HEADER DNA/RNA CHIMERIC HYBRID DUPLEX 16-DEC-94 104D 104D 2

COMPND DNA/RNA CHIMERIC HYBRID DUPLEX 104D 3

COMPND 2 (5'-R(*CP*GP*CP*G)-D(*TP*AP*TP*AP*CP*GP*CP*G)-3') 104D 4

COMPND 3 (NMR, 1 STRUCTURE) 104D 5

SOURCE SYNTHETIC 104D 6

EXPDTA NMR 104D 7

AUTHOR L.ZHU,M.SALAZAR,B.R.REID 104D 8

REVDAT 1 31-MAR-95 104D 0 104D 9

JRNL AUTH L.ZHU,M.SALAZAR,B.R.REID 104D 10

JRNL TITL DNA DUPLEXES FLANKED BY HYBRID DUPLEXES: THE 104D 11

JRNL TITL 2 SOLUTION STRUCTURE OF CHIMERIC JUNCTIONS IN 104D 12

JRNL REF BIOCHEMISTRY V. 34 2372 1995 104D 13

JRNL REFN ASTM BICHAW US ISSN 0006-2960 0033 104D 14

REMARK 1 104D 15

REMARK 2 104D 16

REMARK 2 RESOLUTION. NOT APPLICABLE. SEE REMARK 4. 104D 17

REMARK 3 104D 18

REMARK 3 REFINEMENT. 104D 19

REMARK 3 PROGRAM DISCOVER, AMBER FORCE FIELD 104D 20

REMARK 3 AUTHORS BIOSYM TECHNOLOGIES, INC. 104D 21

REMARK 3 R VALUE 0.160 104D 22

REMARK 3 FINAL RMS COORD. SHIFT 0.65 ANGSTROMS 104D 23

REMARK 3 104D 24

REMARK 3 NUMBER OF ATOMS USED IN REFINEMENT. 104D 25

REMARK 3 NUMBER OF PROTEIN ATOMS 0 104D 26

REMARK 3 NUMBER OF NUCLEIC ACID ATOMS 766 104D 27

REMARK 3 NUMBER OF HETEROGEN ATOMS 0 104D 28

REMARK 3 NUMBER OF SOLVENT ATOMS 0 104D 29

REMARK 4 104D 30

REMARK 4 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION 104D 31

REMARK 4 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT 104D 32

REMARK 4 *CRYST1* AND *SCALE* RECORDS BE INCLUDED, BUT THE VALUES ON 104D 33

REMARK 4 THESE RECORDS ARE MEANINGLESS. 104D 34

REMARK 5 104D 35

REMARK 5 KEYWDS: JUNCTION, HYBRID, DUPLEX 104D 36

REMARK 105 104D 37

REMARK 105 THE PROTEIN DATA BANK HAS ADOPTED THE SACCHARIDE CHEMISTS 104D 38

REMARK 105 NOMENCLATURE FOR ATOMS OF THE DEOXYRIBOSE/RIBOSE MOIETY 104D 39

REMARK 105 RATHER THAN THAT OF THE NUCLEOSIDE CHEMISTS. THE RING 104D 40

REMARK 105 OXYGEN ATOM IS LABELLED O4* INSTEAD OF O1*. 104D 41

SEQRES 1 A 12 C G C G T A T A C G C G 104D 42

SEQRES 1 B 12 C G C G T A T A C G C G 104D 43

CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 104D 44

ORIGX1 1.000000 0.000000 0.000000 0.00000 104D 45

ORIGX2 0.000000 1.000000 0.000000 0.00000 104D 46

ORIGX3 0.000000 0.000000 1.000000 0.00000 104D 47

SCALE1 1.000000 0.000000 0.000000 0.00000 104D 48

SCALE2 0.000000 1.000000 0.000000 0.00000 104D 49

SCALE3 0.000000 0.000000 1.000000 0.00000 104D 50

ATOM 1 O5* C A 1 0.302 -7.166 1.688 1.00 0.00 104D 51

ATOM 2 C5* C A 1 1.282 -7.618 0.778 1.00 0.00 104D 52

ATOM 3 C4* C A 1 2.258 -6.494 0.415 1.00 0.00 104D 53

ATOM 4 O4* C A 1 1.559 -5.375 -0.142 1.00 0.00 104D 54

ATOM 5 C3* C A 1 3.029 -5.960 1.625 1.00 0.00 104D 55

ATOM 6 O3* C A 1 4.223 -6.665 1.944 1.00 0.00 104D 56

ATOM 7 C2* C A 1 3.364 -4.578 1.109 1.00 0.00 104D 57

ATOM 8 O2* C A 1 4.565 -4.602 0.355 1.00 0.00 104D 58

ATOM 9 C1* C A 1 2.239 -4.169 0.198 1.00 0.00 104D 59

ATOM 10 N1 C A 1 1.372 -3.087 0.757 1.00 0.00 104D 60

ATOM 11 C2 C A 1 1.566 -1.778 0.290 1.00 0.00 104D 61

ATOM 12 O2 C A 1 2.403 -1.503 -0.568 1.00 0.00 104D 62

ATOM 13 N3 C A 1 0.821 -0.774 0.818 1.00 0.00 104D 63

ATOM 14 C4 C A 1 -0.070 -1.004 1.785 1.00 0.00 104D 64

ATOM 15 N4 C A 1 -0.756 0.046 2.249 1.00 0.00 104D 65

ATOM 16 C5 C A 1 -0.290 -2.332 2.293 1.00 0.00 104D 66

ATOM 17 C6 C A 1 0.450 -3.333 1.749 1.00 0.00 104D 67

ATOM 18 1H5* C A 1 0.788 -7.973 -0.127 1.00 0.00 104D 68

ATOM 19 2H5* C A 1 1.834 -8.444 1.228 1.00 0.00 104D 69

ATOM 20 H4* C A 1 2.969 -6.895 -0.312 1.00 0.00 104D 70

ATOM 21 H3* C A 1 2.369 -5.878 2.490 1.00 0.00 104D 71

ATOM 22 1H2* C A 1 3.361 -3.870 1.900 1.00 0.00 104D 72

ATOM 23 2HO* C A 1 4.806 -3.700 0.132 1.00 0.00 104D 73

ATOM 24 H1* C A 1 2.819 -3.731 -0.595 1.00 0.00 104D 74

ATOM 25 1H4 C A 1 -0.562 0.957 1.849 1.00 0.00 104D 75

ATOM 26 2H4 C A 1 -1.433 -0.062 2.989 1.00 0.00 104D 76

ATOM 27 H5 C A 1 -1.003 -2.560 3.072 1.00 0.00 104D 77

ATOM 28 H6 C A 1 0.306 -4.341 2.113 1.00 0.00 104D 78

ATOM 29 H5T C A 1 -0.282 -7.899 1.895 1.00 0.00 104D 79

ATOM 30 P G A 2 5.198 -6.191 3.160 1.00 0.00 104D 80

ATOM 31 O1P G A 2 6.252 -7.220 3.308 1.00 0.00 104D 81

ATOM 32 O2P G A 2 4.331 -5.874 4.316 1.00 0.00 104D 82

ATOM 33 O5* G A 2 5.916 -4.804 2.698 1.00 0.00 104D 83

ATOM 34 C5* G A 2 7.102 -4.778 1.913 1.00 0.00 104D 84

ATOM 35 C4* G A 2 7.540 -3.336 1.568 1.00 0.00 104D 85

ATOM 36 O4* G A 2 6.572 -2.539 0.880 1.00 0.00 104D 86

ATOM 37 C3* G A 2 7.908 -2.500 2.792 1.00 0.00 104D 87

ATOM 38 O3* G A 2 9.165 -2.834 3.350 1.00 0.00 104D 88

ATOM 39 C2* G A 2 7.950 -1.123 2.141 1.00 0.00 104D 89

ATOM 40 O2* G A 2 9.071 -0.983 1.290 1.00 0.00 104D 90

ATOM 41 C1* G A 2 6.692 -1.183 1.333 1.00 0.00 104D 91

ATOM 42 N9 G A 2 5.503 -0.621 1.997 1.00 0.00 104D 92

ATOM 43 C8 G A 2 4.478 -1.366 2.409 1.00 0.00 104D 93

ATOM 44 N7 G A 2 3.388 -0.739 2.736 1.00 0.00 104D 94

ATOM 45 C5 G A 2 3.733 0.587 2.499 1.00 0.00 104D 95

ATOM 46 C6 G A 2 2.948 1.770 2.638 1.00 0.00 104D 96

ATOM 47 O6 G A 2 1.780 1.865 3.007 1.00 0.00 104D 97

ATOM 48 N1 G A 2 3.659 2.918 2.299 1.00 0.00 104D 98

ATOM 49 C2 G A 2 4.972 2.925 1.861 1.00 0.00 104D 99

ATOM 50 N2 G A 2 5.512 4.117 1.587 1.00 0.00 104D 100

ATOM 51 N3 G A 2 5.706 1.810 1.706 1.00 0.00 104D 101

ATOM 52 C4 G A 2 5.033 0.675 2.045 1.00 0.00 104D 102

ATOM 53 1H5* G A 2 6.988 -5.367 0.997 1.00 0.00 104D 103

ATOM 54 2H5* G A 2 7.905 -5.234 2.493 1.00 0.00 104D 104

ATOM 55 H4* G A 2 8.420 -3.413 0.926 1.00 0.00 104D 105

ATOM 56 H3* G A 2 7.077 -2.575 3.494 1.00 0.00 104D 106

ATOM 57 1H2* G A 2 7.848 -0.262 2.763 1.00 0.00 104D 107

ATOM 58 2HO* G A 2 9.863 -1.151 1.807 1.00 0.00 104D 108

ATOM 59 H1* G A 2 6.768 -0.474 0.581 1.00 0.00 104D 109

ATOM 60 H8 G A 2 4.721 -2.385 2.348 1.00 0.00 104D 110

ATOM 61 H1 G A 2 3.162 3.796 2.391 1.00 0.00 104D 111

ATOM 62 1H2 G A 2 4.971 4.961 1.721 1.00 0.00 104D 112

ATOM 63 2H2 G A 2 6.468 4.169 1.268 1.00 0.00 104D 113

ATOM 64 P C A 3 9.599 -2.305 4.812 1.00 0.00 104D 114

ATOM 65 O1P C A 3 11.049 -2.549 4.972 1.00 0.00 104D 115

