USER MOD reduce.3.24.130724 H: found=0, std=0, add=184, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 232 hydrogens (48 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DG O5' : rot -74:sc= 1.3 USER MOD Single : A 5 DG O3' : rot 180:sc= 0 USER MOD Single : B 1 DG O5' : rot -74:sc= 0.58 USER MOD Single : B 5 DG O3' : rot 180:sc= 0 USER MOD Single : C 1 DG O5' : rot 180:sc= 0 USER MOD Single : C 5 DG O3' : rot 180:sc= 0 USER MOD Single : D 1 DG O5' : rot -7:sc= 0.576 USER MOD Single : D 5 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -7.579 -3.145 -0.752 1.00 1.00 O ATOM 2 C5' DG A 1 -8.399 -4.103 -1.416 1.00 1.00 C ATOM 3 C4' DG A 1 -8.302 -3.949 -2.915 1.00 1.00 C ATOM 4 O4' DG A 1 -7.102 -3.198 -3.226 1.00 1.00 O ATOM 5 C3' DG A 1 -8.157 -5.260 -3.685 1.00 1.00 C ATOM 6 O3' DG A 1 -8.615 -5.091 -5.032 1.00 1.00 O ATOM 7 C2' DG A 1 -6.654 -5.450 -3.635 1.00 1.00 C ATOM 8 C1' DG A 1 -6.203 -4.036 -3.941 1.00 1.00 C ATOM 9 N9 DG A 1 -4.836 -3.698 -3.551 1.00 1.00 N ATOM 10 C8 DG A 1 -3.851 -3.227 -4.386 1.00 1.00 C ATOM 11 N7 DG A 1 -2.735 -2.951 -3.769 1.00 1.00 N ATOM 12 C5 DG A 1 -2.993 -3.263 -2.444 1.00 1.00 C ATOM 13 C6 DG A 1 -2.149 -3.169 -1.311 1.00 1.00 C ATOM 14 O6 DG A 1 -0.980 -2.755 -1.258 1.00 1.00 O ATOM 15 N1 DG A 1 -2.787 -3.588 -0.148 1.00 1.00 N ATOM 16 C2 DG A 1 -4.089 -4.038 -0.098 1.00 1.00 C ATOM 17 N2 DG A 1 -4.554 -4.389 1.109 1.00 1.00 N ATOM 18 N3 DG A 1 -4.889 -4.129 -1.151 1.00 1.00 N ATOM 19 C4 DG A 1 -4.283 -3.728 -2.288 1.00 1.00 C ATOM 0 H5' DG A 1 -9.435 -3.982 -1.100 1.00 1.00 H new ATOM 0 H5'' DG A 1 -8.094 -5.109 -1.129 1.00 1.00 H new ATOM 0 H4' DG A 1 -9.234 -3.469 -3.212 1.00 1.00 H new ATOM 0 H3' DG A 1 -8.726 -6.100 -3.287 1.00 1.00 H new ATOM 0 H2' DG A 1 -6.309 -5.796 -2.661 1.00 1.00 H new ATOM 0 H2'' DG A 1 -6.300 -6.170 -4.373 1.00 1.00 H new ATOM 0 HO5' DG A 1 -6.638 -3.405 -0.838 1.00 1.00 H new ATOM 0 H1' DG A 1 -6.209 -3.911 -5.024 1.00 1.00 H new ATOM 0 H8 DG A 1 -3.988 -3.098 -5.450 1.00 1.00 H new ATOM 0 H1 DG A 1 -2.258 -3.560 0.723 1.00 1.00 H new ATOM 0 H21 DG A 1 -5.510 -4.729 1.208 1.00 1.00 H new ATOM 0 H22 DG A 1 -3.951 -4.316 1.929 1.00 1.00 H new ATOM 32 P DG A 2 -8.873 -6.362 -5.978 1.00 1.00 P ATOM 33 OP1 DG A 2 -9.794 -5.921 -7.054 1.00 1.00 O ATOM 34 OP2 DG A 2 -9.252 -7.515 -5.128 1.00 1.00 O ATOM 35 O5' DG A 2 -7.452 -6.661 -6.626 1.00 1.00 O ATOM 36 C5' DG A 2 -6.849 -5.742 -7.535 1.00 1.00 C ATOM 37 C4' DG A 2 -5.467 -6.222 -7.916 1.00 1.00 C ATOM 38 O4' DG A 2 -4.529 -5.873 -6.867 1.00 1.00 O ATOM 39 C3' DG A 2 -5.336 -7.740 -8.082 1.00 1.00 C ATOM 40 O3' DG A 2 -4.386 -8.069 -9.101 1.00 1.00 O ATOM 41 C2' DG A 2 -4.763 -8.156 -6.741 1.00 1.00 C ATOM 42 C1' DG A 2 -3.773 -7.030 -6.566 1.00 1.00 C ATOM 43 N9 DG A 2 -3.172 -6.873 -5.246 1.00 1.00 N ATOM 44 C8 DG A 2 -3.643 -7.317 -4.033 1.00 1.00 C ATOM 45 N7 DG A 2 -2.837 -7.055 -3.040 1.00 1.00 N ATOM 46 C5 DG A 2 -1.771 -6.394 -3.633 1.00 1.00 C ATOM 47 C6 DG A 2 -0.584 -5.861 -3.065 1.00 1.00 C ATOM 48 O6 DG A 2 -0.237 -5.862 -1.874 1.00 1.00 O ATOM 49 N1 DG A 2 0.238 -5.271 -4.022 1.00 1.00 N ATOM 50 C2 DG A 2 -0.060 -5.207 -5.366 1.00 1.00 C ATOM 51 N2 DG A 2 0.824 -4.581 -6.158 1.00 1.00 N ATOM 52 N3 DG A 2 -1.161 -5.699 -5.907 1.00 1.00 N ATOM 53 C4 DG A 2 -1.965 -6.274 -4.990 1.00 1.00 C ATOM 0 H5' DG A 2 -6.787 -4.754 -7.078 1.00 1.00 H new ATOM 0 H5'' DG A 2 -7.467 -5.642 -8.427 1.00 1.00 H new ATOM 0 H4' DG A 2 -5.266 -5.744 -8.875 1.00 1.00 H new ATOM 0 H3' DG A 2 -6.276 -8.218 -8.358 1.00 1.00 H new ATOM 0 H2' DG A 2 -5.513 -8.187 -5.951 1.00 1.00 H new ATOM 0 H2'' DG A 2 -4.289 -9.137 -6.769 1.00 1.00 H new ATOM 0 H1' DG A 2 -2.912 -7.229 -7.204 1.00 1.00 H new ATOM 0 H8 DG A 2 -4.585 -7.831 -3.914 1.00 1.00 H new ATOM 0 H1 DG A 2 1.117 -4.860 -3.708 1.00 1.00 H new ATOM 0 H21 DG A 2 0.648 -4.507 -7.160 1.00 1.00 H new ATOM 0 H22 DG A 2 1.672 -4.179 -5.758 1.00 1.00 H new HETATM 65 P AZW A 3 -4.702 -7.919 -10.665 1.00 1.00 P HETATM 66 OP1 AZW A 3 -5.601 -6.761 -10.891 1.00 1.00 O HETATM 67 OP2 AZW A 3 -5.104 -9.255 -11.161 1.00 1.00 O HETATM 68 O5' AZW A 3 -3.266 -7.583 -11.261 1.00 1.00 O HETATM 69 C5' AZW A 3 -2.209 -8.527 -11.102 1.00 1.00 C HETATM 70 C1A AZW A 3 -1.124 -7.984 -10.198 1.00 1.00 C HETATM 71 C2A AZW A 3 -0.149 -7.107 -10.697 1.00 1.00 C HETATM 72 C6A AZW A 3 -1.034 -8.447 -8.876 1.00 1.00 C HETATM 73 C3A AZW A 3 0.921 -6.710 -9.882 1.00 1.00 C HETATM 74 C5A AZW A 3 0.034 -8.052 -8.062 1.00 1.00 C HETATM 75 C4A AZW A 3 1.017 -7.190 -8.565 1.00 1.00 C HETATM 76 N5A AZW A 3 2.138 -6.866 -7.764 1.00 1.00 N HETATM 77 C1B AZW A 3 6.298 -7.094 -4.836 1.00 1.00 C HETATM 78 C2B AZW A 3 6.335 -6.805 -6.209 1.00 1.00 C HETATM 79 C6B AZW A 3 5.118 -7.583 -4.260 1.00 1.00 C HETATM 80 C3B AZW A 3 5.199 -7.012 -7.002 1.00 1.00 C HETATM 81 C5B AZW A 3 3.982 -7.792 -5.053 1.00 1.00 C HETATM 82 C4B AZW A 3 4.022 -7.509 -6.424 1.00 1.00 C HETATM 83 N5B AZW A 3 2.894 -7.781 -7.231 1.00 1.00 N HETATM 84 C3' AZW A 3 7.531 -6.899 -3.979 1.00 1.00 C HETATM 85 O3' AZW A 3 8.708 -7.264 -4.694 1.00 1.00 O ATOM 98 P DG A 4 9.803 -6.146 -5.055 1.00 1.00 P ATOM 99 OP1 DG A 4 10.532 -6.583 -6.270 1.00 1.00 O ATOM 100 OP2 DG A 4 10.561 -5.850 -3.819 1.00 1.00 O ATOM 101 O5' DG A 4 8.937 -4.867 -5.430 1.00 1.00 O ATOM 102 C5' DG A 4 9.559 -3.632 -5.781 1.00 1.00 C ATOM 103 C4' DG A 4 8.839 -3.026 -6.961 1.00 1.00 C ATOM 104 O4' DG A 4 7.491 -3.558 -7.012 1.00 1.00 O ATOM 105 C3' DG A 4 8.672 -1.508 -6.927 1.00 1.00 C ATOM 106 O3' DG A 4 8.632 -1.006 -8.269 1.00 1.00 O ATOM 107 C2' DG A 4 7.331 -1.344 -6.237 1.00 1.00 C ATOM 108 C1' DG A 4 6.552 -2.507 -6.823 1.00 1.00 C ATOM 109 N9 DG A 4 5.450 -3.015 -6.010 1.00 1.00 N ATOM 110 C8 DG A 4 4.181 -3.283 -6.458 1.00 1.00 C ATOM 111 N7 DG A 4 3.392 -3.750 -5.531 1.00 1.00 N ATOM 112 C5 DG A 4 4.185 -3.790 -4.395 1.00 1.00 C ATOM 113 C6 DG A 4 3.863 -4.209 -3.081 1.00 1.00 C ATOM 114 O6 DG A 4 2.782 -4.646 -2.662 1.00 1.00 O ATOM 115 N1 DG A 4 4.946 -4.093 -2.217 1.00 1.00 N ATOM 116 C2 DG A 4 6.186 -3.627 -2.589 1.00 