3 [Pose & PDBinfo](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_3_Pose_PDBinfo.ipynb)
+负责介绍PyRosetta对结构文件的处理，以及Pose对象的重要作用
-- 1.4 [Atom & Residue](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_4_Atom_Residue.ipynb)
+负责人:@吴炜坤
-- 1.5 [Conformation & Protein Geometry](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_5_Conformation_Geometry.ipynb)
+- 1.0 [Pose IO介绍](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_1_Pose_IO.ipynb)
+- 1.1 [PymolMover与可视化](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_2_PyMover_PyRosetta.ipynb)
+- 1.2 [Pose与PDBinfo的交互](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_3_Pose_PDBinfo.ipynb)
+- 1.3 [Atom与Residue的层级](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_4_Atom_Residue.ipynb)
+- 1.4 [Conformation层级](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_5_Conformation_Geometry.ipynb)
+- 1.5 [Pose的操作变换一览](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_6_Pose_Operating.ipynb)
-- 1.6 [Pose Operation](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/1_PoseIO/1_6_Pose_Operating.ipynb)
+### 二、Energy Function与Constraint
-### 二、Energy Function与Constraint: 介绍Rosetta的能量函数与物理约束
+介绍Rosetta的能量函数与物理约束
-负责人: @黄健 进度: 60%
+负责人: @黄健
-> 相关的官方章节: http://nbviewer.jupyter.org/github/RosettaCommons/PyRosetta.notebooks/blob/master/notebooks/03.00-Rosetta-Energy-Score-Functions.ipynb
+- 2.0 [Atom与Structure的表示方式](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/2_Energy/2_1_Atom_Model.ipynb)
+- 2.1 [Energy Terms and Score Function介绍](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/2_Energy/2_2_Energy_Function.ipynb)
+- 2.2 [Constraints的介绍与用法](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/2_Energy/2_3_Constraint.ipynb)
+- 2.3 [Contsraint的API查询](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/2_Energy/2_4_Contsraint_API.ipynb)
-> Constraint的API总结: https://zhuanlan.zhihu.com/p/58897635
-- 2.0 [Atom Model](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/2_Energy/2_1_Atom_Model.ipynb)
-- 2.1 [Energy Terms and Score Function](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/2_Energy/2_2_Energy_Function.ipynb)
+### 三、Kinematics与Trees
-- 2.2 [Constraints](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/2_Energy/2_3_Constraint.ipynb)
+介绍Rosetta的骨架自由度控制
+负责人:@张博文
+- 3.0 [FoldTree的连续性](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/3_Kinematics/3_0_FoldTree.ipynb)
+- 3.1 [FoldTree的不连续性](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/3_Kinematics/3_1_Jump_Cutpoint.ipynb)
-### 三、Kinematics与Trees: 介绍Rosetta的骨架自由度控制
-负责人:@张博文 进度: 33%
-> 相关的官方章节: http://nbviewer.jupyter.org/github/RosettaCommons/PyRosetta.notebooks/blob/master/notebooks/04.00-Introduction-to-Folding.ipynb
+### 四、Monte Carlo
-> Foldtree的概念: https://zhuanlan.zhihu.com/p/59863638
+介绍Rosetta中的蒙特卡洛算法【核心】
-- 3.0 [FoldTree与顺序性](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/3_Kinematics/3_0_FoldTree.ipynb)
+负责人:@吴炜坤
-- 3.1 Docking Tree & Jumps
+- 4.0 [Metropolis Monte Carlo采样](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/4_MCMC/4_0_Metropolis_Monte_Carlo.ipynb)
+- 4.1 [Movers & MC object运作机理](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/4_MCMC/4_1_Movers_MC_object.ipynb)
+- 4.2 [Fragment如何加速Folding采样](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/4_MCMC/4_2_Fragment_Folding.ipynb)
-- 3.2 MoveMap
+### 五、Residue Selector
-### 四、Monte Carlo: 介绍Rosetta中的蒙特卡洛算法【核心】
+介绍残基选择器，自定义选择范围。
-负责人:@吴炜坤 进度: 100%
-
-> 相关的官方章节:https://nbviewer.jupyter.org/github/RosettaCommons/PyRosetta.notebooks/blob/master/notebooks/4.02-Low-Res-Scoring-and-Fragments.ipynb
-
-> 相关的官方章节: http://nbviewer.jupyter.org/github/RosettaCommons/PyRosetta.notebooks/blob/master/notebooks/05.00-Structure-Refinement.ipynb
-
-- 4.0 [Metropolis & Simulated annealing](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/4_MCMC/4_0_Metropolis_Monte_Carlo.ipynb)
-
-- 4.1 [Movers & MC object ](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/4_MCMC/4_1_Movers_MC_object.ipynb)
-
-- 4.2 [Fragment_Folding](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/4_MCMC/4_2_Fragment_Folding.ipynb)
+负责人:@槐喆
+- 5.0 [Residue Selector简介](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/5_Residue_Selector/5_0_ResidueSelectors_Logic.ipynb)
+- 5.1 [Residue Selector的API查询](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/5_Residue_Selector/5_1_ResidueSelector_ApiSearch.ipynb)
-### 五、Residue Selector: 介绍残基选择器
-负责人:@槐喆 进度: 50% 。校对:@吴炜坤
+### 六、Packer与TaskOperation
-> 中文总结：https://zhuanlan.zhihu.com/p/58348980
+介绍Packer与氨基酸侧链自由度控制，如何使用PyRosetta进行设计
-> 官网资料: https://www.rosettacommons.org/docs/latest/scripting_documentation/RosettaScripts/ResidueSelectors/ResidueSelectors
+负责人:@吴炜坤
-[residue selector preview](https://nbviewer.jupyter.org/github/guyujun/chinese-pyrosetta/blob/master/ResidueSelectors.ipynb)
+- 6.0 [Rotamers & Packer简介](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/6_Packer_TaskOperation/6_0_Rotamer_Packer.ipynb)
+- 6.1 [TaskOperation & PackTask任务机制](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/6_Packer_TaskOperation/6_1_PackTask_TaskOP.ipynb)
+- 6.2 [Resfile System与Rotamer控制](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/6_Packer_TaskOperation/6_2_Resfile_System.ipynb)
+- 6.3 [TaskOperation的API查询](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/6_Packer_TaskOperation/6_3_TaskOperation_API.ipynb)
-- 5.0 [Residue Selector的逻辑](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/5_Residue_Selector/5_0_ResidueSelectors_Logic.ipynb)
-- 5.1 [Residue Selector的API查询](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/5_Residue_Selector/5_1_ResidueSelector_ApiSearch.ipynb)
+### 七、SimpleMetric
+新一代特征计算和记录工具
-### 六、Packer与TaskOperation: 介绍Packer与氨基酸侧链自由度控制
+负责人:@槐喆
-负责人:@吴炜坤 进度: 50%
+- 7.0 [SimpleMetric逻辑](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/7_Simple_Metrics/7_0_Simple_Metrics_Logic.ipynb)
+- 7.1 [SimpleMetric的API查询](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/7_Simple_Metrics/7_1_Simple_Metrics_ApiSearch.ipynb)
-> 相关的官方章节: http://nbviewer.jupyter.org/github/RosettaCommons/PyRosetta.notebooks/blob/master/notebooks/06.00-Introduction-to-Packing-and-Design.ipynb
-- [6.1 Rotamers & Packer](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/6_Packer_TaskOperation/6_0_Rotamer_Packer.ipynb)
-- 6.2 TaskOperation、TaskFactory与PackTask（Rotamer自由度控制）
+### 八、Filters
-- 6.3 NCAA(调色板)
+过滤器也是计算器。
+负责人: @吴炜坤@黄健
+- 8.0 [Filters的逻辑](https://nbviewer.jupyter.org/github/guyujun/pyrosettabasic/blob/master/8_Filter/8_1_Filter_Introduction.ipynb)
+- 8.1 [Filters的API查询](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/8_Filter/8_2_RosettaFilter_API.ipynb)
-### 七、SimpleMetric: 新一代特征计算和记录工具
-负责人:@槐喆 @黄健 进度: 30%
-> SimpleMetric的API总结 https://zhuanlan.zhihu.com/p/58383955
+### 九、RosettaScript & XmlObject
-- 7.0 SimpleMetric
+xmlObject如何解决Rosetta历史遗留问题
-- ????