ATOM 66 O2P C A 3 8.646 -2.871 5.792 1.00 0.00 104D 116

ATOM 67 O5* C A 3 9.350 -0.711 4.752 1.00 0.00 104D 117

ATOM 68 C5* C A 3 10.333 0.204 4.304 1.00 0.00 104D 118

ATOM 69 C4* C A 3 9.783 1.639 4.379 1.00 0.00 104D 119

ATOM 70 O4* C A 3 8.585 1.896 3.638 1.00 0.00 104D 120

ATOM 71 C3* C A 3 9.407 2.068 5.795 1.00 0.00 104D 121

ATOM 72 O3* C A 3 10.497 2.276 6.671 1.00 0.00 104D 122

ATOM 73 C2* C A 3 8.728 3.380 5.432 1.00 0.00 104D 123

ATOM 74 O2* C A 3 9.647 4.320 4.906 1.00 0.00 104D 124

ATOM 75 C1* C A 3 7.805 2.878 4.337 1.00 0.00 104D 125

ATOM 76 N1 C A 3 6.501 2.363 4.862 1.00 0.00 104D 126

ATOM 77 C2 C A 3 5.462 3.277 5.070 1.00 0.00 104D 127

ATOM 78 O2 C A 3 5.640 4.485 4.935 1.00 0.00 104D 128

ATOM 79 N3 C A 3 4.232 2.806 5.423 1.00 0.00 104D 129

ATOM 80 C4 C A 3 4.017 1.496 5.614 1.00 0.00 104D 130

ATOM 81 N4 C A 3 2.796 1.078 5.962 1.00 0.00 104D 131

ATOM 82 C5 C A 3 5.063 0.539 5.410 1.00 0.00 104D 132

ATOM 83 C6 C A 3 6.269 1.021 5.036 1.00 0.00 104D 133

ATOM 84 1H5* C A 3 10.690 -0.022 3.293 1.00 0.00 104D 134

ATOM 85 2H5* C A 3 11.191 0.144 4.974 1.00 0.00 104D 135

ATOM 86 H4* C A 3 10.572 2.287 3.995 1.00 0.00 104D 136

ATOM 87 H3* C A 3 8.677 1.348 6.184 1.00 0.00 104D 137

ATOM 88 1H2* C A 3 8.201 3.871 6.224 1.00 0.00 104D 138

ATOM 89 2HO* C A 3 10.355 4.437 5.543 1.00 0.00 104D 139

ATOM 90 H1* C A 3 7.569 3.742 3.740 1.00 0.00 104D 140

ATOM 91 1H4 C A 3 2.054 1.751 6.090 1.00 0.00 104D 141

ATOM 92 2H4 C A 3 2.615 0.094 6.088 1.00 0.00 104D 142

ATOM 93 H5 C A 3 4.920 -0.526 5.494 1.00 0.00 104D 143

ATOM 94 H6 C A 3 7.053 0.316 4.860 1.00 0.00 104D 144

ATOM 95 P G A 4 10.275 2.330 8.272 1.00 0.00 104D 145

ATOM 96 O1P G A 4 11.552 2.752 8.889 1.00 0.00 104D 146

ATOM 97 O2P G A 4 9.651 1.054 8.683 1.00 0.00 104D 147

ATOM 98 O5* G A 4 9.188 3.504 8.503 1.00 0.00 104D 148

ATOM 99 C5* G A 4 9.537 4.873 8.424 1.00 0.00 104D 149

ATOM 100 C4* G A 4 8.323 5.773 8.685 1.00 0.00 104D 150

ATOM 101 O4* G A 4 7.252 5.592 7.771 1.00 0.00 104D 151

ATOM 102 C3* G A 4 7.693 5.552 10.056 1.00 0.00 104D 152

ATOM 103 O3* G A 4 8.510 6.102 11.076 1.00 0.00 104D 153

ATOM 104 C2* G A 4 6.407 6.342 9.853 1.00 0.00 104D 154

ATOM 105 O2* G A 4 6.646 7.736 9.866 1.00 0.00 104D 155

ATOM 106 C1* G A 4 6.044 5.898 8.459 1.00 0.00 104D 156

ATOM 107 N9 G A 4 5.093 4.779 8.513 1.00 0.00 104D 157

ATOM 108 C8 G A 4 5.350 3.473 8.290 1.00 0.00 104D 158

ATOM 109 N7 G A 4 4.321 2.682 8.419 1.00 0.00 104D 159

ATOM 110 C5 G A 4 3.279 3.558 8.716 1.00 0.00 104D 160

ATOM 111 C6 G A 4 1.883 3.315 8.905 1.00 0.00 104D 161

ATOM 112 O6 G A 4 1.277 2.249 8.823 1.00 0.00 104D 162

ATOM 113 N1 G A 4 1.179 4.480 9.207 1.00 0.00 104D 163

ATOM 114 C2 G A 4 1.750 5.736 9.305 1.00 0.00 104D 164

ATOM 115 N2 G A 4 0.951 6.758 9.625 1.00 0.00 104D 165

ATOM 116 N3 G A 4 3.052 5.970 9.095 1.00 0.00 104D 166

ATOM 117 C4 G A 4 3.754 4.845 8.800 1.00 0.00 104D 167

ATOM 118 1H5* G A 4 9.947 5.105 7.443 1.00 0.00 104D 168

ATOM 119 2H5* G A 4 10.296 5.095 9.176 1.00 0.00 104D 169

ATOM 120 H4* G A 4 8.657 6.809 8.609 1.00 0.00 104D 170

ATOM 121 H3* G A 4 7.463 4.485 10.161 1.00 0.00 104D 171

ATOM 122 1H2* G A 4 5.570 6.088 10.483 1.00 0.00 104D 172

ATOM 123 2HO* G A 4 7.117 7.951 10.674 1.00 0.00 104D 173

ATOM 124 H1* G A 4 5.496 6.686 8.020 1.00 0.00 104D 174

ATOM 125 H8 G A 4 6.349 3.224 8.005 1.00 0.00 104D 175

ATOM 126 H1 G A 4 0.183 4.380 9.358 1.00 0.00 104D 176

ATOM 127 1H2 G A 4 -0.030 6.604 9.809 1.00 0.00 104D 177

ATOM 128 2H2 G A 4 1.339 7.687 9.695 1.00 0.00 104D 178

ATOM 129 P T A 5 8.269 5.780 12.635 1.00 0.00 104D 179

ATOM 130 O1P T A 5 8.272 4.309 12.796 1.00 0.00 104D 180

ATOM 131 O2P T A 5 9.206 6.608 13.424 1.00 0.00 104D 181

ATOM 132 O5* T A 5 6.770 6.296 12.915 1.00 0.00 104D 182

ATOM 133 C5* T A 5 6.452 7.619 13.312 1.00 0.00 104D 183

ATOM 134 C4* T A 5 4.941 7.680 13.586 1.00 0.00 104D 184

ATOM 135 O4* T A 5 4.206 7.151 12.487 1.00 0.00 104D 185

ATOM 136 C3* T A 5 4.574 6.820 14.795 1.00 0.00 104D 186

ATOM 137 O3* T A 5 4.547 7.600 15.985 1.00 0.00 104D 187

ATOM 138 C2* T A 5 3.214 6.239 14.454 1.00 0.00 104D 188

ATOM 139 C1* T A 5 3.065 6.441 12.957 1.00 0.00 104D 189

ATOM 140 N1 T A 5 2.911 5.089 12.367 1.00 0.00 104D 190

ATOM 141 C2 T A 5 1.630 4.538 12.355 1.00 0.00 104D 191

ATOM 142 O2 T A 5 0.617 5.182 12.620 1.00 0.00 104D 192

ATOM 143 N3 T A 5 1.550 3.180 12.101 1.00 0.00 104D 193

ATOM 144 C4 T A 5 2.615 2.326 11.866 1.00 0.00 104D 194

ATOM 145 O4 T A 5 2.398 1.136 11.648 1.00 0.00 104D 195

ATOM 146 C5 T A 5 3.918 2.963 11.957 1.00 0.00 104D 196

ATOM 147 C5M T A 5 5.175 2.132 11.794 1.00 0.00 104D 197

ATOM 148 C6 T A 5 4.018 4.295 12.205 1.00 0.00 104D 198

ATOM 149 1H5* T A 5 6.725 8.344 12.545 1.00 0.00 104D 199

ATOM 150 2H5* T A 5 6.983 7.870 14.232 1.00 0.00 104D 200

ATOM 151 H4* T A 5 4.671 8.723 13.775 1.00 0.00 104D 201

ATOM 152 H3* T A 5 5.267 5.972 14.814 1.00 0.00 104D 202

ATOM 153 1H2* T A 5 2.360 6.682 14.977 1.00 0.00 104D 203

ATOM 154 2H2* T A 5 3.297 5.176 14.655 1.00 0.00 104D 204

ATOM 155 H1* T A 5 2.172 7.025 12.788 1.00 0.00 104D 205

ATOM 156 H3 T A 5 0.621 2.785 12.095 1.00 0.00 104D 206

ATOM 157 1H5M T A 5 5.029 1.389 11.009 1.00 0.00 104D 207

ATOM 158 2H5M T A 5 6.023 2.763 11.523 1.00 0.00 104D 208

ATOM 159 3H5M T A 5 5.395 1.624 12.733 1.00 0.00 104D 209

ATOM 160 H6 T A 5 4.979 4.758 12.370 1.00 0.00 104D 210

ATOM 161 P A A 6 4.126 7.004 17.436 1.00 0.00 104D 211

ATOM 162 O1P A A 6 4.630 5.615 17.522 1.00 0.00 104D 212

ATOM 163 O2P A A 6 4.532 7.991 18.461 1.00 0.00 104D 213

ATOM 164 O5* A A 6 2.506 6.938 17.432 1.00 0.00 104D 214

ATOM 165 C5* A A 6 1.696 8.099 17.327 1.00 0.00 104D 215

ATOM 166 C4* A A 6 0.214 7.706 17.194 1.00 0.00 104D 216

ATOM 167 O4* A A 6 0.094 6.755 16.146 1.00 0.00 104D 217

ATOM 168 C3* A A 6 -0.365 7.099 18.482 1.00 0.00 104D 218

ATOM 169 O3* A A 6 -1.450 7.866 18.995 1.00 0.00 104D 219