1.00 C ATOM 117 N2 DG A 4 7.122 -3.586 -1.628 1.00 1.00 N ATOM 118 N3 DG A 4 6.499 -3.234 -3.814 1.00 1.00 N ATOM 119 C4 DG A 4 5.458 -3.340 -4.667 1.00 1.00 C ATOM 0 H5' DG A 4 10.608 -3.797 -6.027 1.00 1.00 H new ATOM 0 H5'' DG A 4 9.534 -2.946 -4.934 1.00 1.00 H new ATOM 0 H4' DG A 4 9.465 -3.277 -7.817 1.00 1.00 H new ATOM 0 H3' DG A 4 9.476 -0.972 -6.423 1.00 1.00 H new ATOM 0 H2' DG A 4 7.416 -1.411 -5.152 1.00 1.00 H new ATOM 0 H2'' DG A 4 6.867 -0.383 -6.462 1.00 1.00 H new ATOM 0 H1' DG A 4 6.079 -2.146 -7.736 1.00 1.00 H new ATOM 0 H8 DG A 4 3.867 -3.123 -7.479 1.00 1.00 H new ATOM 0 H1 DG A 4 4.813 -4.371 -1.245 1.00 1.00 H new ATOM 0 H21 DG A 4 8.060 -3.250 -1.844 1.00 1.00 H new ATOM 0 H22 DG A 4 6.895 -3.891 -0.682 1.00 1.00 H new ATOM 131 P DG A 5 8.543 0.573 -8.546 1.00 1.00 P ATOM 132 OP1 DG A 5 9.117 0.843 -9.886 1.00 1.00 O ATOM 133 OP2 DG A 5 9.106 1.266 -7.363 1.00 1.00 O ATOM 134 O5' DG A 5 6.980 0.865 -8.607 1.00 1.00 O ATOM 135 C5' DG A 5 6.162 0.229 -9.587 1.00 1.00 C ATOM 136 C4' DG A 5 4.700 0.488 -9.300 1.00 1.00 C ATOM 137 O4' DG A 5 4.306 -0.234 -8.108 1.00 1.00 O ATOM 138 C3' DG A 5 4.348 1.956 -9.040 1.00 1.00 C ATOM 139 O3' DG A 5 3.284 2.383 -9.893 1.00 1.00 O ATOM 140 C2' DG A 5 3.899 1.973 -7.588 1.00 1.00 C ATOM 141 C1' DG A 5 3.368 0.566 -7.417 1.00 1.00 C ATOM 142 N9 DG A 5 3.254 0.110 -6.035 1.00 1.00 N ATOM 143 C8 DG A 5 4.188 0.227 -5.033 1.00 1.00 C ATOM 144 N7 DG A 5 3.774 -0.236 -3.884 1.00 1.00 N ATOM 145 C5 DG A 5 2.486 -0.687 -4.140 1.00 1.00 C ATOM 146 C6 DG A 5 1.535 -1.293 -3.275 1.00 1.00 C ATOM 147 O6 DG A 5 1.646 -1.541 -2.063 1.00 1.00 O ATOM 148 N1 DG A 5 0.349 -1.602 -3.935 1.00 1.00 N ATOM 149 C2 DG A 5 0.118 -1.351 -5.270 1.00 1.00 C ATOM 150 N2 DG A 5 -1.080 -1.719 -5.749 1.00 1.00 N ATOM 151 N3 DG A 5 0.994 -0.788 -6.085 1.00 1.00 N ATOM 152 C4 DG A 5 2.150 -0.483 -5.460 1.00 1.00 C ATOM 0 H5' DG A 5 6.354 -0.844 -9.590 1.00 1.00 H new ATOM 0 H5'' DG A 5 6.416 0.601 -10.579 1.00 1.00 H new ATOM 0 H4' DG A 5 4.178 0.164 -10.201 1.00 1.00 H new ATOM 0 H3' DG A 5 5.185 2.626 -9.235 1.00 1.00 H new ATOM 0 H2' DG A 5 4.723 2.186 -6.907 1.00 1.00 H new ATOM 0 H2'' DG A 5 3.132 2.726 -7.405 1.00 1.00 H new ATOM 0 HO3' DG A 5 3.074 3.322 -9.709 1.00 1.00 H new ATOM 0 H1' DG A 5 2.346 0.510 -7.793 1.00 1.00 H new ATOM 0 H8 DG A 5 5.167 0.659 -5.181 1.00 1.00 H new ATOM 0 H1 DG A 5 -0.397 -2.042 -3.396 1.00 1.00 H new ATOM 0 H21 DG A 5 -1.308 -1.559 -6.730 1.00 1.00 H new ATOM 0 H22 DG A 5 -1.763 -2.159 -5.132 1.00 1.00 H new TER 165 DG A 5 ATOM 166 O5' DG B 1 7.367 2.366 1.143 1.00 1.00 O ATOM 167 C5' DG B 1 8.694 1.899 1.383 1.00 1.00 C ATOM 168 C4' DG B 1 8.804 1.286 2.760 1.00 1.00 C ATOM 169 O4' DG B 1 7.476 0.923 3.209 1.00 1.00 O ATOM 170 C3' DG B 1 9.630 0.002 2.837 1.00 1.00 C ATOM 171 O3' DG B 1 10.272 -0.080 4.116 1.00 1.00 O ATOM 172 C2' DG B 1 8.576 -1.078 2.682 1.00 1.00 C ATOM 173 C1' DG B 1 7.420 -0.475 3.456 1.00 1.00 C ATOM 174 N9 DG B 1 6.092 -0.949 3.080 1.00 1.00 N ATOM 175 C8 DG B 