+负责人:@黄健@吴炜坤
+- 9.0 [RosettaScript基础](https://nbviewer.org/github/guyujun/pyrosetta-basic/blob/master/9_XmlObject/9_1_RS_basis.ipynb)
+- 9.1 [RosettaScript进阶](https://nbviewer.org/github/guyujun/pyrosetta-basic/blob/master/9_XmlObject/9_2_RS_advanced.ipynb)
+- 9.2 [XmlObject的用法](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/9_XmlObject/9_3_XmlObject.ipynb)
-### 八、Filters: 过滤器，大过滤器！
-负责人: @黄健 @张博文 进度: 0%
+### 十、进阶分析
-> 官网资料: https://www.rosettacommons.org/docs/latest/scripting_documentation/RosettaScripts/Filters/Filters-RosettaScripts
+Silent与rstoolbox的完美结合。
-- 8.0 Filters的逻辑
+负责人:@吴炜坤
-- 8.1 Filters的API
+- 10.0 [rstoolbox对Silent文件解析](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/10_Analysis/10_0_rstoolbox.ipynb)
+- 10.1 [rstoolbox更多有用的API](https://nbviewer.jupyter.org/github/guyujun/pyrosetta-basic/blob/master/10_Analysis/10_1_more_api.ipynb)
-### 九、xmlObject & RosettaScript: xmlObject如何解决Rosetta历史遗留问题
+#### FAQ:
-负责人:@黄健 进度: 0%
+如果你有任何问题，请在github issues里提出，我们有专人进行回答。
-xmlObject的API总结: https://zhuanlan.zhihu.com/p/58381573
+如果你想找到蛋白质设计社区，可以使用微信入群讨论，请将微信号发送至rosettastudy@163.com邮箱，将有专人添加您微信邀请入群。
-> 官网资料:
->
-> 1. https://www.rosettacommons.org/docs/latest/scripting_documentation/RosettaScripts/RosettaScripts
-> 2. https://nbviewer.jupyter.org/github/RosettaCommons/PyRosetta.notebooks/blob/master/notebooks/02.07-RosettaScripts-in-PyRosetta.ipynb
+**申请邮件格式（缺一不可）:**
-- 9.0 RosettaScript
+1. **个人介绍（姓名，专业）**
+2. **所在课题组**
+3. **研究课题内容**
+4. **入群理由**
+5. **个人微信号**
-- 9.1 XmlObject
+入群前，将进行相关问题提问审核。
-- 9.2 自定义Mover
-- 9.3 PyRosetta的多进程化
-###
+### 参考资料:
-## 参考资料:
+PyRosetta中文基础计划的地址: https://github.com/guyujun/pyrosetta-basic
-中文开源计划的地址: https://github.com/guyujun/chinese-pyrosetta
+官方PyRosetta Notebook开源地址: https://github.com/RosettaCommons/PyRosetta.notebooks
-PyRosetta Notebook开源地址: https://github.com/RosettaCommons/PyRosetta.notebooks
+官方PyRosetta API查询: https://graylab.jhpytu.edu/PyRosetta.documentation/search.html?q=cdr
-PyRosetta API查询: https://graylab.jhpytu.edu/PyRosetta.documentation/search.html?q=cdr
+Rosetta中文社区知乎: https://www.zhihu.com/column/rosettastudy
-Rosetta中文知乎: https://www.zhihu.com/column/rosettastudy
\ No newline at end of file
diff --git a/others/.ipynb_checkpoints/0_1_Python_Basic-checkpoint.ipynb b/others/.ipynb_checkpoints/0_1_Python_Basic-checkpoint.ipynb
new file mode 100644
index 0000000..c5f318c
--- /dev/null
+++ b/others/.ipynb_checkpoints/0_1_Python_Basic-checkpoint.ipynb
@@ -0,0 +1,672 @@
+{
+ "cells": [
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "# Python Basic（未完成编辑）\n",
+ "\n",
+ "@Author: 吴炜坤\n",
+ "\n",
+ "@email：weikun.wu@xtalpi.com/weikunwu@163.com\n",
+ "\n",
+ "PyRosetta顾名思义，是Rosetta的Python界面的API封装。因此本章节将以pyrosetta的一些例句为例，介绍一些关于python的**非常基础**语法和语句，以方便读者阅读和理解本系列教程的内容。\n",
+ "\n",
+ "更加详细的python教程课程可以在网络上找到很多，比如https://juejin.cn/post/6844903765410070535"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "### 0. 库与Import\n",
+ "模块是一个包含所有你定义的函数和变量的文件，其后缀名是.py。模块可以被别的程序引入，以使用该模块中的函数等功能。在pyrosetta中所有的函数和方法都是定义在rosetta.io文件中(C++)的。但和一般的python标准库的导入方法类似。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 1,
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "# 导入pyrosetta\n",
+ "import pyrosetta"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 2,
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "# 也可以等价写于:\n",
+ "from pyrosetta import init"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "导入了函数或某个函数的上级的库，我们就可以来调用这个函数来实现一些功能了。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 3,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2020 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release 2020.23+release.0d6f90a8cb9fa0567ca76bb71ee93bfe73340c70 2020-06-04T19:12:24] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release r257 2020.23+release.0d6f90a8cb9 0d6f90a8cb9fa0567ca76bb71ee93bfe73340c70 http://www.pyrosetta.org 2020-06-04T19:12:24\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/envs/pyrosetta/lib/python3.6/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-573114774 seed_offset=0 real_seed=-573114774 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-573114774 RG_type=mt19937\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 使用这个函数的方法1:库名+\".\"+函数。“.”代表在指定在这个库中寻找我们需要的函数。\n",
+ "pyrosetta.init()"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 4,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2020 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release 2020.23+release.0d6f90a8cb9fa0567ca76bb71ee93bfe73340c70 2020-06-04T19:12:24] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release r257 2020.23+release.0d6f90a8cb9 0d6f90a8cb9fa0567ca76bb71ee93bfe73340c70 http://www.pyrosetta.org 2020-06-04T19:12:24\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/envs/pyrosetta/lib/python3.6/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=-578603057 seed_offset=0 real_seed=-578603057 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=-578603057 RG_type=mt19937\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 也可以这样来调用, 因为 我们先前已经指定了 from pyrosetta import init。从pyrosetta中导入叫init的函数。\n",
+ "init()"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "#### 提示:\n",
+ "如此一来，pyrosetta在我们的内存中就已经激活了。\n",
+ "\n",
+ "在运行pyrosetta的任何函数之前，**一定记得进行初始化。** 否则将会报错。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "### 1. 变量与数据类型\n",
+ "PyRosetta和Python能处理的数据类型类似:\n",
+ "- 整数\n",
+ "- 浮点数\n",
+ "- 字符串\n",
+ "- 布尔值"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "### 2. 列表与切片\n",
+ "在Python中列表和切片是非常重要的概念，此处我们以一些简单的例子来说明;\n",
+ "\n",
+ "**列表** 就是用“[]”符号，将一系列的变量和数据以“,”分隔的一个数据格式。\n",
+ "\n",
+ "**切片** 就是用索引号去获取列表中的某个或某个范围内的数据，并返回值或列表。但是注意索引的顺序是从0开始。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 5,
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "1"
+ ]
+ },
+ "execution_count": 5,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# 创建一个列表: \n",
+ "mylist = [1, 2, 3, 4, 5, 6]\n",
+ "\n",
+ "# 索引: 第一个元素:\n",
+ "mylist[0]"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 6,
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "[2, 3]"
+ ]
+ },
+ "execution_count": 6,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# 索引: 一个范围, 第二个元素到第三个元素:\n",