ATOM 170 C2* A A 6 -0.823 5.714 18.047 1.00 0.00 104D 220

ATOM 171 C1* A A 6 -0.768 5.704 16.532 1.00 0.00 104D 221

ATOM 172 N9 A A 6 -0.220 4.399 16.120 1.00 0.00 104D 222

ATOM 173 C8 A A 6 1.059 3.942 16.277 1.00 0.00 104D 223

ATOM 174 N7 A A 6 1.281 2.786 15.714 1.00 0.00 104D 224

ATOM 175 C5 A A 6 0.015 2.394 15.285 1.00 0.00 104D 225

ATOM 176 C6 A A 6 -0.478 1.225 14.672 1.00 0.00 104D 226

ATOM 177 N6 A A 6 0.326 0.303 14.132 1.00 0.00 104D 227

ATOM 178 N1 A A 6 -1.814 1.037 14.636 1.00 0.00 104D 228

ATOM 179 C2 A A 6 -2.617 1.991 15.112 1.00 0.00 104D 229

ATOM 180 N3 A A 6 -2.277 3.178 15.607 1.00 0.00 104D 230

ATOM 181 C4 A A 6 -0.926 3.317 15.664 1.00 0.00 104D 231

ATOM 182 1H5* A A 6 1.985 8.661 16.438 1.00 0.00 104D 232

ATOM 183 2H5* A A 6 1.831 8.735 18.203 1.00 0.00 104D 233

ATOM 184 H4* A A 6 -0.360 8.596 16.931 1.00 0.00 104D 234

ATOM 185 H3* A A 6 0.425 7.006 19.228 1.00 0.00 104D 235

ATOM 186 1H2* A A 6 -1.850 5.499 18.362 1.00 0.00 104D 236

ATOM 187 2H2* A A 6 -0.068 4.996 18.395 1.00 0.00 104D 237

ATOM 188 H1* A A 6 -1.746 5.846 16.078 1.00 0.00 104D 238

ATOM 189 H8 A A 6 1.780 4.511 16.850 1.00 0.00 104D 239

ATOM 190 1H6 A A 6 -0.059 -0.510 13.670 1.00 0.00 104D 240

ATOM 191 2H6 A A 6 1.325 0.450 14.143 1.00 0.00 104D 241

ATOM 192 H2 A A 6 -3.680 1.794 15.105 1.00 0.00 104D 242

ATOM 193 P T A 7 -2.084 7.603 20.473 1.00 0.00 104D 243

ATOM 194 O1P T A 7 -1.004 7.105 21.354 1.00 0.00 104D 244

ATOM 195 O2P T A 7 -2.838 8.815 20.863 1.00 0.00 104D 245

ATOM 196 O5* T A 7 -3.149 6.397 20.279 1.00 0.00 104D 246

ATOM 197 C5* T A 7 -4.502 6.632 19.923 1.00 0.00 104D 247

ATOM 198 C4* T A 7 -5.150 5.348 19.369 1.00 0.00 104D 248

ATOM 199 O4* T A 7 -4.189 4.574 18.653 1.00 0.00 104D 249

ATOM 200 C3* T A 7 -5.740 4.450 20.467 1.00 0.00 104D 250

ATOM 201 O3* T A 7 -6.995 3.934 20.043 1.00 0.00 104D 251

ATOM 202 C2* T A 7 -4.694 3.348 20.568 1.00 0.00 104D 252

ATOM 203 C1* T A 7 -4.226 3.239 19.128 1.00 0.00 104D 253

ATOM 204 N1 T A 7 -2.904 2.553 19.042 1.00 0.00 104D 254

ATOM 205 C2 T A 7 -2.809 1.402 18.257 1.00 0.00 104D 255

ATOM 206 O2 T A 7 -3.778 0.840 17.753 1.00 0.00 104D 256

ATOM 207 N3 T A 7 -1.535 0.888 18.073 1.00 0.00 104D 257

ATOM 208 C4 T A 7 -0.371 1.372 18.647 1.00 0.00 104D 258

ATOM 209 O4 T A 7 0.704 0.833 18.399 1.00 0.00 104D 259

ATOM 210 C5 T A 7 -0.575 2.467 19.576 1.00 0.00 104D 260

ATOM 211 C5M T A 7 0.606 3.005 20.360 1.00 0.00 104D 261

ATOM 212 C6 T A 7 -1.807 3.014 19.742 1.00 0.00 104D 262

ATOM 213 1H5* T A 7 -4.573 7.419 19.171 1.00 0.00 104D 263

ATOM 214 2H5* T A 7 -5.050 6.990 20.795 1.00 0.00 104D 264

ATOM 215 H4* T A 7 -5.954 5.649 18.694 1.00 0.00 104D 265

ATOM 216 H3* T A 7 -5.846 4.999 21.404 1.00 0.00 104D 266

ATOM 217 1H2* T A 7 -5.093 2.388 20.875 1.00 0.00 104D 267

ATOM 218 2H2* T A 7 -3.893 3.685 21.228 1.00 0.00 104D 268

ATOM 219 H1* T A 7 -5.001 2.705 18.572 1.00 0.00 104D 269

ATOM 220 H3 T A 7 -1.468 0.067 17.486 1.00 0.00 104D 270

ATOM 221 1H5M T A 7 0.378 3.979 20.796 1.00 0.00 104D 271

ATOM 222 2H5M T A 7 0.855 2.307 21.159 1.00 0.00 104D 272

ATOM 223 3H5M T A 7 1.467 3.113 19.699 1.00 0.00 104D 273

ATOM 224 H6 T A 7 -1.922 3.819 20.461 1.00 0.00 104D 274

ATOM 225 P A A 8 -7.971 3.103 21.035 1.00 0.00 104D 275

ATOM 226 O1P A A 8 -7.662 3.500 22.427 1.00 0.00 104D 276

ATOM 227 O2P A A 8 -9.354 3.249 20.528 1.00 0.00 104D 277

ATOM 228 O5* A A 8 -7.526 1.557 20.854 1.00 0.00 104D 278

ATOM 229 C5* A A 8 -8.178 0.694 19.938 1.00 0.00 104D 279

ATOM 230 C4* A A 8 -7.640 -0.737 20.058 1.00 0.00 104D 280

ATOM 231 O4* A A 8 -6.263 -0.822 19.727 1.00 0.00 104D 281

ATOM 232 C3* A A 8 -7.825 -1.315 21.469 1.00 0.00 104D 282

ATOM 233 O3* A A 8 -8.716 -2.429 21.361 1.00 0.00 104D 283

ATOM 234 C2* A A 8 -6.409 -1.733 21.861 1.00 0.00 104D 284

ATOM 235 C1* A A 8 -5.662 -1.812 20.543 1.00 0.00 104D 285

ATOM 236 N9 A A 8 -4.211 -1.579 20.617 1.00 0.00 104D 286

ATOM 237 C8 A A 8 -3.548 -0.517 21.157 1.00 0.00 104D 287

ATOM 238 N7 A A 8 -2.260 -0.518 20.932 1.00 0.00 104D 288

ATOM 239 C5 A A 8 -2.057 -1.686 20.197 1.00 0.00 104D 289

ATOM 240 C6 A A 8 -0.912 -2.313 19.655 1.00 0.00 104D 290

ATOM 241 N6 A A 8 0.320 -1.795 19.737 1.00 0.00 104D 291

ATOM 242 N1 A A 8 -1.065 -3.512 19.056 1.00 0.00 104D 292

ATOM 243 C2 A A 8 -2.280 -4.054 18.975 1.00 0.00 104D 293

ATOM 244 N3 A A 8 -3.427 -3.554 19.417 1.00 0.00 104D 294

ATOM 245 C4 A A 8 -3.244 -2.352 20.027 1.00 0.00 104D 295

ATOM 246 1H5* A A 8 -8.054 1.049 18.915 1.00 0.00 104D 296

ATOM 247 2H5* A A 8 -9.245 0.665 20.166 1.00 0.00 104D 297

ATOM 248 H4* A A 8 -8.185 -1.353 19.340 1.00 0.00 104D 298

ATOM 249 H3* A A 8 -8.196 -0.575 22.178 1.00 0.00 104D 299

ATOM 250 1H2* A A 8 -6.510 -2.692 22.297 1.00 0.00 104D 300

ATOM 251 2H2* A A 8 -5.897 -1.111 22.587 1.00 0.00 104D 301

ATOM 252 H1* A A 8 -5.785 -2.829 20.200 1.00 0.00 104D 302

ATOM 253 H8 A A 8 -4.092 0.230 21.712 1.00 0.00 104D 303

ATOM 254 1H6 A A 8 1.114 -2.282 19.341 1.00 0.00 104D 304

ATOM 255 2H6 A A 8 0.449 -0.889 20.163 1.00 0.00 104D 305

ATOM 256 H2 A A 8 -2.359 -5.033 18.520 1.00 0.00 104D 306

ATOM 257 P C A 9 -9.083 -3.426 22.592 1.00 0.00 104D 307

ATOM 258 O1P C A 9 -10.380 -4.072 22.288 1.00 0.00 104D 308

ATOM 259 O2P C A 9 -8.917 -2.678 23.858 1.00 0.00 104D 309

ATOM 260 O5* C A 9 -7.924 -4.562 22.522 1.00 0.00 104D 310

ATOM 261 C5* C A 9 -7.968 -5.617 21.578 1.00 0.00 104D 311

ATOM 262 C4* C A 9 -6.639 -6.392 21.502 1.00 0.00 104D 312

ATOM 263 O4* C A 9 -5.470 -5.597 21.254 1.00 0.00 104D 313

ATOM 264 C3* C A 9 -6.368 -7.177 22.791 1.00 0.00 104D 314

ATOM 265 O3* C A 9 -6.406 -8.572 22.485 1.00 0.00 104D 315

ATOM 266 C2* C A 9 -4.966 -6.727 23.207 1.00 0.00 104D 316

ATOM 267 C1* C A 9 -4.344 -6.182 21.921 1.00 0.00 104D 317

ATOM 268 N1 C A 9 -3.229 -5.207 22.167 1.00 0.00 104D 318

ATOM 269 C2 C A 9 -1.949 -5.501 21.672 1.00 0.00 104D 319

ATOM 270 O2 C A 9 -1.728 -6.498 20.989 1.00 0.00 104D 320