1 5.165 -1.519 3.917 1.00 1.00 C ATOM 176 N7 DG B 1 4.039 -1.815 3.326 1.00 1.00 N ATOM 177 C5 DG B 1 4.234 -1.418 2.011 1.00 1.00 C ATOM 178 C6 DG B 1 3.360 -1.490 0.896 1.00 1.00 C ATOM 179 O6 DG B 1 2.193 -1.908 0.865 1.00 1.00 O ATOM 180 N1 DG B 1 3.941 -0.987 -0.263 1.00 1.00 N ATOM 181 C2 DG B 1 5.216 -0.470 -0.327 1.00 1.00 C ATOM 182 N2 DG B 1 5.619 -0.011 -1.524 1.00 1.00 N ATOM 183 N3 DG B 1 6.042 -0.395 0.706 1.00 1.00 N ATOM 184 C4 DG B 1 5.493 -0.883 1.839 1.00 1.00 C ATOM 0 H5' DG B 1 9.398 2.726 1.290 1.00 1.00 H new ATOM 0 H5'' DG B 1 8.967 1.162 0.628 1.00 1.00 H new ATOM 0 H4' DG B 1 9.300 2.042 3.368 1.00 1.00 H new ATOM 0 H3' DG B 1 10.423 -0.069 2.092 1.00 1.00 H new ATOM 0 H2' DG B 1 8.322 -1.258 1.637 1.00 1.00 H new ATOM 0 H2'' DG B 1 8.899 -2.031 3.101 1.00 1.00 H new ATOM 0 HO5' DG B 1 6.777 1.602 0.976 1.00 1.00 H new ATOM 0 H1' DG B 1 7.540 -0.765 4.500 1.00 1.00 H new ATOM 0 H8 DG B 1 5.350 -1.705 4.965 1.00 1.00 H new ATOM 0 H1 DG B 1 3.388 -1.002 -1.120 1.00 1.00 H new ATOM 0 H21 DG B 1 6.554 0.383 -1.631 1.00 1.00 H new ATOM 0 H22 DG B 1 4.990 -0.057 -2.326 1.00 1.00 H new ATOM 197 P DG B 2 11.435 -1.155 4.386 1.00 1.00 P ATOM 198 OP1 DG B 2 12.213 -0.669 5.551 1.00 1.00 O ATOM 199 OP2 DG B 2 12.136 -1.438 3.112 1.00 1.00 O ATOM 200 O5' DG B 2 10.651 -2.461 4.842 1.00 1.00 O ATOM 201 C5' DG B 2 9.922 -2.467 6.069 1.00 1.00 C ATOM 202 C4' DG B 2 9.116 -3.737 6.194 1.00 1.00 C ATOM 203 O4' DG B 2 7.983 -3.678 5.292 1.00 1.00 O ATOM 204 C3' DG B 2 9.879 -5.013 5.831 1.00 1.00 C ATOM 205 O3' DG B 2 9.675 -6.007 6.839 1.00 1.00 O ATOM 206 C2' DG B 2 9.255 -5.446 4.517 1.00 1.00 C ATOM 207 C1' DG B 2 7.837 -4.946 4.681 1.00 1.00 C ATOM 208 N9 DG B 2 7.074 -4.789 3.446 1.00 1.00 N ATOM 209 C8 DG B 2 7.535 -4.374 2.220 1.00 1.00 C ATOM 210 N7 DG B 2 6.612 -4.369 1.295 1.00 1.00 N ATOM 211 C5 DG B 2 5.471 -4.809 1.952 1.00 1.00 C ATOM 212 C6 DG B 2 4.153 -5.012 1.466 1.00 1.00 C ATOM 213 O6 DG B 2 3.724 -4.834 0.318 1.00 1.00 O ATOM 214 N1 DG B 2 3.292 -5.467 2.461 1.00 1.00 N ATOM 215 C2 DG B 2 3.668 -5.696 3.766 1.00 1.00 C ATOM 216 N2 DG B 2 2.717 -6.142 4.595 1.00 1.00 N ATOM 217 N3 DG B 2 4.893 -5.511 4.231 1.00 1.00 N ATOM 218 C4 DG B 2 5.739 -5.070 3.278 1.00 1.00 C ATOM 0 H5' DG B 2 9.260 -1.602 6.110 1.00 1.00 H new ATOM 0 H5'' DG B 2 10.611 -2.381 6.909 1.00 1.00 H new ATOM 0 H4' DG B 2 8.836 -3.791 7.246 1.00 1.00 H new ATOM 0 H3' DG B 2 10.956 -4.863 5.753 1.00 1.00 H new ATOM 0 H2' DG B 2 9.752 -4.996 3.658 1.00 1.00 H new ATOM 0 H2'' DG B 2 9.296 -6.526 4.379 1.00 1.00 H new ATOM 0 H1' DG B 2 7.271 -5.682 5.252 1.00 1.00 H new ATOM 0 H8 DG B 2 8.559 -4.081 2.039 1.00 1.00 H new ATOM 0 H1 DG B 2 2.320 -5.642 2.207 1.00 1.00 H new ATOM 0 H21 DG B 2 2.939 -6.329 5.573 1.00 1.00 H new ATOM 0 H22 DG B 2 1.770 -6.295 4.249 1.00 1.00 H new HETATM 230 P AZW B 3 10.738 -7.195 7.030 1.00 1.00 P HETATM 231 OP1 AZW B 3 11.262 -7.134 8.414 1.00 1.00 O HETATM 232 OP2 AZW B 3 11.688 -7.149 5.894 1.00 1.00 O HETATM 233 O5' AZW B 3 