+ "mylist[1:3]"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "因此所有pyrosetta返回的数据类型，只要是列表，就可以使用索引切片进行数据获取。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "### 3. For循环\n",
+ "循环在数据分析中具有重要的作用。\n",
+ "\n",
+ "使用for…in 循环是python最简单理解的一种循环方式，可以直白的逻辑可以理解为:\n",
+ "```\n",
+ "for(对于)。。in(在某个集合)中的元素进行循环。\n",
+ "```\n",
+ "举例，我想对一个列表循环并将这个列表中的所有值进行打印:\n",
+ "\n",
+ "print()函数代表，将“()”中的内容进行打印输出到屏幕上。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 7,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "1\n",
+ "2\n",
+ "3\n",
+ "4\n",
+ "5\n",
+ "6\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 循环:\n",
+ "for x in mylist:\n",
+ " print(x)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "for x in mylist: 代表在mylist中的元素x进行循环。而且对于每个循环需要做的处理就是print()。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "### 4. Def(函数)\n",
+ "函数是组织好的，可重复使用的，用来实现单一，或相关联功能的代码段。\n",
+ "函数能提高应用的模块性，和代码的重复利用率。你已经知道Python提供了许多内建函数，比如print()。但你也可以自己创建函数，这被叫做用户自定义函数。\n"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 8,
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "# 定义一个函数:\n",
+ "def init_pyrosetta():\n",
+ " import pyrosetta\n",
+ " pyrosetta.init()\n",
+ " return 0"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 9,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2020 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release 2020.23+release.0d6f90a8cb9fa0567ca76bb71ee93bfe73340c70 2020-06-04T19:12:24] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python36.Release r257 2020.23+release.0d6f90a8cb9 0d6f90a8cb9fa0567ca76bb71ee93bfe73340c70 http://www.pyrosetta.org 2020-06-04T19:12:24\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/envs/pyrosetta/lib/python3.6/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=1475936894 seed_offset=0 real_seed=1475936894 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=1475936894 RG_type=mt19937\n"
+ ]
+ },
+ {
+ "data": {
+ "text/plain": [
+ "0"
+ ]
+ },
+ "execution_count": 9,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# 调用函数::\n",
+ "init_pyrosetta()"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "### 5. Class(类)\n",
+ "（新手向: 也可以简单地理解为一些函数的集合!）\n",
+ "\n",
+ "在Python中，定义类是通过class关键字, class后面紧接着是类名(用户自定义)，类名通常是大写开头的单词，紧接着是object(指明类从哪继承)。\n",
+ "\n",
+ "类中最重要的两个概念是:\n",
+ "- 方法\n",
+ "- 属性\n",
+ "\n",
+ "\n",
+ "**1. 类中的函数即称为方法**。\n",
+ "\n",
+ "`__init__()` 是函数的构造方法，每档创建新实例时 Python 都会自动运行它。注意构造方法名字必须是这个，是规定好的。\n",
+ "\n",
+ "print_words函数 是类test的一个方法。\n",
+ "\n",
+ "**2. 类中的变量即称为属性**。\n",
+ "\n",
+ "self.words 是类的一个属性，__init__()函在实例化的过程中，将外部输入的words转换为内部的一个属性。\n",
+ "\n"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 10,
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "# 一个类的代码示例:\n",
+ "class test(object):\n",
+ "\n",
+ " def __init__(self, words):\n",
+ " self.words = words\n",
+ "\n",
+ " def print_words(self):\n",
+ " print(self.words)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "可见，类是抽象的模板，是属性和方法抽象的模板，但类进行实例化(传递参数时)，类创建出来的一个个具体的“对象”。\n",
+ "\n",
+ "有了对象之后，然后方可调用其中的方法(函数);"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 11,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "hello\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 实例化，通过传递参数’hello‘。并实例化test。\n",
+ "test1 = test('hello')\n",
+ "\n",
+ "# 使用类中的方法: 实例化的变量名+'.'+函数名(传递的参数，如果有的话)。\n",
+ "test1.print_words()"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "运行类中的方法实现了打印我们最开始传递的参数“hello”。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "### 6. PyRosetta Class & Function的使用**\n",
+ "在PyRosetta中, 所有的功能相关的代码都是封装在类和函数当中的，因此我们只需要学会如何调用这些功能，就能达到学习和应用的目的。\n",
+ "区分函数和类的使用也十分简单。可直接在PyRosetta的API网站中查询，一般而言，如果是类，那么都是以class字段直接开头。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "如果是函数: 就可以直接调用。比如我们想从序列直接生成结构，可以使用**pose_from_sequence函数**。\n",
+ ""
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 12,
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 980 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.734775 seconds.\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 调用函数的例子:\n",
+ "from pyrosetta.io import pose_from_sequence\n",
+ "pose = pose_from_sequence('AAAAAAA')"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "如果是一个类，那么我们必须首先对他进行实例化，才能使用它。\n",
+ "比如:\n",
+ ""
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 13,
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "# 导入类\n",
+ "from pyrosetta.rosetta.protocols.minimization_packing import MinMover\n",
+ "\n",
+ "# 实例化，并赋予一个变量名。\n",
+ "minmover = MinMover()"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "PyRosetta的类被实例化后，大多数负责执行功能的都是叫apply()的函数，该函数接受的对象也大多数是Rosetta的Pose对象。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 16,
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "# 运行类，执行结构进行能量最小化。\n",
+ "minmover.apply(pose)"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "**有的时候一些类会强制用户传递必要的参数才能实例化**\n",
+ "\n",
+ "还是以MinMover作为例子，在实例化过程中，如果没有传递参数。那么类会有一些默认的设置。\n",
+ "\n",
+ "当然用户也可以传递自己想要的参数进去，但是必须满足参数的格式要求，如init3, 用户需要传递4个参数，才能实例化这个类。\n",
+ "\n",
+ ""
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "### 进阶阅读"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "#### 1. What is a \"Size\" or a \"Real\"?\n",
+ "\n",
+ "Within Rosetta, several simple objects are used for basic data structures. If these are seen within PyRosetta help, they can be replaced by their appropriate Python data type.\n",
+ " Size in an int\n",
+ " Real is a double or float (use float in Python)\n",
+ " Vector or Vector1 often serves the purpose of a Python list"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "#### 2. Where are Vector objects?\n",
+ "\n",
+ "Within Rosetta, Vector objects are used for various list structures. The common Vector objects are found in various locations. Please consult the question below for more information.\n",
+ " Vector1 \n",
+ " rosetta.Vector1 \n",
+ " xyzVector\n",
+ " rosetta.numeric.xyzVector \n",
+ " vector1_(data type)\n",
+ " rosetta.utility.vector1_(data type)\n"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "#### 3. Why are Rosetta objects 1-indexed?\n",
+ "\n",
+ "Within Rosetta has its roots in FORTRAN so counting is \"1-indexed\" (the first element is numbered 1). Python on the other hand is \"0-indexed\" (the first element is numbered 0). The documentation discusses this in a little more depth."