ATOM 271 N3 C A 9 -0.925 -4.642 21.936 1.00 0.00 104D 321

ATOM 272 C4 C A 9 -1.107 -3.544 22.678 1.00 0.00 104D 322

ATOM 273 N4 C A 9 -0.058 -2.747 22.906 1.00 0.00 104D 323

ATOM 274 C5 C A 9 -2.408 -3.207 23.180 1.00 0.00 104D 324

ATOM 275 C6 C A 9 -3.420 -4.051 22.892 1.00 0.00 104D 325

ATOM 276 1H5* C A 9 -8.243 -5.256 20.587 1.00 0.00 104D 326

ATOM 277 2H5* C A 9 -8.750 -6.313 21.883 1.00 0.00 104D 327

ATOM 278 H4* C A 9 -6.799 -7.091 20.675 1.00 0.00 104D 328

ATOM 279 H3* C A 9 -7.093 -6.933 23.568 1.00 0.00 104D 329

ATOM 280 1H2* C A 9 -4.505 -7.658 23.571 1.00 0.00 104D 330

ATOM 281 2H2* C A 9 -4.978 -5.869 23.913 1.00 0.00 104D 331

ATOM 282 H1* C A 9 -3.918 -7.027 21.380 1.00 0.00 104D 332

ATOM 283 1H4 C A 9 0.847 -3.003 22.533 1.00 0.00 104D 333

ATOM 284 2H4 C A 9 -0.166 -1.905 23.452 1.00 0.00 104D 334

ATOM 285 H5 C A 9 -2.645 -2.337 23.767 1.00 0.00 104D 335

ATOM 286 H6 C A 9 -4.381 -3.757 23.268 1.00 0.00 104D 336

ATOM 287 P G A 10 -6.312 -9.739 23.614 1.00 0.00 104D 337

ATOM 288 O1P G A 10 -6.878 -10.976 23.032 1.00 0.00 104D 338

ATOM 289 O2P G A 10 -6.873 -9.204 24.875 1.00 0.00 104D 339

ATOM 290 O5* G A 10 -4.722 -9.975 23.840 1.00 0.00 104D 340

ATOM 291 C5* G A 10 -3.955 -10.794 22.977 1.00 0.00 104D 341

ATOM 292 C4* G A 10 -2.464 -10.819 23.357 1.00 0.00 104D 342

ATOM 293 O4* G A 10 -1.765 -9.610 23.044 1.00 0.00 104D 343

ATOM 294 C3* G A 10 -2.223 -11.089 24.852 1.00 0.00 104D 344

ATOM 295 O3* G A 10 -1.401 -12.247 25.014 1.00 0.00 104D 345

ATOM 296 C2* G A 10 -1.530 -9.829 25.304 1.00 0.00 104D 346

ATOM 297 C1* G A 10 -0.800 -9.386 24.068 1.00 0.00 104D 347

ATOM 298 N9 G A 10 -0.308 -7.996 24.186 1.00 0.00 104D 348

ATOM 299 C8 G A 10 -1.007 -6.847 24.439 1.00 0.00 104D 349

ATOM 300 N7 G A 10 -0.266 -5.786 24.582 1.00 0.00 104D 350

ATOM 301 C5 G A 10 1.024 -6.254 24.379 1.00 0.00 104D 351

ATOM 302 C6 G A 10 2.265 -5.550 24.367 1.00 0.00 104D 352

ATOM 303 O6 G A 10 2.445 -4.341 24.481 1.00 0.00 104D 353

ATOM 304 N1 G A 10 3.355 -6.400 24.204 1.00 0.00 104D 354

ATOM 305 C2 G A 10 3.260 -7.773 24.064 1.00 0.00 104D 355

ATOM 306 N2 G A 10 4.398 -8.463 23.954 1.00 0.00 104D 356

ATOM 307 N3 G A 10 2.092 -8.429 24.035 1.00 0.00 104D 357

ATOM 308 C4 G A 10 1.014 -7.615 24.189 1.00 0.00 104D 358

ATOM 309 1H5* G A 10 -4.059 -10.470 21.942 1.00 0.00 104D 359

ATOM 310 2H5* G A 10 -4.332 -11.815 23.055 1.00 0.00 104D 360

ATOM 311 H4* G A 10 -2.039 -11.634 22.765 1.00 0.00 104D 361

ATOM 312 H3* G A 10 -3.110 -11.118 25.470 1.00 0.00 104D 362

ATOM 313 1H2* G A 10 -0.849 -10.150 26.058 1.00 0.00 104D 363

ATOM 314 2H2* G A 10 -2.233 -9.061 25.640 1.00 0.00 104D 364

ATOM 315 H1* G A 10 0.065 -10.039 24.030 1.00 0.00 104D 365

ATOM 316 H8 G A 10 -2.078 -6.816 24.514 1.00 0.00 104D 366

ATOM 317 H1 G A 10 4.272 -5.970 24.202 1.00 0.00 104D 367

ATOM 318 1H2 G A 10 5.290 -7.989 23.983 1.00 0.00 104D 368

ATOM 319 2H2 G A 10 4.361 -9.467 23.859 1.00 0.00 104D 369

ATOM 320 P C A 11 -0.962 -12.838 26.468 1.00 0.00 104D 370

ATOM 321 O1P C A 11 -0.853 -14.308 26.338 1.00 0.00 104D 371

ATOM 322 O2P C A 11 -1.867 -12.266 27.489 1.00 0.00 104D 372

ATOM 323 O5* C A 11 0.530 -12.245 26.747 1.00 0.00 104D 373

ATOM 324 C5* C A 11 1.689 -12.893 26.248 1.00 0.00 104D 374

ATOM 325 C4* C A 11 3.008 -12.260 26.724 1.00 0.00 104D 375

ATOM 326 O4* C A 11 3.122 -10.869 26.433 1.00 0.00 104D 376

ATOM 327 C3* C A 11 3.243 -12.411 28.231 1.00 0.00 104D 377

ATOM 328 O3* C A 11 4.569 -12.915 28.401 1.00 0.00 104D 378

ATOM 329 C2* C A 11 3.089 -10.993 28.775 1.00 0.00 104D 379

ATOM 330 C1* C A 11 3.596 -10.165 27.583 1.00 0.00 104D 380

ATOM 331 N1 C A 11 3.081 -8.756 27.528 1.00 0.00 104D 381

ATOM 332 C2 C A 11 4.022 -7.731 27.352 1.00 0.00 104D 382

ATOM 333 O2 C A 11 5.222 -7.959 27.211 1.00 0.00 104D 383

ATOM 334 N3 C A 11 3.598 -6.439 27.353 1.00 0.00 104D 384

ATOM 335 C4 C A 11 2.304 -6.132 27.490 1.00 0.00 104D 385

ATOM 336 N4 C A 11 1.960 -4.841 27.498 1.00 0.00 104D 386

ATOM 337 C5 C A 11 1.300 -7.158 27.531 1.00 0.00 104D 387

ATOM 338 C6 C A 11 1.728 -8.446 27.542 1.00 0.00 104D 388

ATOM 339 1H5* C A 11 1.678 -12.914 25.159 1.00 0.00 104D 389

ATOM 340 2H5* C A 11 1.691 -13.928 26.592 1.00 0.00 104D 390

ATOM 341 H4* C A 11 3.775 -12.819 26.177 1.00 0.00 104D 391

ATOM 342 H3* C A 11 2.499 -13.059 28.691 1.00 0.00 104D 392

ATOM 343 1H2* C A 11 3.749 -10.974 29.667 1.00 0.00 104D 393

ATOM 344 2H2* C A 11 2.015 -10.751 28.967 1.00 0.00 104D 394

ATOM 345 H1* C A 11 4.701 -10.166 27.651 1.00 0.00 104D 395

ATOM 346 1H4 C A 11 2.690 -4.146 27.408 1.00 0.00 104D 396

ATOM 347 2H4 C A 11 0.991 -4.568 27.543 1.00 0.00 104D 397

ATOM 348 H5 C A 11 0.241 -6.941 27.531 1.00 0.00 104D 398

ATOM 349 H6 C A 11 0.943 -9.200 27.547 1.00 0.00 104D 399

ATOM 350 P G A 12 5.252 -13.208 29.846 1.00 0.00 104D 400

ATOM 351 O1P G A 12 6.201 -14.332 29.680 1.00 0.00 104D 401

ATOM 352 O2P G A 12 4.176 -13.306 30.858 1.00 0.00 104D 402

ATOM 353 O5* G A 12 6.111 -11.863 30.154 1.00 0.00 104D 403

ATOM 354 C5* G A 12 7.464 -11.738 29.746 1.00 0.00 104D 404

ATOM 355 C4* G A 12 8.080 -10.386 30.141 1.00 0.00 104D 405

ATOM 356 O4* G A 12 7.371 -9.265 29.614 1.00 0.00 104D 406

ATOM 357 C3* G A 12 8.147 -10.188 31.663 1.00 0.00 104D 407

ATOM 358 O3* G A 12 9.485 -10.014 32.080 1.00 0.00 104D 408

ATOM 359 C2* G A 12 7.359 -8.907 31.911 1.00 0.00 104D 409

ATOM 360 C1* G A 12 7.419 -8.202 30.561 1.00 0.00 104D 410

ATOM 361 N9 G A 12 6.281 -7.263 30.410 1.00 0.00 104D 411

ATOM 362 C8 G A 12 4.941 -7.544 30.433 1.00 0.00 104D 412

ATOM 363 N7 G A 12 4.163 -6.507 30.308 1.00 0.00 104D 413

ATOM 364 C5 G A 12 5.050 -5.446 30.179 1.00 0.00 104D 414

ATOM 365 C6 G A 12 4.793 -4.057 29.967 1.00 0.00 104D 415

ATOM 366 O6 G A 12 3.714 -3.505 29.752 1.00 0.00 104D 416

ATOM 367 N1 G A 12 5.964 -3.304 29.955 1.00 0.00 104D 417

ATOM 368 C2 G A 12 7.237 -3.828 30.087 1.00 0.00 104D 418

ATOM 369 N2 G A 12 8.261 -2.972 30.010 1.00 0.00 104D 419