9.859 -8.513 6.884 1.00 1.00 O HETATM 234 C5' AZW B 3 8.719 -8.714 7.713 1.00 1.00 C HETATM 235 C1A AZW B 3 7.508 -9.033 6.862 1.00 1.00 C HETATM 236 C2A AZW B 3 6.224 -8.797 7.371 1.00 1.00 C HETATM 237 C6A AZW B 3 7.661 -9.603 5.587 1.00 1.00 C HETATM 238 C3A AZW B 3 5.096 -9.135 6.616 1.00 1.00 C HETATM 239 C5A AZW B 3 6.529 -9.942 4.832 1.00 1.00 C HETATM 240 C4A AZW B 3 5.245 -9.711 5.350 1.00 1.00 C HETATM 241 N5A AZW B 3 4.101 -10.092 4.616 1.00 1.00 N HETATM 242 C1B AZW B 3 0.148 -10.594 1.543 1.00 1.00 C HETATM 243 C2B AZW B 3 0.076 -10.290 2.910 1.00 1.00 C HETATM 244 C6B AZW B 3 1.375 -10.495 0.871 1.00 1.00 C HETATM 245 C3B AZW B 3 1.223 -9.888 3.602 1.00 1.00 C HETATM 246 C5B AZW B 3 2.525 -10.092 1.566 1.00 1.00 C HETATM 247 C4B AZW B 3 2.448 -9.789 2.933 1.00 1.00 C HETATM 248 N5B AZW B 3 3.602 -9.391 3.643 1.00 1.00 N HETATM 249 C3' AZW B 3 -1.097 -11.028 0.801 1.00 1.00 C HETATM 250 O3' AZW B 3 -1.462 -12.352 1.179 1.00 1.00 O ATOM 263 P DG B 4 -2.826 -12.637 1.981 1.00 1.00 P ATOM 264 OP1 DG B 4 -2.599 -13.820 2.843 1.00 1.00 O ATOM 265 OP2 DG B 4 -3.929 -12.660 0.993 1.00 1.00 O ATOM 266 O5' DG B 4 -3.026 -11.370 2.921 1.00 1.00 O ATOM 267 C5' DG B 4 -4.328 -10.996 3.375 1.00 1.00 C ATOM 268 C4' DG B 4 -4.237 -10.362 4.745 1.00 1.00 C ATOM 269 O4' DG B 4 -2.925 -9.771 4.903 1.00 1.00 O ATOM 270 C3' DG B 4 -5.230 -9.230 5.007 1.00 1.00 C ATOM 271 O3' DG B 4 -5.579 -9.186 6.395 1.00 1.00 O ATOM 272 C2' DG B 4 -4.444 -7.997 4.601 1.00 1.00 C ATOM 273 C1' DG B 4 -3.039 -8.364 5.048 1.00 1.00 C ATOM 274 N9 DG B 4 -1.940 -7.747 4.309 1.00 1.00 N ATOM 275 C8 DG B 4 -0.767 -7.282 4.852 1.00 1.00 C ATOM 276 N7 DG B 4 0.054 -6.789 3.967 1.00 1.00 N ATOM 277 C5 DG B 4 -0.614 -6.935 2.761 1.00 1.00 C ATOM 278 C6 DG B 4 -0.213 -6.576 1.451 1.00 1.00 C ATOM 279 O6 DG B 4 0.847 -6.044 1.095 1.00 1.00 O ATOM 280 N1 DG B 4 -1.182 -6.889 0.502 1.00 1.00 N ATOM 281 C2 DG B 4 -2.389 -7.480 0.793 1.00 1.00 C ATOM 282 N2 DG B 4 -3.215 -7.705 -0.240 1.00 1.00 N ATOM 283 N3 DG B 4 -2.772 -7.821 2.010 1.00 1.00 N ATOM 284 C4 DG B 4 -1.847 -7.523 2.948 1.00 1.00 C ATOM 0 H5' DG B 4 -4.974 -11.873 3.413 1.00 1.00 H new ATOM 0 H5'' DG B 4 -4.780 -10.297 2.671 1.00 1.00 H new ATOM 0 H4' DG B 4 -4.455 -11.173 5.440 1.00 1.00 H new ATOM 0 H3' DG B 4 -6.171 -9.334 4.467 1.00 1.00 H new ATOM 0 H2' DG B 4 -4.497 -7.813 3.528 1.00 1.00 H new ATOM 0 H2'' DG B 4 -4.809 -7.098 5.097 1.00 1.00 H new ATOM 0 H1' DG B 4 -2.935 -7.994 6.068 1.00 1.00 H new ATOM 0 H8 DG B 4 -0.546 -7.321 5.909 1.00 1.00 H new ATOM 0 H1 DG B 4 -0.984 -6.665 -0.473 1.00 1.00 H new ATOM 0 H21 DG B 4 -4.123 -8.141 -0.081 1.00 1.00 H new ATOM 0 H22 DG B 4 -2.935 -7.440 -1.184 1.00 1.00 H new ATOM 296 P DG B 5 -6.603 -8.075 6.940 1.00 1.00 P ATOM 297 OP1 DG B 5 -7.268 -8.634 8.139 1.00 1.00 O ATOM 298 OP2 DG B 5 -7.434 -7.604 5.807 1.00 1.00 O ATOM 299 O5' DG B 5 -5.661 -6.884 7.412 1.00 1.00 O ATOM 300 C5' DG B 5 -4.720 -7.086 8.465 1.00 1.00 C ATOM 301 C4' DG B 5 -3.705 -5.969 8.484 1.00 1.00 C ATOM 