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "#### 4. How do I construct Rosetta Vector0/Vector1 objects?\n",
+ "\n",
+ "Vector0/1 is exposed in newer versions of PyRosetta and lives in pyrosetta.rosetta.utility.vector{0/1}_*. Specific Vector1 objects live in rosetta.utility.vector1_type.\n",
+ "\n",
+ "There is also pyrosetta.Vector1 helper function that will do construction of most common types using Python list as input. For or example:\n",
+ " print rosetta.Vector1( [ 1 , 2 , 3 ] )\n",
+ " print rosetta.Vector1( [ 1.0 , 2.0 , 3.0 ] )\n",
+ " print rosetta.Vector1( [ True , False , True ] )\n",
+ " print rosetta.Vector1( [ 'a' , 'b' , 'c' ] )\n",
+ "\n",
+ " v = rosetta.utility.vector1_SSize()\n",
+ " v.append( 1 )\n",
+ " print v\n"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "#### 5. How do I construct various C++ std objects, like std::map?\n",
+ "\n",
+ "C++ sts:: types is exposed in PyRosetta in pyrosetta.rosetta.std module. For example all map types could be accessed as: pyrosetta.rosetta.std.map_type1_type2.\n",
+ "\n",
+ "For example:\n",
+ " m = pyrosetta.rosetta.std.map_string_Real()\n",
+ " m['aaa'] = 1.0; m['bb']= 3.0\n",
+ " print m"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "#### 6. How do I construct std::set objects?\n",
+ "\n",
+ "std::set templates is exposed in PyRosetta and lives in pyrosetta.rosetta.std_*. There is also helper function Set that will convert Python list/set object into PyRosetta, it could be found in pyrosetta namespace:\n",
+ "\n",
+ " print pyrosetta.Set( [ 1 , 2 , 3 ] )\n",
+ " print pyrosetta.Set( [ 1.0 , 2.0 , 3.0 ] )\n",
+ " print pyrosetta.Set( [ 'a' , 'b' , 'c' ] )\n",
+ "\n",
+ " s = pyrosetta.utility.Set_SSize()\n",
+ " s.add(1); s.add(2); s.add(1); s.erase(2)\n",
+ " print s"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "#### 7. How do I convert \"AP\" or \"CAP\" objects to regular class objects?\n",
+ "\n",
+ "Use the \"get\" function (rosetta.utility.utility___getCAP in older releases). This is an involved issue which does not come up in common usage of PyRosetta.\n",
+ "For example, to create a \"ALA\" residue:\n",
+ "(new way)\n",
+ " chm = rosetta.core.chemical.ChemicalManager.get_instance()\n",
+ " rts = chm.residue_type_set( 'fa_standard' ).get()\n",
+ " ala = rosetta.core.conformation.ResidueFactory.create_residue( rts.name_map( 'ALA' ) )\n",
+ " print ala\n",
+ "\n",
+ "(old way)\n",
+ " chm = rosetta.core.chemical.ChemicalManager.get_instance()\n",
+ " rts_AP = chm.residue_type_set( 'fa_standard' )\n",
+ " rts = rosetta.utility.utility___getCAP( rts_AP ) # converts a CAP object to a ResidueTypeSet object\n",
+ " ala = rosetta.core.conformation.ResidueFactory.create_residue( rts.name_map( 'ALA' ) )\n",
+ " print ala"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "metadata": {},
+ "source": [
+ "#### 8. How do I use std::ostream or std::istream for methods that require it? \n",
+ "\n",
+ "The objects std::ostream and std::istream are bound in PyRosetta as pyrosetta.rosetta.std.ostream and pyrosetta.rosetta.std.istream, respectively. Generally, objects that require these objects will also accept classes that are pyrosetta.rosetta.std.istringstream and pyrosetta.rosetta.std.ostringstream objects. Use these types of objects instead."
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ }
+ ],
+ "metadata": {
+ "kernelspec": {
+ "display_name": "Python 3",
+ "language": "python",
+ "name": "python3"
+ },
+ "language_info": {
+ "codemirror_mode": {
+ "name": "ipython",
+ "version": 3
+ },
+ "file_extension": ".py",
+ "mimetype": "text/x-python",
+ "name": "python",
+ "nbconvert_exporter": "python",
+ "pygments_lexer": "ipython3",
+ "version": "3.7.10"
+ }
+ },
+ "nbformat": 4,
+ "nbformat_minor": 4
+}
diff --git a/1_PoseIO/0_1_Python_Basic.ipynb b/others/0_1_Python_Basic.ipynb
similarity index 99%
rename from 1_PoseIO/0_1_Python_Basic.ipynb
rename to others/0_1_Python_Basic.ipynb
index ad3822c..c5f318c 100644
--- a/1_PoseIO/0_1_Python_Basic.ipynb
+++ b/others/0_1_Python_Basic.ipynb
@@ -4,7 +4,7 @@
"cell_type": "markdown",
"metadata": {},
"source": [
- "# Python Basic\n",
+ "# Python Basic（未完成编辑）\n",
"\n",
"@Author: 吴炜坤\n",
"\n",
@@ -12,7 +12,7 @@
"\n",
"PyRosetta顾名思义，是Rosetta的Python界面的API封装。因此本章节将以pyrosetta的一些例句为例，介绍一些关于python的**非常基础**语法和语句，以方便读者阅读和理解本系列教程的内容。\n",
"\n",
- "更加详细的python教程课程可以再网络上找到很多，比如https://juejin.cn/post/6844903765410070535"
+ "更加详细的python教程课程可以在网络上找到很多，比如https://juejin.cn/post/6844903765410070535"
]
},
{
@@ -664,7 +664,7 @@
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
- "version": "3.6.12"
+ "version": "3.7.10"
}
},
"nbformat": 4,
![](\"./img/pyrosetta_install1.jpg\")
![](\"./img/pyrosetta_notebook_api.png\")
![](\"./img/pose.png\")
![](\"./img/PoseObject.png\")
![](\"./img/demo-pdb.png\")
![](\"./img/5A.png\")
![](\"./img/pose_from_rcsb.png\")
"
+ "![](\"./img/ptms_peptide.png\")
![](\"./img/metal_pose.png\")
![](\"./img/pymolrosettaserver.png\")
"
+ "![](\"./img/sendpose.png\")
"
+ "![](\"./img/pymol_hbnet.png\")
"
+ "![](\"./img/pymol_energy.png\")
"
+ "![](\"./img/PyMOLObserver_conformers.gif\")
![](\"./img/Params.jpg\")
![](\"./img/phipsiomega.png\")
![](\"./img/conf.png\")
![](\"./img/chi_conf.png\")
![](\"./img/trans_xyz.png\")
![](\"./img/lowRes-HighRes.jpg\")
![](\"./img/Monte-Carlo-algorithm.jpg\")
![](\"./img/Metropolis_Criterion.jpg\")
![](\"./img/energy_good_or_bad.jpg\")
![](\"./img/Energy_Terms.jpg\")
![](\"./img/energy_good_or_bad2.jpg\")