ATOM 370 N3 G A 12 7.481 -5.138 30.246 1.00 0.00 104D 420

ATOM 371 C4 G A 12 6.349 -5.893 30.280 1.00 0.00 104D 421

ATOM 372 1H5* G A 12 7.561 -11.879 28.669 1.00 0.00 104D 422

ATOM 373 2H5* G A 12 8.049 -12.520 30.233 1.00 0.00 104D 423

ATOM 374 H4* G A 12 9.095 -10.417 29.731 1.00 0.00 104D 424

ATOM 375 H3* G A 12 7.684 -11.013 32.204 1.00 0.00 104D 425

ATOM 376 1H2* G A 12 7.791 -8.289 32.699 1.00 0.00 104D 426

ATOM 377 2H2* G A 12 6.332 -9.175 32.162 1.00 0.00 104D 427

ATOM 378 H1* G A 12 8.357 -7.642 30.504 1.00 0.00 104D 428

ATOM 379 H8 G A 12 4.568 -8.543 30.545 1.00 0.00 104D 429

ATOM 380 H1 G A 12 5.855 -2.312 29.781 1.00 0.00 104D 430

ATOM 381 1H2 G A 12 8.086 -1.984 29.881 1.00 0.00 104D 431

ATOM 382 2H2 G A 12 9.207 -3.318 30.065 1.00 0.00 104D 432

ATOM 383 H3T G A 12 9.864 -9.277 31.596 1.00 0.00 104D 433

TER 384 G A 12 104D 434

ATOM 385 O5* C B 13 5.776 5.559 27.666 1.00 0.00 104D 435

ATOM 386 C5* C B 13 7.021 5.735 28.310 1.00 0.00 104D 436

ATOM 387 C4* C B 13 7.745 4.401 28.521 1.00 0.00 104D 437

ATOM 388 O4* C B 13 6.959 3.512 29.320 1.00 0.00 104D 438

ATOM 389 C3* C B 13 8.043 3.656 27.216 1.00 0.00 104D 439

ATOM 390 O3* C B 13 9.261 4.028 26.584 1.00 0.00 104D 440

ATOM 391 C2* C B 13 8.138 2.242 27.745 1.00 0.00 104D 441

ATOM 392 O2* C B 13 9.457 1.942 28.173 1.00 0.00 104D 442

ATOM 393 C1* C B 13 7.215 2.164 28.931 1.00 0.00 104D 443

ATOM 394 N1 C B 13 5.993 1.338 28.691 1.00 0.00 104D 444

ATOM 395 C2 C B 13 5.962 0.036 29.213 1.00 0.00 104D 445

ATOM 396 O2 C B 13 6.880 -0.425 29.889 1.00 0.00 104D 446

ATOM 397 N3 C B 13 4.888 -0.752 28.951 1.00 0.00 104D 447

ATOM 398 C4 C B 13 3.875 -0.320 28.196 1.00 0.00 104D 448

ATOM 399 N4 C B 13 2.864 -1.168 27.987 1.00 0.00 104D 449

ATOM 400 C5 C B 13 3.871 1.012 27.650 1.00 0.00 104D 450

ATOM 401 C6 C B 13 4.944 1.798 27.925 1.00 0.00 104D 451

ATOM 402 1H5* C B 13 6.850 6.204 29.279 1.00 0.00 104D 452

ATOM 403 2H5* C B 13 7.644 6.395 27.704 1.00 0.00 104D 453

ATOM 404 H4* C B 13 8.689 4.621 29.028 1.00 0.00 104D 454

ATOM 405 H3* C B 13 7.192 3.726 26.537 1.00 0.00 104D 455

ATOM 406 1H2* C B 13 7.752 1.551 27.039 1.00 0.00 104D 456

ATOM 407 2HO* C B 13 9.774 2.662 28.722 1.00 0.00 104D 457

ATOM 408 H1* C B 13 7.852 1.604 29.594 1.00 0.00 104D 458

ATOM 409 1H4 C B 13 2.923 -2.092 28.402 1.00 0.00 104D 459

ATOM 410 2H4 C B 13 2.076 -0.906 27.414 1.00 0.00 104D 460

ATOM 411 H5 C B 13 3.067 1.402 27.043 1.00 0.00 104D 461

ATOM 412 H6 C B 13 4.967 2.804 27.527 1.00 0.00 104D 462

ATOM 413 H5T C B 13 5.932 5.320 26.750 1.00 0.00 104D 463

ATOM 414 P G B 14 9.758 3.324 25.202 1.00 0.00 104D 464

ATOM 415 O1P G B 14 10.967 4.046 24.750 1.00 0.00 104D 465

ATOM 416 O2P G B 14 8.582 3.249 24.307 1.00 0.00 104D 466

ATOM 417 O5* G B 14 10.192 1.798 25.564 1.00 0.00 104D 467

ATOM 418 C5* G B 14 11.493 1.459 26.032 1.00 0.00 104D 468

ATOM 419 C4* G B 14 11.627 -0.051 26.333 1.00 0.00 104D 469

ATOM 420 O4* G B 14 10.714 -0.581 27.297 1.00 0.00 104D 470

ATOM 421 C3* G B 14 11.420 -0.933 25.104 1.00 0.00 104D 471

ATOM 422 O3* G B 14 12.514 -0.923 24.207 1.00 0.00 104D 472

ATOM 423 C2* G B 14 11.291 -2.285 25.793 1.00 0.00 104D 473

ATOM 424 O2* G B 14 12.531 -2.725 26.313 1.00 0.00 104D 474

ATOM 425 C1* G B 14 10.362 -1.916 26.907 1.00 0.00 104D 475

ATOM 426 N9 G B 14 8.935 -2.146 26.623 1.00 0.00 104D 476

ATOM 427 C8 G B 14 8.055 -1.159 26.463 1.00 0.00 104D 477

ATOM 428 N7 G B 14 6.797 -1.483 26.476 1.00 0.00 104D 478

ATOM 429 C5 G B 14 6.852 -2.856 26.683 1.00 0.00 104D 479

ATOM 430 C6 G B 14 5.790 -3.799 26.824 1.00 0.00 104D 480

ATOM 431 O6 G B 14 4.580 -3.589 26.786 1.00 0.00 104D 481

ATOM 432 N1 G B 14 6.259 -5.094 27.027 1.00 0.00 104D 482

ATOM 433 C2 G B 14 7.597 -5.441 27.098 1.00 0.00 104D 483

ATOM 434 N2 G B 14 7.877 -6.734 27.288 1.00 0.00 104D 484

ATOM 435 N3 G B 14 8.599 -4.552 26.986 1.00 0.00 104D 485

ATOM 436 C4 G B 14 8.163 -3.280 26.775 1.00 0.00 104D 486

ATOM 437 1H5* G B 14 11.770 2.049 26.912 1.00 0.00 104D 487

ATOM 438 2H5* G B 14 12.209 1.699 25.245 1.00 0.00 104D 488

ATOM 439 H4* G B 14 12.637 -0.216 26.711 1.00 0.00 104D 489

ATOM 440 H3* G B 14 10.473 -0.635 24.652 1.00 0.00 104D 490

ATOM 441 1H2* G B 14 10.807 -3.081 25.270 1.00 0.00 104D 491

ATOM 442 2HO* G B 14 13.165 -2.753 25.593 1.00 0.00 104D 492

ATOM 443 H1* G B 14 10.464 -2.634 27.648 1.00 0.00 104D 493

ATOM 444 H8 G B 14 8.552 -0.237 26.400 1.00 0.00 104D 494

ATOM 445 H1 G B 14 5.554 -5.815 27.120 1.00 0.00 104D 495

ATOM 446 1H2 G B 14 7.128 -7.411 27.354 1.00 0.00 104D 496

ATOM 447 2H2 G B 14 8.840 -7.032 27.344 1.00 0.00 104D 497

ATOM 448 P C B 15 12.376 -1.515 22.713 1.00 0.00 104D 498

ATOM 449 O1P C B 15 13.737 -1.647 22.148 1.00 0.00 104D 499

ATOM 450 O2P C B 15 11.361 -0.706 22.003 1.00 0.00 104D 500

ATOM 451 O5* C B 15 11.763 -2.994 22.925 1.00 0.00 104D 501

ATOM 452 C5* C B 15 12.570 -4.137 23.133 1.00 0.00 104D 502

ATOM 453 C4* C B 15 11.683 -5.385 23.285 1.00 0.00 104D 503

ATOM 454 O4* C B 15 10.715 -5.348 24.341 1.00 0.00 104D 504

ATOM 455 C3* C B 15 10.831 -5.675 22.053 1.00 0.00 104D 505

ATOM 456 O3* C B 15 11.545 -6.129 20.921 1.00 0.00 104D 506

ATOM 457 C2* C B 15 9.961 -6.771 22.651 1.00 0.00 104D 507

ATOM 458 O2* C B 15 10.685 -7.953 22.949 1.00 0.00 104D 508

ATOM 459 C1* C B 15 9.544 -6.074 23.933 1.00 0.00 104D 509

ATOM 460 N1 C B 15 8.319 -5.229 23.764 1.00 0.00 104D 510

ATOM 461 C2 C B 15 7.068 -5.841 23.898 1.00 0.00 104D 511

ATOM 462 O2 C B 15 6.966 -7.056 24.051 1.00 0.00 104D 512

ATOM 463 N3 C B 15 5.948 -5.063 23.866 1.00 0.00 104D 513

ATOM 464 C4 C B 15 6.026 -3.739 23.665 1.00 0.00 104D 514

ATOM 465 N4 C B 15 4.902 -3.016 23.641 1.00 0.00 104D 515

ATOM 466 C5 C B 15 7.293 -3.089 23.522 1.00 0.00 104D 516

ATOM 467 C6 C B 15 8.394 -3.870 23.583 1.00 0.00 104D 517

ATOM 468 1H5* C B 15 13.240 -4.029 23.993 1.00 0.00 104D 518

ATOM 469 2H5* C B 15 13.195 -4.283 22.251 1.00 0.00 104D 519