302 O4' DG B 5 -3.052 -5.877 7.202 1.00 1.00 O ATOM 303 C3' DG B 5 -4.284 -4.573 8.716 1.00 1.00 C ATOM 304 O3' DG B 5 -4.204 -4.224 10.101 1.00 1.00 O ATOM 305 C2' DG B 5 -3.411 -3.653 7.872 1.00 1.00 C ATOM 306 C1' DG B 5 -2.481 -4.588 7.107 1.00 1.00 C ATOM 307 N9 DG B 5 -2.317 -4.257 5.695 1.00 1.00 N ATOM 308 C8 DG B 5 -3.262 -4.348 4.701 1.00 1.00 C ATOM 309 N7 DG B 5 -2.816 -3.979 3.530 1.00 1.00 N ATOM 310 C5 DG B 5 -1.495 -3.620 3.764 1.00 1.00 C ATOM 311 C6 DG B 5 -0.499 -3.136 2.871 1.00 1.00 C ATOM 312 O6 DG B 5 -0.597 -2.908 1.654 1.00 1.00 O ATOM 313 N1 DG B 5 0.710 -2.896 3.520 1.00 1.00 N ATOM 314 C2 DG B 5 0.924 -3.097 4.864 1.00 1.00 C ATOM 315 N2 DG B 5 2.156 -2.820 5.317 1.00 1.00 N ATOM 316 N3 DG B 5 0.005 -3.543 5.707 1.00 1.00 N ATOM 317 C4 DG B 5 -1.173 -3.784 5.095 1.00 1.00 C ATOM 0 H5' DG B 5 -4.215 -8.043 8.332 1.00 1.00 H new ATOM 0 H5'' DG B 5 -5.240 -7.130 9.422 1.00 1.00 H new ATOM 0 H4' DG B 5 -3.045 -6.230 9.311 1.00 1.00 H new ATOM 0 H3' DG B 5 -5.337 -4.505 8.442 1.00 1.00 H new ATOM 0 H2' DG B 5 -4.014 -3.051 7.192 1.00 1.00 H new ATOM 0 H2'' DG B 5 -2.848 -2.960 8.497 1.00 1.00 H new ATOM 0 HO3' DG B 5 -4.577 -3.327 10.234 1.00 1.00 H new ATOM 0 H1' DG B 5 -1.487 -4.508 7.546 1.00 1.00 H new ATOM 0 H8 DG B 5 -4.272 -4.690 4.871 1.00 1.00 H new ATOM 0 H1 DG B 5 1.489 -2.548 2.961 1.00 1.00 H new ATOM 0 H21 DG B 5 2.377 -2.949 6.304 1.00 1.00 H new ATOM 0 H22 DG B 5 2.871 -2.481 4.674 1.00 1.00 H new TER 330 DG B 5 ATOM 331 O5' DG C 1 8.634 2.965 -3.422 1.00 1.00 O ATOM 332 C5' DG C 1 7.387 3.639 -3.232 1.00 1.00 C ATOM 333 C4' DG C 1 6.772 4.055 -4.550 1.00 1.00 C ATOM 334 O4' DG C 1 5.529 3.333 -4.729 1.00 1.00 O ATOM 335 C3' DG C 1 6.408 5.536 -4.662 1.00 1.00 C ATOM 336 O3' DG C 1 6.555 5.978 -6.018 1.00 1.00 O ATOM 337 C2' DG C 1 4.952 5.555 -4.239 1.00 1.00 C ATOM 338 C1' DG C 1 4.445 4.246 -4.813 1.00 1.00 C ATOM 339 N9 DG C 1 3.297 3.668 -4.120 1.00 1.00 N ATOM 340 C8 DG C 1 2.092 3.331 -4.686 1.00 1.00 C ATOM 341 N7 DG C 1 1.238 2.836 -3.832 1.00 1.00 N ATOM 342 C5 DG C 1 1.919 2.848 -2.624 1.00 1.00 C ATOM 343 C6 DG C 1 1.496 2.429 -1.337 1.00 1.00 C ATOM 344 O6 DG C 1 0.405 1.935 -1.010 1.00 1.00 O ATOM 345 N1 DG C 1 2.485 2.610 -0.374 1.00 1.00 N ATOM 346 C2 DG C 1 3.734 3.127 -0.637 1.00 1.00 C ATOM 347 N2 DG C 1 4.580 3.209 0.403 1.00 1.00 N ATOM 348 N3 DG C 1 4.142 3.520 -1.834 1.00 1.00 N ATOM 349 C4 DG C 1 3.192 3.355 -2.780 1.00 1.00 C ATOM 0 H5' DG C 1 7.540 4.519 -2.607 1.00 1.00 H new ATOM 0 H5'' DG C 1 6.697 2.985 -2.698 1.00 1.00 H new ATOM 0 H4' DG C 1 7.536 3.839 -5.297 1.00 1.00 H new ATOM 0 H3' DG C 1 7.036 6.193 -4.060 1.00 1.00 H new ATOM 0 H2' DG C 1 4.842 5.596 -3.155 1.00 1.00 H new ATOM 0 H2'' DG C 1 4.419 6.414 -4.647 1.00 1.00 H new ATOM 0 HO5' DG C 1 9.005 2.711 -2.551 1.00 1.00 H new ATOM 0 H1' DG C 1 4.098 4.442 -5.828 1.00 1.00 H new ATOM 0 H8 DG C 1 1.872 3.463 -5.735 1.00 1.00 H new ATOM 0 H1 DG C 1 2.271 2.343 0.587 1.00 1.00 H new ATOM 0 H21 DG C 1 5.519 3.584 0.268 1.00 