![](\"./img/Energy_terms_classification.jpg\")
![](\"./img/energy_weights.jpg\")
![](\"./img/LJ-term_fa_atr_fa_rep.jpg\")
![](\"./img/quadratic_punishment.jpg\")
![](\"./img/flat_region.png\")
![](\"./img/flat_region.jpg\")
\n",
+ "(图片来源: 晶泰科技团队)"
]
},
{
"cell_type": "markdown",
"metadata": {},
"source": [
- "#### 3.1 单一限制类型\n",
+ "#### 3.1 几何约束的类型\n",
"\n",
- "单一限制类型仅限制单一的测量值。\n",
+ "下面介绍所有Rosetta支持的几何约束类型:\n",
"\n",
"1. Atompair\n",
"\n",
"![](\"./imgs/freedom.jpg\")
![](\"./imgs/simple_foldtree.jpg\")
![](\"./imgs/phi_change.png\")
![](\"./imgs/phi_change.jpg\")
![](\"./imgs/foldtree_sequence.png\")
"
+ "![](\"./imgs/foldtree.jpg\")
![](\"./imgs/set_jump.jpg\")
"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "14875583-123d-4b73-8486-8caa4a809c2c",
+ "metadata": {},
+ "source": [
+ "**此时，FoldTree树结构才只会有一个根部起点！！Root=PoseID:1**"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "f6d858cf-0ffe-4c13-97c4-0d2b099595c3",
+ "metadata": {},
+ "source": [
+ "**思考**:\n",
+ "1. 当改变第70号氨基酸时，杠杠效应具体表现？\n",
+ "2. 当改变第150号氨基酸时，杠杠效应具体表现？"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "d9d546f2-570f-4d95-8e91-1fc1a172ce93",
+ "metadata": {},
+ "source": [
+ "#### 1.2 正确设置一个带Jump的FoldTree"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "c3d6c16d-d718-4963-a50f-9a60f7227178",
+ "metadata": {},
+ "source": [
+ "设置带Jump点的foldtree方式也是通过FoldTree下的add_edge函数完成，用以下的例子，我们尝试复现1.1节中展示的foldtree。\n",
+ "\n",
+ "先来看一个例子:"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 4,
+ "id": "04ed5384-db07-4eb1-bee3-37d1c6485d92",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.kinematics.FoldTree: {0} \u001b[0m\u001b[31m\u001b[1m[ ERROR ]\u001b[0m Bad fold tree at edge EDGE 108 194 -1\n",
+ "\u001b[0mcore.kinematics.FoldTree: {0} \u001b[0m\u001b[31m\u001b[1m[ ERROR ]\u001b[0m Start residue 108 not built yet.\n",
+ "\u001b[0mcore.kinematics.FoldTree: {0} \u001b[0m\u001b[31m\u001b[1m[ ERROR ]\u001b[0m FOLD_TREE EDGE 1 107 -1 EDGE 108 194 -1 EDGE 1 108 1\n",
+ "FOLD_TREE EDGE 1 107 -1 EDGE 108 194 -1 EDGE 1 108 1 \n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.kinematics import FoldTree\n",
+ "# 完整定义试试:\n",
+ "ft = FoldTree() #设置一个空的foldtree对象\n",
+ "ft.add_edge(start=1, stop=107, label=-1)\n",
+ "ft.add_edge(start=108, stop=194, label=-1)\n",
+ "ft.add_edge(start=1, stop=108, label=1) # add jump\n",
+ "ft.check_fold_tree() # 检查foldtree的有效性;\n",
+ "print(ft)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "40d1204f-1993-4e99-8b59-afc8dd3c1318",
+ "metadata": {},
+ "source": [
+ "**笔者解读: 这是因为在构建foldtree时是有顺序性的。每一个子节点必须先定义父节点才能生效。在第一种做法中，108号残基么有预先定义父节点。而在第二种做法中，先定义了107-108之间的jump，因此108号残基的foldtree才是有效的！**"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "8bc2862e-2db9-4e24-b3e2-7afcdc5ee6de",
+ "metadata": {},
+ "source": [
+ "我们先定义里两个edge之后再去定义jump。但发现foldtree是无效的！"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 5,
+ "id": "84551714-66ce-477e-b54c-1dd6e740e26c",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 5,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.core.kinematics import FoldTree\n",
+ "# 完整定义试试:\n",
+ "ft = FoldTree() #设置一个空的foldtree对象\n",
+ "ft.add_edge(start=1, stop=107, label=-1)\n",
+ "ft.add_edge(start=1, stop=108, label=1) # add jump\n",
+ "ft.add_edge(start=108, stop=194, label=-1)\n",
+ "ft.check_fold_tree() # 检查foldtree的有效性;"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "9b9af2ef-9672-45fa-bc3d-204b1ec75bd7",
+ "metadata": {},
+ "source": [
+ "而如果先构建第一个edge，然后构建jump，在构建第二个edge时，foldtree是有效的。这种现象产生原因是？"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "c857d074-b4ad-4c6c-9410-aace7149762f",
+ "metadata": {},
+ "source": [
+ "**jump点的设置练习**: 读者可根据以下foldtree的逻辑图创建一个foldtree么？(提示注意jump编号)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "2949c0d3-e0a4-4896-bd23-214e000fc040",
+ "metadata": {},
+ "source": [
+ "![](\"./imgs/two_jump2.jpg\")
"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 6,
+ "id": "daadb0ac-2550-4096-a061-b5fefd890aef",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 6,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# 答案\n",
+ "from pyrosetta.rosetta.core.kinematics import FoldTree\n",
+ "# 完整定义试试:\n",
+ "ft = FoldTree() #设置一个空的foldtree对象\n",
+ "\n",
+ "# 正确答案:\n",
+ "ft.add_edge(start=1, stop=107, label=-1)\n",
+ "ft.add_edge(start=107, stop=108, label=1) # add jump1\n",
+ "ft.add_edge(start=108, stop=157, label=-1)\n",
+ "ft.add_edge(start=88, stop=158, label=2) # add jump2\n",
+ "ft.add_edge(start=158, stop=194, label=-1)\n",
+ "ft.check_fold_tree() # 检查foldtree的有效性;"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "e0a51b5c-1f28-4c84-8770-130e5dbcaedd",
+ "metadata": {},
+ "source": [
+ "**关键点在于按照jump的流向构建FoldTree**"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "a41a5092",
+ "metadata": {},
+ "source": [
+ "#### 1.2 FoldTree的可切割性: Cutpoint"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "c7ee1eb9",
+ "metadata": {},
+ "source": [
+ "FoldTree是可以在edge中进行对点的切割，即设置cutpoint，在快速设置loop时十分有用。 \n",
+ "总体来说，Cutpoint就是FoldTree中的不连续点，相对于peptide edge的连续性来说，cutpoint的出现相当于一把剪刀，将非peptide edge内氨基酸的连接关系切断，也就是FoldTree内EDGE的上下游关系在此处被切断。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 7,
+ "id": "807c3145-ee9e-4468-91f2-b7401692e12b",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "FOLD_TREE EDGE 1 10 -1 \n"
+ ]
+ }
+ ],
+ "source": [
+ "# demo for add a cutpoint\n",
+ "cutpoint_pose = pose_from_sequence('AAAAAAAAAA')\n",
+ "pose_foldtree = cutpoint_pose.fold_tree()\n",