ATOM 470 H4* C B 15 12.366 -6.215 23.462 1.00 0.00 104D 520

ATOM 471 H3* C B 15 10.231 -4.782 21.844 1.00 0.00 104D 521

ATOM 472 1H2* C B 15 9.124 -7.071 22.055 1.00 0.00 104D 522

ATOM 473 2HO* C B 15 11.250 -7.792 23.707 1.00 0.00 104D 523

ATOM 474 H1* C B 15 9.270 -6.860 24.615 1.00 0.00 104D 524

ATOM 475 1H4 C B 15 4.010 -3.474 23.761 1.00 0.00 104D 525

ATOM 476 2H4 C B 15 4.946 -2.017 23.513 1.00 0.00 104D 526

ATOM 477 H5 C B 15 7.407 -2.022 23.418 1.00 0.00 104D 527

ATOM 478 H6 C B 15 9.347 -3.394 23.501 1.00 0.00 104D 528

ATOM 479 P G B 16 10.880 -6.082 19.449 1.00 0.00 104D 529

ATOM 480 O1P G B 16 11.784 -6.797 18.521 1.00 0.00 104D 530

ATOM 481 O2P G B 16 10.508 -4.678 19.169 1.00 0.00 104D 531

ATOM 482 O5* G B 16 9.511 -6.933 19.580 1.00 0.00 104D 532

ATOM 483 C5* G B 16 9.515 -8.346 19.649 1.00 0.00 104D 533

ATOM 484 C4* G B 16 8.089 -8.899 19.768 1.00 0.00 104D 534

ATOM 485 O4* G B 16 7.389 -8.476 20.928 1.00 0.00 104D 535

ATOM 486 C3* G B 16 7.183 -8.491 18.612 1.00 0.00 104D 536

ATOM 487 O3* G B 16 7.525 -9.195 17.430 1.00 0.00 104D 537

ATOM 488 C2* G B 16 5.848 -8.942 19.191 1.00 0.00 104D 538

ATOM 489 O2* G B 16 5.722 -10.350 19.171 1.00 0.00 104D 539

ATOM 490 C1* G B 16 6.001 -8.460 20.611 1.00 0.00 104D 540

ATOM 491 N9 G B 16 5.370 -7.144 20.773 1.00 0.00 104D 541

ATOM 492 C8 G B 16 5.983 -5.944 20.854 1.00 0.00 104D 542

ATOM 493 N7 G B 16 5.179 -4.925 20.971 1.00 0.00 104D 543

ATOM 494 C5 G B 16 3.917 -5.513 21.008 1.00 0.00 104D 544

ATOM 495 C6 G B 16 2.624 -4.934 21.191 1.00 0.00 104D 545

ATOM 496 O6 G B 16 2.337 -3.753 21.378 1.00 0.00 104D 546

ATOM 497 N1 G B 16 1.607 -5.886 21.150 1.00 0.00 104D 547

ATOM 498 C2 G B 16 1.810 -7.243 20.966 1.00 0.00 104D 548

ATOM 499 N2 G B 16 0.734 -8.033 20.930 1.00 0.00 104D 549

ATOM 500 N3 G B 16 3.024 -7.791 20.827 1.00 0.00 104D 550

ATOM 501 C4 G B 16 4.028 -6.876 20.863 1.00 0.00 104D 551

ATOM 502 1H5* G B 16 10.103 -8.685 20.501 1.00 0.00 104D 552

ATOM 503 2H5* G B 16 9.962 -8.748 18.740 1.00 0.00 104D 553

ATOM 504 H4* G B 16 8.160 -9.988 19.799 1.00 0.00 104D 554

ATOM 505 H3* G B 16 7.201 -7.397 18.530 1.00 0.00 104D 555

ATOM 506 1H2* G B 16 4.959 -8.470 18.803 1.00 0.00 104D 556

ATOM 507 2HO* G B 16 5.886 -10.653 18.276 1.00 0.00 104D 557

ATOM 508 H1* G B 16 5.423 -9.104 21.215 1.00 0.00 104D 558

ATOM 509 H8 G B 16 7.051 -5.952 20.845 1.00 0.00 104D 559

ATOM 510 H1 G B 16 0.662 -5.543 21.270 1.00 0.00 104D 560

ATOM 511 1H2 G B 16 -0.194 -7.641 21.011 1.00 0.00 104D 561

ATOM 512 2H2 G B 16 0.853 -9.027 20.806 1.00 0.00 104D 562

ATOM 513 P T B 17 6.953 -8.772 15.986 1.00 0.00 104D 563

ATOM 514 O1P T B 17 7.276 -7.345 15.773 1.00 0.00 104D 564

ATOM 515 O2P T B 17 7.403 -9.782 15.003 1.00 0.00 104D 565

ATOM 516 O5* T B 17 5.355 -8.891 16.146 1.00 0.00 104D 566

ATOM 517 C5* T B 17 4.625 -10.081 15.903 1.00 0.00 104D 567

ATOM 518 C4* T B 17 3.130 -9.760 16.052 1.00 0.00 104D 568

ATOM 519 O4* T B 17 2.874 -9.102 17.288 1.00 0.00 104D 569

ATOM 520 C3* T B 17 2.670 -8.797 14.957 1.00 0.00 104D 570

ATOM 521 O3* T B 17 2.133 -9.507 13.847 1.00 0.00 104D 571

ATOM 522 C2* T B 17 1.637 -7.913 15.632 1.00 0.00 104D 572

ATOM 523 C1* T B 17 1.856 -8.121 17.119 1.00 0.00 104D 573

ATOM 524 N1 T B 17 2.200 -6.792 17.679 1.00 0.00 104D 574

ATOM 525 C2 T B 17 1.144 -5.946 18.014 1.00 0.00 104D 575

ATOM 526 O2 T B 17 -0.027 -6.318 18.064 1.00 0.00 104D 576

ATOM 527 N3 T B 17 1.464 -4.615 18.216 1.00 0.00 104D 577

ATOM 528 C4 T B 17 2.725 -4.051 18.113 1.00 0.00 104D 578

ATOM 529 O4 T B 17 2.868 -2.849 18.326 1.00 0.00 104D 579

ATOM 530 C5 T B 17 3.762 -4.986 17.705 1.00 0.00 104D 580

ATOM 531 C5M T B 17 5.178 -4.490 17.486 1.00 0.00 104D 581

ATOM 532 C6 T B 17 3.467 -6.296 17.501 1.00 0.00 104D 582

ATOM 533 1H5* T B 17 4.911 -10.873 16.597 1.00 0.00 104D 583

ATOM 534 2H5* T B 17 4.806 -10.429 14.885 1.00 0.00 104D 584

ATOM 535 H4* T B 17 2.572 -10.698 15.980 1.00 0.00 104D 585

ATOM 536 H3* T B 17 3.516 -8.143 14.720 1.00 0.00 104D 586

ATOM 537 1H2* T B 17 0.592 -8.116 15.375 1.00 0.00 104D 587

ATOM 538 2H2* T B 17 1.919 -6.897 15.377 1.00 0.00 104D 588

ATOM 539 H1* T B 17 0.928 -8.474 17.545 1.00 0.00 104D 589

ATOM 540 H3 T B 17 0.695 -4.006 18.456 1.00 0.00 104D 590

ATOM 541 1H5M T B 17 5.249 -4.029 16.500 1.00 0.00 104D 591

ATOM 542 2H5M T B 17 5.434 -3.752 18.246 1.00 0.00 104D 592

ATOM 543 3H5M T B 17 5.889 -5.315 17.546 1.00 0.00 104D 593

ATOM 544 H6 T B 17 4.207 -6.976 17.106 1.00 0.00 104D 594

ATOM 545 P A B 18 1.496 -8.778 12.543 1.00 0.00 104D 595

ATOM 546 O1P A B 18 2.283 -7.553 12.277 1.00 0.00 104D 596

ATOM 547 O2P A B 18 1.357 -9.799 11.482 1.00 0.00 104D 597

ATOM 548 O5* A B 18 0.005 -8.318 12.981 1.00 0.00 104D 598

ATOM 549 C5* A B 18 -1.005 -9.249 13.340 1.00 0.00 104D 599

ATOM 550 C4* A B 18 -2.255 -8.510 13.851 1.00 0.00 104D 600

ATOM 551 O4* A B 18 -1.855 -7.593 14.859 1.00 0.00 104D 601

ATOM 552 C3* A B 18 -2.992 -7.739 12.745 1.00 0.00 104D 602

ATOM 553 O3* A B 18 -4.327 -8.203 12.567 1.00 0.00 104D 603

ATOM 554 C2* A B 18 -2.966 -6.299 13.236 1.00 0.00 104D 604

ATOM 555 C1* A B 18 -2.508 -6.352 14.681 1.00 0.00 104D 605

ATOM 556 N9 A B 18 -1.570 -5.234 14.886 1.00 0.00 104D 606

ATOM 557 C8 A B 18 -0.308 -5.096 14.376 1.00 0.00 104D 607

ATOM 558 N7 A B 18 0.327 -4.043 14.813 1.00 0.00 104D 608

ATOM 559 C5 A B 18 -0.644 -3.370 15.550 1.00 0.00 104D 609

ATOM 560 C6 A B 18 -0.658 -2.134 16.227 1.00 0.00 104D 610

ATOM 561 N6 A B 18 0.459 -1.446 16.493 1.00 0.00 104D 611

ATOM 562 N1 A B 18 -1.849 -1.632 16.617 1.00 0.00 104D 612

ATOM 563 C2 A B 18 -2.954 -2.351 16.414 1.00 0.00 104D 613

ATOM 564 N3 A B 18 -3.055 -3.569 15.890 1.00 0.00 104D 614

ATOM 565 C4 A B 18 -1.845 -4.028 15.474 1.00 0.00 104D 615

ATOM 566 1H5* A B 18 -0.634 -9.892 14.139 1.00 0.00 104D 616

ATOM 567 2H5* A B 18 -1.269 -9.870 12.483 1.00 0.00 104D 617

ATOM 568 H4* A B 18 -2.936 -9.242 14.288 1.00 0.00 104D 618