1.00 H new ATOM 0 H22 DG C 1 4.283 2.896 1.328 1.00 1.00 H new ATOM 362 P DG C 2 6.477 7.540 -6.381 1.00 1.00 P ATOM 363 OP1 DG C 2 7.208 7.760 -7.651 1.00 1.00 O ATOM 364 OP2 DG C 2 6.864 8.315 -5.176 1.00 1.00 O ATOM 365 O5' DG C 2 4.932 7.798 -6.652 1.00 1.00 O ATOM 366 C5' DG C 2 4.240 7.099 -7.685 1.00 1.00 C ATOM 367 C4' DG C 2 2.756 7.358 -7.577 1.00 1.00 C ATOM 368 O4' DG C 2 2.221 6.610 -6.458 1.00 1.00 O ATOM 369 C3' DG C 2 2.385 8.822 -7.322 1.00 1.00 C ATOM 370 O3' DG C 2 1.327 9.231 -8.196 1.00 1.00 O ATOM 371 C2' DG C 2 1.917 8.827 -5.877 1.00 1.00 C ATOM 372 C1' DG C 2 1.320 7.443 -5.754 1.00 1.00 C ATOM 373 N9 DG C 2 1.185 6.951 -4.388 1.00 1.00 N ATOM 374 C8 DG C 2 2.067 7.120 -3.348 1.00 1.00 C ATOM 375 N7 DG C 2 1.641 6.611 -2.222 1.00 1.00 N ATOM 376 C5 DG C 2 0.404 6.071 -2.541 1.00 1.00 C ATOM 377 C6 DG C 2 -0.534 5.389 -1.725 1.00 1.00 C ATOM 378 O6 DG C 2 -0.439 5.106 -0.522 1.00 1.00 O ATOM 379 N1 DG C 2 -1.668 5.008 -2.435 1.00 1.00 N ATOM 380 C2 DG C 2 -1.861 5.258 -3.776 1.00 1.00 C ATOM 381 N2 DG C 2 -3.005 4.814 -4.316 1.00 1.00 N ATOM 382 N3 DG C 2 -0.995 5.893 -4.549 1.00 1.00 N ATOM 383 C4 DG C 2 0.108 6.271 -3.871 1.00 1.00 C ATOM 0 H5' DG C 2 4.438 6.030 -7.608 1.00 1.00 H new ATOM 0 H5'' DG C 2 4.604 7.421 -8.661 1.00 1.00 H new ATOM 0 H4' DG C 2 2.344 7.060 -8.541 1.00 1.00 H new ATOM 0 H3' DG C 2 3.213 9.508 -7.502 1.00 1.00 H new ATOM 0 H2' DG C 2 2.740 8.983 -5.179 1.00 1.00 H new ATOM 0 H2'' DG C 2 1.183 9.610 -5.685 1.00 1.00 H new ATOM 0 H1' DG C 2 0.301 7.455 -6.142 1.00 1.00 H new ATOM 0 H8 DG C 2 3.017 7.623 -3.451 1.00 1.00 H new ATOM 0 H1 DG C 2 -2.403 4.512 -1.931 1.00 1.00 H new ATOM 0 H21 DG C 2 -3.197 4.973 -5.305 1.00 1.00 H new ATOM 0 H22 DG C 2 -3.683 4.317 -3.738 1.00 1.00 H new HETATM 395 P AZW C 3 0.922 10.782 -8.305 1.00 1.00 P HETATM 396 OP1 AZW C 3 0.417 11.033 -9.678 1.00 1.00 O HETATM 397 OP2 AZW C 3 2.056 11.587 -7.795 1.00 1.00 O HETATM 398 O5' AZW C 3 -0.287 10.940 -7.281 1.00 1.00 O HETATM 399 C5' AZW C 3 -1.628 10.730 -7.709 1.00 1.00 C HETATM 400 C1A AZW C 3 -2.481 10.288 -6.540 1.00 1.00 C HETATM 401 C2A AZW C 3 -3.313 11.210 -5.892 1.00 1.00 C HETATM 402 C6A AZW C 3 -2.482 8.944 -6.143 1.00 1.00 C HETATM 403 C3A AZW C 3 -4.155 10.787 -4.856 1.00 1.00 C HETATM 404 C5A AZW C 3 -3.327 8.520 -5.107 1.00 1.00 C HETATM 405 C4A AZW C 3 -4.167 9.440 -4.466 1.00 1.00 C HETATM 406 N5A AZW C 3 -5.083 9.005 -3.481 1.00 1.00 N HETATM 407 C1B AZW C 3 -7.908 6.752 -0.022 1.00 1.00 C HETATM 408 C2B AZW C 3 -8.249 6.815 -1.379 1.00 1.00 C HETATM 409 C6B AZW C 3 -6.592 7.034 0.382 1.00 1.00 C HETATM 410 C3B AZW C 3 -7.285 7.162 -2.325 1.00 1.00 C HETATM 411 C5B AZW C 3 -5.626 7.383 -0.571 1.00 1.00 C HETATM 412 C4B AZW C 3 -5.976 7.449 -1.926 1.00 1.00 C HETATM 413 N5B AZW C 3 -5.030 7.845 -2.892 1.00 1.00 N HETATM 414 C3' AZW C 3 -8.956 6.387 1.008 1.00 1.00 C HETATM 415 O3' AZW C 3 -10.227 6.928 0.654 1.00 1.00 O ATOM 428 P DG C 4 -11.400 5.964 0.124 1.00 1.00 P ATOM 429 OP1 DG C 4 -12.222 6.754 -0.825 