+ "print(pose_foldtree)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "b3a66dff-f4b3-4d75-bd53-9abcb719540e",
+ "metadata": {},
+ "source": [
+ "一个最简单的cutpoint的设置例子，本质上cutpoint就是原有共价连接的地方，**不构建应有的链接**\n",
+ "![](\"./imgs/set_cutpoint.jpg\")
"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 8,
+ "id": "89295550-c045-4493-920e-51a43f5d561f",
+ "metadata": {},
+ "outputs": [],
+ "source": [
+ "from pyrosetta.rosetta.core.kinematics import FoldTree\n",
+ "# 完整定义试试:\n",
+ "ft = FoldTree() #设置一个空的foldtree对象\n",
+ "\n",
+ "# 正确答案:\n",
+ "ft.add_edge(start=1, stop=5, label=-1)\n",
+ "ft.add_edge(start=5, stop=10, label=1)\n",
+ "ft.add_edge(start=10, stop=6, label=-1)\n",
+ "ft.check_fold_tree() # 检查foldtree的有效性;\n",
+ "\n",
+ "# 检查foldtree的cutpoint数量。\n",
+ "ft.num_cutpoint()\n",
+ "cutpoint_pose.fold_tree(ft)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "0e25e8ce",
+ "metadata": {},
+ "source": [
+ "我们可以使用对应pose的FoldTree的num_cutpoint属性来看cutpoint的数量，并通过cutpoint属性来看对应cutpoint的位置，以及is_cutpoint判断是否为cutpoint"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 9,
+ "id": "6a408f29",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "The FoldTree of the Pose: FOLD_TREE EDGE 1 5 -1 EDGE 5 10 1 EDGE 10 6 -1 \n",
+ "The number of the cutpoint in Pose is : 1\n",
+ "The cutpoint in Pose is : 5\n"
+ ]
+ }
+ ],
+ "source": [
+ "#看对应pose中cutpoint的属性\n",
+ "print(f\"The FoldTree of the Pose: {cutpoint_pose.fold_tree()}\")\n",
+ "print(f\"The number of the cutpoint in Pose is : {cutpoint_pose.fold_tree().num_cutpoint()}\") #说明Pose的cutpoint只有一个\n",
+ "print(f\"The cutpoint in Pose is : {cutpoint_pose.fold_tree().cutpoint(1)}\") #说明Pose中的断点在5号残基处"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "fc52df2f-fb35-45d9-8e4f-0eb7e83c6be9",
+ "metadata": {},
+ "source": [
+ "尝试改变3号残基的构象，看看效果: 从第5号残基处构象被切断。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 10,
+ "id": "b2fbc99c-779d-474f-b65c-f4f0164690c4",
+ "metadata": {},
+ "outputs": [
+ {
+ "data": {
+ "text/plain": [
+ "True"
+ ]
+ },
+ "execution_count": 10,
+ "metadata": {},
+ "output_type": "execute_result"
+ }
+ ],
+ "source": [
+ "# set phi3\n",
+ "cutpoint_pose.dump_pdb('./data/cutpoint_raw.pdb')\n",
+ "cutpoint_pose.set_phi(7, 69)\n",
+ "cutpoint_pose.set_psi(7, 60)\n",
+ "cutpoint_pose.dump_pdb('./data/cutpoint_pertuber.pdb')"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "6882a37f-5ec2-4671-a224-f615e05fbd8b",
+ "metadata": {},
+ "source": [
+ "![](\"./imgs/cut_chage_phi.jpg\")
"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "a246a3c2-bca2-4fe4-a152-be28635e5d29",
+ "metadata": {},
+ "source": [
+ "一个设置cutpoint更快的方法: 直接使用FoldTree的new_jump函数，就可以完成上面伸所示的foldtree构建"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 14,
+ "id": "972ed477-7443-4422-8003-66802bfd87a4",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "The FoldTree of the Pose: FOLD_TREE EDGE 1 5 -1 EDGE 5 10 1 EDGE 10 6 -1 \n",
+ "The number of the cutpoint in Pose is : 1\n",
+ "The cutpoint in Pose is : 5\n"
+ ]
+ }
+ ],
+ "source": [
+ "# demo for add a cutpoint\n",
+ "cutpoint_pose = pose_from_sequence('AAAAAAAAAA')\n",
+ "pose_foldtree = cutpoint_pose.fold_tree()\n",
+ "pose_foldtree.new_jump(jump_pos1=5, jump_pos2=10, cutpoint=5)\n",
+ "\n",
+ "#看对应pose中cutpoint的属性\n",
+ "print(f\"The FoldTree of the Pose: {cutpoint_pose.fold_tree()}\")\n",
+ "print(f\"The number of the cutpoint in Pose is : {cutpoint_pose.fold_tree().num_cutpoint()}\") #说明Pose的cutpoint只有一个\n",
+ "print(f\"The cutpoint in Pose is : {cutpoint_pose.fold_tree().cutpoint(1)}\") #说明Pose中的断点在5号残基处"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "cdee64a1",
+ "metadata": {},
+ "source": [
+ "### 二、一些常用FoldTree设置方法"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "0d63f206-7679-4b4a-a3d3-c63056745c87",
+ "metadata": {},
+ "source": [
+ "在蛋白质建模的不同任务中，不同的任务通常需要自定义特定的FoldTree:\n",
+ "- Docking FoldTree: 蛋白/小分子对接\n",
+ "- Loop modeling FoldTree: loop建模\n",
+ "- Folding FoldTree: 蛋白从头折叠"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "853d3dbc",
+ "metadata": {},
+ "source": [
+ "![](\"./imgs/more_foldtree.jpg\")
"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "79fe0811-9888-40ae-ac41-375eb7b57ef8",
+ "metadata": {},
+ "source": [
+ "#### 2.1 快速设置docking foldtree的方法:\n",
+ "\n",
+ "主要调用的函数为: setup_foldtree"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 24,
+ "id": "b6ecb1ed-7239-4037-9924-a2218c55184f",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1v74.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue LEU:CtermProteinFull 107\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue LEU:CtermProteinFull 194\n",
+ "PDB file name: ./data/1v74.pdb\n",
+ " Pose Range Chain PDB Range | #Residues #Atoms\n",
+ "\n",
+ "0001 -- 0107 A 0591 -- 0697 | 0107 residues; 01728 atoms\n",
+ "0108 -- 0194 B 0001 -- 0087 | 0087 residues; 01425 atoms\n",
+ " TOTAL | 0194 residues; 03153 atoms\n",
+ "\n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.docking import setup_foldtree\n",
+ "from pyrosetta.rosetta.utility import vector1_int\n",
+ "# Docking FoldTree\n",
+ "#首先读取data文件中的PDB：1V74文件\n",
+ "pose = pose_from_pdb('./data/1v74.pdb')\n",
+ "print(pose.pdb_info())"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "44785e22-aeba-4aae-a58c-38517230f854",
+ "metadata": {},
+ "source": [
+ "读入的Pose中含有两条链，一条是A一条是B。使用setup_foldtree时我们需要先定义partner概念。\n",
+ "\n",
+ "partner参数的基本形式是\"X_Y\", 含义是我需要构建一个X链为第一个刚体，Y为第二个刚体的。\n",
+ "\n",