ATOM 569 H3* A B 18 -2.432 -7.817 11.811 1.00 0.00 104D 619

ATOM 570 1H2* A B 18 -3.956 -5.830 13.199 1.00 0.00 104D 620

ATOM 571 2H2* A B 18 -2.180 -5.775 12.675 1.00 0.00 104D 621

ATOM 572 H1* A B 18 -3.333 -6.266 15.384 1.00 0.00 104D 622

ATOM 573 H8 A B 18 0.073 -5.807 13.655 1.00 0.00 104D 623

ATOM 574 1H6 A B 18 0.419 -0.579 17.010 1.00 0.00 104D 624

ATOM 575 2H6 A B 18 1.352 -1.829 16.218 1.00 0.00 104D 625

ATOM 576 H2 A B 18 -3.896 -1.905 16.702 1.00 0.00 104D 626

ATOM 577 P T B 19 -5.251 -7.744 11.305 1.00 0.00 104D 627

ATOM 578 O1P T B 19 -4.359 -7.484 10.153 1.00 0.00 104D 628

ATOM 579 O2P T B 19 -6.347 -8.729 11.167 1.00 0.00 104D 629

ATOM 580 O5* T B 19 -5.907 -6.329 11.742 1.00 0.00 104D 630

ATOM 581 C5* T B 19 -7.129 -6.251 12.458 1.00 0.00 104D 631

ATOM 582 C4* T B 19 -7.280 -4.870 13.128 1.00 0.00 104D 632

ATOM 583 O4* T B 19 -6.006 -4.369 13.526 1.00 0.00 104D 633

ATOM 584 C3* T B 19 -7.921 -3.821 12.207 1.00 0.00 104D 634

ATOM 585 O3* T B 19 -8.852 -3.040 12.946 1.00 0.00 104D 635

ATOM 586 C2* T B 19 -6.715 -2.992 11.787 1.00 0.00 104D 636

ATOM 587 C1* T B 19 -5.856 -3.047 13.037 1.00 0.00 104D 637

ATOM 588 N1 T B 19 -4.439 -2.697 12.734 1.00 0.00 104D 638

ATOM 589 C2 T B 19 -3.862 -1.628 13.422 1.00 0.00 104D 639

ATOM 590 O2 T B 19 -4.494 -0.869 14.153 1.00 0.00 104D 640

ATOM 591 N3 T B 19 -2.503 -1.439 13.235 1.00 0.00 104D 641

ATOM 592 C4 T B 19 -1.689 -2.169 12.384 1.00 0.00 104D 642

ATOM 593 O4 T B 19 -0.490 -1.911 12.311 1.00 0.00 104D 643

ATOM 594 C5 T B 19 -2.394 -3.153 11.583 1.00 0.00 104D 644

ATOM 595 C5M T B 19 -1.635 -3.933 10.527 1.00 0.00 104D 645

ATOM 596 C6 T B 19 -3.718 -3.384 11.778 1.00 0.00 104D 646

ATOM 597 1H5* T B 19 -7.179 -7.025 13.224 1.00 0.00 104D 647

ATOM 598 2H5* T B 19 -7.961 -6.437 11.778 1.00 0.00 104D 648

ATOM 599 H4* T B 19 -7.914 -4.997 14.007 1.00 0.00 104D 649

ATOM 600 H3* T B 19 -8.409 -4.297 11.355 1.00 0.00 104D 650

ATOM 601 1H2* T B 19 -6.946 -1.954 11.571 1.00 0.00 104D 651

ATOM 602 2H2* T B 19 -6.227 -3.481 10.942 1.00 0.00 104D 652

ATOM 603 H1* T B 19 -6.299 -2.365 13.768 1.00 0.00 104D 653

ATOM 604 H3 T B 19 -2.085 -0.678 13.752 1.00 0.00 104D 654

ATOM 605 1H5M T B 19 -2.197 -4.812 10.208 1.00 0.00 104D 655

ATOM 606 2H5M T B 19 -1.458 -3.290 9.664 1.00 0.00 104D 656

ATOM 607 3H5M T B 19 -0.676 -4.261 10.931 1.00 0.00 104D 657

ATOM 608 H6 T B 19 -4.213 -4.113 11.145 1.00 0.00 104D 658

ATOM 609 P A B 20 -9.839 -1.967 12.238 1.00 0.00 104D 659

ATOM 610 O1P A B 20 -10.024 -2.370 10.826 1.00 0.00 104D 660

ATOM 611 O2P A B 20 -11.024 -1.806 13.110 1.00 0.00 104D 661

ATOM 612 O5* A B 20 -9.011 -0.576 12.249 1.00 0.00 104D 662

ATOM 613 C5* A B 20 -9.165 0.378 13.286 1.00 0.00 104D 663

ATOM 614 C4* A B 20 -8.356 1.646 12.985 1.00 0.00 104D 664

ATOM 615 O4* A B 20 -6.963 1.389 12.911 1.00 0.00 104D 665

ATOM 616 C3* A B 20 -8.785 2.314 11.670 1.00 0.00 104D 666

ATOM 617 O3* A B 20 -9.319 3.599 11.998 1.00 0.00 104D 667

ATOM 618 C2* A B 20 -7.479 2.403 10.884 1.00 0.00 104D 668

ATOM 619 C1* A B 20 -6.397 2.245 11.935 1.00 0.00 104D 669

ATOM 620 N9 A B 20 -5.124 1.680 11.458 1.00 0.00 104D 670

ATOM 621 C8 A B 20 -4.912 0.515 10.782 1.00 0.00 104D 671

ATOM 622 N7 A B 20 -3.652 0.201 10.635 1.00 0.00 104D 672

ATOM 623 C5 A B 20 -2.978 1.256 11.249 1.00 0.00 104D 673

ATOM 624 C6 A B 20 -1.612 1.571 11.429 1.00 0.00 104D 674

ATOM 625 N6 A B 20 -0.614 0.778 11.020 1.00 0.00 104D 675

ATOM 626 N1 A B 20 -1.299 2.748 12.011 1.00 0.00 104D 676

ATOM 627 C2 A B 20 -2.276 3.560 12.413 1.00 0.00 104D 677

ATOM 628 N3 A B 20 -3.586 3.364 12.327 1.00 0.00 104D 678

ATOM 629 C4 A B 20 -3.875 2.179 11.728 1.00 0.00 104D 679

ATOM 630 1H5* A B 20 -8.855 -0.036 14.245 1.00 0.00 104D 680

ATOM 631 2H5* A B 20 -10.214 0.666 13.359 1.00 0.00 104D 681

ATOM 632 H4* A B 20 -8.515 2.341 13.812 1.00 0.00 104D 682

ATOM 633 H3* A B 20 -9.506 1.714 11.114 1.00 0.00 104D 683

ATOM 634 1H2* A B 20 -7.466 3.378 10.472 1.00 0.00 104D 684

ATOM 635 2H2* A B 20 -7.353 1.712 10.059 1.00 0.00 104D 685

ATOM 636 H1* A B 20 -6.171 3.246 12.274 1.00 0.00 104D 686

ATOM 637 H8 A B 20 -5.752 -0.057 10.423 1.00 0.00 104D 687

ATOM 638 1H6 A B 20 0.352 1.045 11.163 1.00 0.00 104D 688

ATOM 639 2H6 A B 20 -0.830 -0.115 10.600 1.00 0.00 104D 689

ATOM 640 H2 A B 20 -1.988 4.510 12.844 1.00 0.00 104D 690

ATOM 641 P C B 21 -9.769 4.708 10.897 1.00 0.00 104D 691

ATOM 642 O1P C B 21 -10.736 5.626 11.539 1.00 0.00 104D 692

ATOM 643 O2P C B 21 -10.144 4.000 9.653 1.00 0.00 104D 693

ATOM 644 O5* C B 21 -8.401 5.537 10.612 1.00 0.00 104D 694

ATOM 645 C5* C B 21 -7.926 6.526 11.507 1.00 0.00 104D 695

ATOM 646 C4* C B 21 -6.484 6.964 11.187 1.00 0.00 104D 696

ATOM 647 O4* C B 21 -5.515 5.908 11.106 1.00 0.00 104D 697

ATOM 648 C3* C B 21 -6.408 7.728 9.860 1.00 0.00 104D 698

ATOM 649 O3* C B 21 -6.015 9.072 10.141 1.00 0.00 104D 699

ATOM 650 C2* C B 21 -5.337 6.977 9.066 1.00 0.00 104D 700

ATOM 651 C1* C B 21 -4.521 6.245 10.132 1.00 0.00 104D 701

ATOM 652 N1 C B 21 -3.782 5.051 9.601 1.00 0.00 104D 702

ATOM 653 C2 C B 21 -2.382 5.017 9.705 1.00 0.00 104D 703

ATOM 654 O2 C B 21 -1.750 5.907 10.268 1.00 0.00 104D 704

ATOM 655 N3 C B 21 -1.706 3.953 9.186 1.00 0.00 104D 705

ATOM 656 C4 C B 21 -2.344 2.958 8.558 1.00 0.00 104D 706

ATOM 657 N4 C B 21 -1.622 1.947 8.067 1.00 0.00 104D 707

ATOM 658 C5 C B 21 -3.775 2.956 8.455 1.00 0.00 104D 708

ATOM 659 C6 C B 21 -4.436 4.002 8.993 1.00 0.00 104D 709

ATOM 660 1H5* C B 21 -7.991 6.194 12.543 1.00 0.00 104D 710

ATOM 661 2H5* C B 21 -8.573 7.400 11.420 1.00 0.00 104D 711

ATOM 662 H4* C B 21 -6.234 7.639 12.012 1.00 0.00 104D 712

ATOM 663 H3* C B 21 -7.361 7.708 9.329 1.00 0.00 104D 713

ATOM 664 1H2* C B 21 -4.796 7.791 8.561 1.00 0.00 104D 714

ATOM 665 2H2* C B 21 -5.750 6.177 8.414 1.00 0.00 104D 715

ATOM 666 H1* C B 21 -3.773 6.944 10.506 1.00 0.00 104D 716

ATOM 667 1H4 C B 21 -0.614 1.967 8.161 1.00 0.00 104D 717