+ "partner参数支持3条链以上: 如“A_BC”, 含义是A作为一个刚体，BC链一同作为另外一个刚体。\n",
+ "\n",
+ "**setup_foldtree因此根据partner参数去构建相应的Docking FoldTree，并且将\"_\"中间设定为第一个Jump，因此一般Docking任务都会将movable_jumps参数中的vector1_int设置为1.**"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 23,
+ "id": "25405352-6304-4b26-ab64-98cdb11af194",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "FOLD_TREE EDGE 1 88 -1 EDGE 88 107 -1 EDGE 88 158 1 EDGE 158 108 -1 EDGE 158 194 -1 \n"
+ ]
+ }
+ ],
+ "source": [
+ "# 默认设置可以在刚体中移动的jumps为1\n",
+ "movable_jumps_v = vector1_int()\n",
+ "movable_jumps_v.append(1)\n",
+ "\n",
+ "# 设置foldtree\n",
+ "setup_foldtree(pose, partner_chainID='A_B', movable_jumps=movable_jumps_v)\n",
+ "\n",
+ "print(pose.fold_tree())"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "33cbbcd0-e190-4f43-b2df-d994f37eacb8",
+ "metadata": {},
+ "source": [
+ "**思考**:画出上面的图, 为什么setup_foldtree要这样去设置FoldTree呢？"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "id": "b3b1a25b-f430-476c-8e66-7ace704e11ea",
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "id": "1fc82602-7326-4d12-a1e5-8fe2cf2472ff",
+ "metadata": {},
+ "source": [
+ "#### 2.1 快速设置LoopMoldeing foldtree的方法:\n",
+ "\n",
+ "主要调用的函数为: setup_foldtree"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 26,
+ "id": "64171af1-b55b-4091-acb8-0cce67542dc3",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PDB file name: AAAAAAAA\n",
+ " Pose Range Chain PDB Range | #Residues #Atoms\n",
+ "\n",
+ "0001 -- 0027 A 0001 -- 0027 | 0027 residues; 00273 atoms\n",
+ " TOTAL | 0027 residues; 00273 atoms\n",
+ "\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 创建序列Pose\n",
+ "pose = pose_from_sequence('AAAAAAAAAAAAAAAAAAAAAAAAAAA')\n",
+ "print(pose.pdb_info())"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "1e6745e1-984d-4cbf-aaf5-0b7a2363bc8d",
+ "metadata": {},
+ "source": [
+ "假设我现在要对10-20这段区域的骨架进行随机化采样，又不希望这段区域的自由度变化对1-9, 21-27的区域造成影响。\n",
+ "\n",
+ "这就是Loop modeling FoldTree需要做的事情。"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 28,
+ "id": "b61273c3-ddd4-4f72-a063-317b2cf3f2d5",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "FOLD_TREE EDGE 1 9 -1 EDGE 9 15 -1 EDGE 9 21 1 EDGE 21 16 -1 EDGE 21 27 -1 \n"
+ ]
+ }
+ ],
+ "source": [
+ "from pyrosetta.rosetta.protocols.loops import Loops, Loop, fold_tree_from_loops\n",
+ "\n",
+ "# define loops;\n",
+ "loop_fold_tree = FoldTree()\n",
+ "loops = Loops()\n",
+ "loop = Loop(10, 20, 15) # start_res, end_res, cut_res\n",
+ "loops.add_loop(loop)\n",
+ "\n",
+ "# setup loop modelling foldtree;\n",
+ "fold_tree_from_loops(pose, loops, loop_fold_tree)\n",
+ "print(loop_fold_tree)\n",
+ "pose.fold_tree(loop_fold_tree)"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "7dfa0176-b5ee-4991-9049-efb02db322bc",
+ "metadata": {},
+ "source": [
+ "**思考**:画出上面的图，思考为什么fold_tree_from_loops要这样去设置FoldTree呢？"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": null,
+ "id": "715e267f-a8fb-4255-955f-b5c1f3749839",
+ "metadata": {},
+ "outputs": [],
+ "source": []
+ },
+ {
+ "cell_type": "markdown",
+ "id": "9b21b508",
+ "metadata": {},
+ "source": [
+ "**练习**"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "9c2c41aa-e808-46d7-9dbe-7bc9684a0b67",
+ "metadata": {},
+ "source": [
+ "1. 如果我已知有一段功能结构区域范围，如何设置foldtree，在采样时避免这段区域发生变化呢? （难度系数: **）\n",
+ "\n",
+ "2. 如何设定一个可以在Docking中允许loops采样的FoldTree呢？（难度系数: ****）"
+ ]
+ }
+ ],
+ "metadata": {
+ "kernelspec": {
+ "display_name": "Python 3",
+ "language": "python",
+ "name": "python3"
+ },
+ "language_info": {
+ "codemirror_mode": {
+ "name": "ipython",
+ "version": 3
+ },
+ "file_extension": ".py",
+ "mimetype": "text/x-python",
+ "name": "python",
+ "nbconvert_exporter": "python",
+ "pygments_lexer": "ipython3",
+ "version": "3.7.10"
+ },
+ "toc": {
+ "base_numbering": 1,
+ "nav_menu": {},
+ "number_sections": true,
+ "sideBar": true,
+ "skip_h1_title": false,
+ "title_cell": "Table of Contents",
+ "title_sidebar": "Contents",
+ "toc_cell": false,
+ "toc_position": {},
+ "toc_section_display": true,
+ "toc_window_display": false
+ }
+ },
+ "nbformat": 4,
+ "nbformat_minor": 5
+}
diff --git a/3_Kinematics/.ipynb_checkpoints/3_1_Jump_Cutpoint-checkpoint.ipynb b/3_Kinematics/.ipynb_checkpoints/3_1_Jump_Cutpoint-checkpoint.ipynb
new file mode 100644
index 0000000..571ee82
--- /dev/null
+++ b/3_Kinematics/.ipynb_checkpoints/3_1_Jump_Cutpoint-checkpoint.ipynb
@@ -0,0 +1,779 @@
+{
+ "cells": [
+ {
+ "cell_type": "markdown",
+ "id": "f3d8c35e",
+ "metadata": {},
+ "source": [
+ "# FoldTree的不连续性\n",
+ "\n",
+ "@Author: 张博文\n",
+ "@email：bowen.zhang@xtalpi.com\n",
+ "\n",
+ "@Proofread: 吴炜坤\n",
+ "@email：weikun.wu@xtalpi.com"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "6b014b71",
+ "metadata": {},
+ "source": [
+ "上一节中，我们介绍了Rosetta中坐标的处理方式Rosetta的基本概念，及其顺序性、杠杠性。这一节中，我们将继续介绍： \n",
+ "(1)FoldTree的另两个特性：跳跃性和可切割性。 \n",
+ "(2)快速设置特殊任务foldtree的方法"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 1,
+ "id": "f086eb81",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PyRosetta-4 2021 [Rosetta PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release 2021.26+release.b308454c455dd04f6824cc8b23e54bbb9be2cdd7 2021-07-02T13:01:54] retrieved from: http://www.pyrosetta.org\n",
+ "(C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team.\n",
+ "\u001b[0mcore.init: {0} \u001b[0mChecking for fconfig files in pwd and ./rosetta/flags\n",
+ "\u001b[0mcore.init: {0} \u001b[0mRosetta version: PyRosetta4.conda.mac.cxx11thread.serialization.python37.Release r288 2021.26+release.b308454c455 b308454c455dd04f6824cc8b23e54bbb9be2cdd7 http://www.pyrosetta.org 2021-07-02T13:01:54\n",
+ "\u001b[0mcore.init: {0} \u001b[0mcommand: PyRosetta -ex1 -ex2aro -database /opt/miniconda3/lib/python3.7/site-packages/pyrosetta/database\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0m'RNG device' seed mode, using '/dev/urandom', seed=1987000656 seed_offset=0 real_seed=1987000656 thread_index=0\n",
+ "\u001b[0mbasic.random.init_random_generator: {0} \u001b[0mRandomGenerator:init: Normal mode, seed=1987000656 RG_type=mt19937\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 初始化pyrosetta，使用pyrosetta必须要做的一件事情\n",
+ "from pyrosetta import init, pose_from_pdb, pose_from_sequence\n",
+ "init()"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "956e446f",
+ "metadata": {},
+ "source": [
+ "### 一、FoldTree的不连续性"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "3309ddef",
+ "metadata": {},
+ "source": [
+ "上一节中我们已经提到了FoldTree的另外两个特性：跳跃性和可切割性，这一节我们将详细的介绍。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "29340e34",
+ "metadata": {},
+ "source": [
+ "#### 1.1 FoldTree的跳跃性: Jump连接"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "0a905a9c",
+ "metadata": {},
+ "source": [
+ "上一节我们已经提过，在FoldTree中当蛋白质有多条链组成时，尽管每一条链中的残基都是共价连接，多条链之间实际上并不存在实际的共价连接。而在FoldTree的概念中，一个树结构只能有一个“根”, 因此在Rosetta中，引入了一种虚拟共价链接，为成为Jump。如同跳跃一般，可以建立一种\"超远程\"的上下游关系。\n",
+ "\n",
+ "以下我们将实践揭开jump的定义方式:"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 2,
+ "id": "043fc87e-0364-4db2-8821-b10202d69c47",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mFinished initializing fa_standard residue type set. Created 984 residue types\n",
+ "\u001b[0mcore.chemical.GlobalResidueTypeSet: {0} \u001b[0mTotal time to initialize 0.640777 seconds.\n",
+ "\u001b[0mcore.import_pose.import_pose: {0} \u001b[0mFile './data/1v74.pdb' automatically determined to be of type PDB\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue LEU:CtermProteinFull 107\n",
+ "\u001b[0mcore.conformation.Conformation: {0} \u001b[0m\u001b[1m[ WARNING ]\u001b[0m missing heavyatom: OXT on residue LEU:CtermProteinFull 194\n"
+ ]
+ }
+ ],
+ "source": [
+ "#首先读取data文件中的PDB：1V74文件\n",
+ "pose = pose_from_pdb('./data/1v74.pdb')"
+ ]
+ },
+ {
+ "cell_type": "code",
+ "execution_count": 3,
+ "id": "7b1c58d7-53ac-4ede-9e61-5ba2b797f5e2",
+ "metadata": {},
+ "outputs": [
+ {
+ "name": "stdout",
+ "output_type": "stream",
+ "text": [
+ "PDB:1V74: FOLD_TREE EDGE 1 107 -1 EDGE 1 108 1 EDGE 108 194 -1 \n",
+ "The size of the foldtree (number of edges) is 3\n",
+ "The number of the jump is 1\n"
+ ]
+ }
+ ],
+ "source": [
+ "# 输出该pose的FoldTree\n",
+ "print(\"PDB:1V74: \",pose.fold_tree())\n",
+ "print(f\"The size of the foldtree (number of edges) is {pose.fold_tree().size()}\") #Foldtree 的尺寸（edge的个数）\n",
+ "print(f\"The number of the jump is {pose.fold_tree().num_jump()}\") #Foldtree 的jump点的个数"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "aa40610f",
+ "metadata": {},
+ "source": [
+ "可以看到该Pose中含有3个Edge（含一个Jump Edge）。与上一章介绍的一样，其中，从1-107、108-194最后一位为-1，因此这两个edge内所有残基为共价连接，而1和108号残基，即该蛋白的A链和B链的N端由一个Jump连接，即一个虚拟的“共价键”。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "34db2cd2-7afc-40ba-8a74-4175b67816f9",
+ "metadata": {},
+ "source": [
+ "将这个FoldTree进行可视化的话，即如上图所示。此时A链的1号残基为B链108-194残基的上游，同时也是2-107号残基的上游。\n",
+ "因此jump1的虚拟链接定义了ChainA和ChainB之间的上下游关系。"
+ ]
+ },
+ {
+ "cell_type": "markdown",
+ "id": "15be28c8",
+ "metadata": {},
+ "source": [
+ "![](\"./img/conformation_space.jpg\")
![](\"./img/玻尔兹曼分布.jpg\")
![](\"./img/mc_samping.jpg\")
![](\"./img/马尔科夫链.jpg\")
![](\"./img/能量面的对比.jpg\")
![](\"./img/mcmc_river.jpg\")
![](\"./img/Metropolis.jpg\")
![](\"./img/mcmc.jpg\")
![](\"./img/SA.jpg\")
![](\"./img/mcmc_min.jpg\")
![](\"./img/rama.jpg\")
![](\"./img/GD.jpg\")
![](\"./img/minmover.gif\")
![](\"./img/2i9m.png\")
![](\"./img/fullatom_fold.gif\")
![](\"./img/能量面的变化.jpg\")
![](\"./img/sample_mcm.png\")
![](\"./img/prediction.png\")
![](\"./img/6LZ9_init.png\")
![](\"./img/6LZ9_heavychain.png\")
![](\"./img/6LZ9_lightchain.png\")
![](\"./img/6LZ9_light_or_heavy.png\")
![](\"./img/6LZ9_light_and_heavy.png\")
![](\"./img/6LZ9_not_heavy.png\")
![](\"./img/6LZ9_entire_pose.png\")
![](\"./img/6LZ9_index.png\")
![](\"./img/6LZ9_pdb_index.png\")
![](\"./img/6LZ9_pdb_range.png\")
![](\"./img/6LZ9_residuename.png\")
![](\"./img/6LZ9_multi_residuename.png\")
![](\"./img/6LZ9_ss.png\")
![](\"./img/6LZ9_nbr.png\")
![](\"./img/6LZ9_nbr_noself.png\")
![](\"./img/6LZ9_core.png\")
![](\"./img/6LZ9_surface.png\")
![](\"./img/6XBE_lmc.png\")
![](\"./img/sheet_pose.png\")
![](\"./img/paired_sheet.png\")
![](\"./img/shtif_paired_sheet.png\")
![](\"./img/what_is_rotamer.jpg\")
![](\"./img/residue_rotamer.jpg\")
![](\"./img/rotamerprobility.jpg\")
![](\"./img/05PercSmoothed.GLU.Chi3Dens.gp_gm.gif\")
![](\"./img/Efun.jpg\")
![](\"./img/interactiongraph.jpg\")
![](\"./img/PackerTask.jpg\")
![](\"./img/taskop_turnoff.png\")
![](\"./img/repacking_conf.png\")
![](\"./img/FastRelax.jpg\")
![](\"./img/fastrelaxed.png\")
![](\"./img/fastdesign.png\")
![](\"./img/Resfile_format.jpg\")
![](\"./img/structure_align.png\")
![](\"./img/SimpleMetricsFrameworks.jpg\")
![](\"./img/6LZ9_per_resi_sasa.png\")
![](\"./img/6LZ9_h_chain.png\")
![](\"./img/6LZ9_l_chain_sasa.png\")
![](\"./img/3K2U_init.png\")
![](\"./img/6LZ9_rmsd.png\")
![](\"./img/InteractionGraph.png\")
![](\"./img/6LZ9_H_polar.png\")
![](\"./img/salt_brigde.png\")