ATOM 668 2H4 C B 21 -2.075 1.177 7.599 1.00 0.00 104D 718

ATOM 669 H5 C B 21 -4.364 2.189 7.985 1.00 0.00 104D 719

ATOM 670 H6 C B 21 -5.506 3.957 8.913 1.00 0.00 104D 720

ATOM 671 P G B 22 -5.949 10.242 9.011 1.00 0.00 104D 721

ATOM 672 O1P G B 22 -6.020 11.545 9.708 1.00 0.00 104D 722

ATOM 673 O2P G B 22 -6.943 9.922 7.962 1.00 0.00 104D 723

ATOM 674 O5* G B 22 -4.471 10.104 8.354 1.00 0.00 104D 724

ATOM 675 C5* G B 22 -3.326 10.679 8.956 1.00 0.00 104D 725

ATOM 676 C4* G B 22 -2.033 10.354 8.189 1.00 0.00 104D 726

ATOM 677 O4* G B 22 -1.611 8.990 8.304 1.00 0.00 104D 727

ATOM 678 C3* G B 22 -2.132 10.656 6.684 1.00 0.00 104D 728

ATOM 679 O3* G B 22 -1.114 11.583 6.304 1.00 0.00 104D 729

ATOM 680 C2* G B 22 -1.928 9.297 6.065 1.00 0.00 104D 730

ATOM 681 C1* G B 22 -1.039 8.604 7.059 1.00 0.00 104D 731

ATOM 682 N9 G B 22 -0.969 7.147 6.812 1.00 0.00 104D 732

ATOM 683 C8 G B 22 -1.981 6.226 6.761 1.00 0.00 104D 733

ATOM 684 N7 G B 22 -1.603 5.026 6.428 1.00 0.00 104D 734

ATOM 685 C5 G B 22 -0.230 5.145 6.269 1.00 0.00 104D 735

ATOM 686 C6 G B 22 0.746 4.156 5.945 1.00 0.00 104D 736

ATOM 687 O6 G B 22 0.574 2.950 5.797 1.00 0.00 104D 737

ATOM 688 N1 G B 22 2.019 4.699 5.788 1.00 0.00 104D 738

ATOM 689 C2 G B 22 2.318 6.041 5.936 1.00 0.00 104D 739

ATOM 690 N2 G B 22 3.580 6.419 5.716 1.00 0.00 104D 740

ATOM 691 N3 G B 22 1.409 6.962 6.285 1.00 0.00 104D 741

ATOM 692 C4 G B 22 0.159 6.451 6.444 1.00 0.00 104D 742

ATOM 693 1H5* G B 22 -3.225 10.353 9.990 1.00 0.00 104D 743

ATOM 694 2H5* G B 22 -3.449 11.763 8.952 1.00 0.00 104D 744

ATOM 695 H4* G B 22 -1.272 10.998 8.641 1.00 0.00 104D 745

ATOM 696 H3* G B 22 -3.112 10.944 6.331 1.00 0.00 104D 746

ATOM 697 1H2* G B 22 -1.409 9.490 5.155 1.00 0.00 104D 747

ATOM 698 2H2* G B 22 -2.866 8.751 5.932 1.00 0.00 104D 748

ATOM 699 H1* G B 22 -0.056 9.017 6.861 1.00 0.00 104D 749

ATOM 700 H8 G B 22 -3.005 6.466 6.978 1.00 0.00 104D 750

ATOM 701 H1 G B 22 2.761 4.057 5.539 1.00 0.00 104D 751

ATOM 702 1H2 G B 22 4.278 5.742 5.443 1.00 0.00 104D 752

ATOM 703 2H2 G B 22 3.828 7.393 5.808 1.00 0.00 104D 753

ATOM 704 P C B 23 -0.937 12.147 4.785 1.00 0.00 104D 754

ATOM 705 O1P C B 23 -0.429 13.533 4.880 1.00 0.00 104D 755

ATOM 706 O2P C B 23 -2.193 11.884 4.048 1.00 0.00 104D 756

ATOM 707 O5* C B 23 0.227 11.227 4.114 1.00 0.00 104D 757

ATOM 708 C5* C B 23 1.603 11.534 4.281 1.00 0.00 104D 758

ATOM 709 C4* C B 23 2.542 10.637 3.455 1.00 0.00 104D 759

ATOM 710 O4* C B 23 2.376 9.242 3.699 1.00 0.00 104D 760

ATOM 711 C3* C B 23 2.389 10.838 1.944 1.00 0.00 104D 761

ATOM 712 O3* C B 23 3.703 11.021 1.411 1.00 0.00 104D 762

ATOM 713 C2* C B 23 1.743 9.541 1.461 1.00 0.00 104D 763

ATOM 714 C1* C B 23 2.327 8.530 2.462 1.00 0.00 104D 764

ATOM 715 N1 C B 23 1.509 7.286 2.656 1.00 0.00 104D 765

ATOM 716 C2 C B 23 2.173 6.054 2.563 1.00 0.00 104D 766

ATOM 717 O2 C B 23 3.383 5.975 2.362 1.00 0.00 104D 767

ATOM 718 N3 C B 23 1.453 4.907 2.685 1.00 0.00 104D 768

ATOM 719 C4 C B 23 0.137 4.933 2.916 1.00 0.00 104D 769

ATOM 720 N4 C B 23 -0.510 3.767 3.008 1.00 0.00 104D 770

ATOM 721 C5 C B 23 -0.549 6.171 3.155 1.00 0.00 104D 771

ATOM 722 C6 C B 23 0.169 7.315 3.022 1.00 0.00 104D 772

ATOM 723 1H5* C B 23 1.884 11.473 5.331 1.00 0.00 104D 773

ATOM 724 2H5* C B 23 1.777 12.561 3.957 1.00 0.00 104D 774

ATOM 725 H4* C B 23 3.543 10.953 3.769 1.00 0.00 104D 775

ATOM 726 H3* C B 23 1.737 11.677 1.712 1.00 0.00 104D 776

ATOM 727 1H2* C B 23 2.112 9.430 0.421 1.00 0.00 104D 777

ATOM 728 2H2* C B 23 0.632 9.579 1.577 1.00 0.00 104D 778

ATOM 729 H1* C B 23 3.336 8.269 2.086 1.00 0.00 104D 779

ATOM 730 1H4 C B 23 0.017 2.911 2.894 1.00 0.00 104D 780

ATOM 731 2H4 C B 23 -1.492 3.742 3.238 1.00 0.00 104D 781

ATOM 732 H5 C B 23 -1.588 6.216 3.453 1.00 0.00 104D 782

ATOM 733 H6 C B 23 -0.371 8.235 3.237 1.00 0.00 104D 783

ATOM 734 P G B 24 4.018 11.253 -0.166 1.00 0.00 104D 784

ATOM 735 O1P G B 24 5.222 12.108 -0.267 1.00 0.00 104D 785

ATOM 736 O2P G B 24 2.766 11.673 -0.835 1.00 0.00 104D 786

ATOM 737 O5* G B 24 4.404 9.771 -0.709 1.00 0.00 104D 787

ATOM 738 C5* G B 24 5.742 9.300 -0.685 1.00 0.00 104D 788

ATOM 739 C4* G B 24 5.875 7.874 -1.242 1.00 0.00 104D 789

ATOM 740 O4* G B 24 5.079 6.919 -0.541 1.00 0.00 104D 790

ATOM 741 C3* G B 24 5.477 7.777 -2.722 1.00 0.00 104D 791

ATOM 742 O3* G B 24 6.566 7.321 -3.497 1.00 0.00 104D 792

ATOM 743 C2* G B 24 4.359 6.740 -2.745 1.00 0.00 104D 793

ATOM 744 C1* G B 24 4.605 5.945 -1.468 1.00 0.00 104D 794

ATOM 745 N9 G B 24 3.355 5.295 -1.003 1.00 0.00 104D 795

ATOM 746 C8 G B 24 2.170 5.885 -0.658 1.00 0.00 104D 796

ATOM 747 N7 G B 24 1.225 5.057 -0.318 1.00 0.00 104D 797

ATOM 748 C5 G B 24 1.827 3.811 -0.430 1.00 0.00 104D 798

ATOM 749 C6 G B 24 1.304 2.512 -0.146 1.00 0.00 104D 799

ATOM 750 O6 G B 24 0.218 2.220 0.352 1.00 0.00 104D 800

ATOM 751 N1 G B 24 2.216 1.503 -0.447 1.00 0.00 104D 801

ATOM 752 C2 G B 24 3.496 1.718 -0.926 1.00 0.00 104D 802

ATOM 753 N2 G B 24 4.263 0.642 -1.127 1.00 0.00 104D 803

ATOM 754 N3 G B 24 4.000 2.940 -1.156 1.00 0.00 104D 804

ATOM 755 C4 G B 24 3.120 3.943 -0.886 1.00 0.00 104D 805

ATOM 756 1H5* G B 24 6.149 9.333 0.326 1.00 0.00 104D 806

ATOM 757 2H5* G B 24 6.353 9.954 -1.308 1.00 0.00 104D 807

ATOM 758 H4* G B 24 6.937 7.632 -1.131 1.00 0.00 104D 808

ATOM 759 H3* G B 24 5.107 8.726 -3.111 1.00 0.00 104D 809

ATOM 760 1H2* G B 24 4.398 6.097 -3.624 1.00 0.00 104D 810

ATOM 761 2H2* G B 24 3.402 7.261 -2.698 1.00 0.00 104D 811

ATOM 762 H1* G B 24 5.354 5.176 -1.677 1.00 0.00 104D 812

ATOM 763 H8 G B 24 2.036 6.949 -0.669 1.00 0.00 104D 813

ATOM 764 H1 G B 24 1.919 0.557 -0.242 1.00 0.00 104D 814

ATOM 765 1H2 G B 24 3.894 -0.283 -0.948 1.00 0.00 104D 815

ATOM 766 2H2 G B 24 5.214 0.759 -1.442 1.00 0.00 104D 816

ATOM 767 H3T G B 24 7.262 7.982 -3.464 1.00 0.00 104D 817

TER 768 G B 24 104D 818

MASTER 27 0 0 0 0 0 0 6 766 2 0 2 104D 819

END 104D 820