1.00 1.00 O ATOM 430 OP2 DG C 4 -12.051 5.326 1.293 1.00 1.00 O ATOM 431 O5' DG C 4 -10.643 4.840 -0.710 1.00 1.00 O ATOM 432 C5' DG C 4 -11.320 3.665 -1.157 1.00 1.00 C ATOM 433 C4' DG C 4 -10.916 3.346 -2.578 1.00 1.00 C ATOM 434 O4' DG C 4 -9.603 3.905 -2.834 1.00 1.00 O ATOM 435 C3' DG C 4 -10.807 1.858 -2.912 1.00 1.00 C ATOM 436 O3' DG C 4 -11.246 1.629 -4.258 1.00 1.00 O ATOM 437 C2' DG C 4 -9.320 1.585 -2.773 1.00 1.00 C ATOM 438 C1' DG C 4 -8.734 2.882 -3.294 1.00 1.00 C ATOM 439 N9 DG C 4 -7.377 3.191 -2.850 1.00 1.00 N ATOM 440 C8 DG C 4 -6.327 3.551 -3.658 1.00 1.00 C ATOM 441 N7 DG C 4 -5.221 3.774 -3.005 1.00 1.00 N ATOM 442 C5 DG C 4 -5.556 3.548 -1.679 1.00 1.00 C ATOM 443 C6 DG C 4 -4.754 3.636 -0.516 1.00 1.00 C ATOM 444 O6 DG C 4 -3.554 3.933 -0.438 1.00 1.00 O ATOM 445 N1 DG C 4 -5.469 3.327 0.636 1.00 1.00 N ATOM 446 C2 DG C 4 -6.799 2.977 0.650 1.00 1.00 C ATOM 447 N2 DG C 4 -7.331 2.716 1.854 1.00 1.00 N ATOM 448 N3 DG C 4 -7.560 2.890 -0.430 1.00 1.00 N ATOM 449 C4 DG C 4 -6.881 3.187 -1.559 1.00 1.00 C ATOM 0 H5' DG C 4 -12.398 3.813 -1.101 1.00 1.00 H new ATOM 0 H5'' DG C 4 -11.079 2.826 -0.504 1.00 1.00 H new ATOM 0 H4' DG C 4 -11.713 3.769 -3.190 1.00 1.00 H new ATOM 0 H3' DG C 4 -11.417 1.216 -2.276 1.00 1.00 H new ATOM 0 H2' DG C 4 -9.032 1.389 -1.740 1.00 1.00 H new ATOM 0 H2'' DG C 4 -9.003 0.724 -3.361 1.00 1.00 H new ATOM 0 H1' DG C 4 -8.656 2.796 -4.378 1.00 1.00 H new ATOM 0 H8 DG C 4 -6.409 3.641 -4.731 1.00 1.00 H new ATOM 0 H1 DG C 4 -4.975 3.362 1.528 1.00 1.00 H new ATOM 0 H21 DG C 4 -8.313 2.451 1.931 1.00 1.00 H new ATOM 0 H22 DG C 4 -6.753 2.783 2.692 1.00 1.00 H new ATOM 461 P DG C 5 -11.407 0.136 -4.825 1.00 1.00 P ATOM 462 OP1 DG C 5 -12.437 0.156 -5.892 1.00 1.00 O ATOM 463 OP2 DG C 5 -11.580 -0.774 -3.669 1.00 1.00 O ATOM 464 O5' DG C 5 -9.997 -0.177 -5.493 1.00 1.00 O ATOM 465 C5' DG C 5 -9.511 0.624 -6.569 1.00 1.00 C ATOM 466 C4' DG C 5 -8.062 0.305 -6.861 1.00 1.00 C ATOM 467 O4' DG C 5 -7.205 0.931 -5.887 1.00 1.00 O ATOM 468 C3' DG C 5 -7.672 -1.168 -6.766 1.00 1.00 C ATOM 469 O3' DG C 5 -7.986 -1.868 -7.975 1.00 1.00 O ATOM 470 C2' DG C 5 -6.170 -1.097 -6.546 1.00 1.00 C ATOM 471 C1' DG C 5 -5.937 0.302 -5.973 1.00 1.00 C ATOM 472 N9 DG C 5 -5.325 0.311 -4.647 1.00 1.00 N ATOM 473 C8 DG C 5 -5.875 -0.137 -3.471 1.00 1.00 C ATOM 474 N7 DG C 5 -5.076 -0.005 -2.444 1.00 1.00 N ATOM 475 C5 DG C 5 -3.927 0.563 -2.978 1.00 1.00 C ATOM 476 C6 DG C 5 -2.707 0.939 -2.352 1.00 1.00 C ATOM 477 O6 DG C 5 -2.386 0.832 -1.154 1.00 1.00 O ATOM 478 N1 DG C 5 -1.801 1.481 -3.261 1.00 1.00 N ATOM 479 C2 DG C 5 -2.048 1.635 -4.607 1.00 1.00 C ATOM 480 N2 DG C 5 -1.064 2.176 -5.340 1.00 1.00 N ATOM 481 N3 DG C 5 -3.177 1.288 -5.202 1.00 1.00 N ATOM 482 C4 DG C 5 -4.068 0.763 -4.336 1.00 1.00 C ATOM 0 H5' DG C 5 -9.613 1.680 -6.318 1.00 1.00 H new ATOM 0 H5'' DG C 5 -10.114 0.449 -7.460 1.00 1.00 H new ATOM 0 H4' DG C 5 -7.943 0.656 -7.886 1.00 1.00 H new ATOM 0 H3' DG C 5 -8.202 -1.707 -5.980 1.00 1.00 H new ATOM 0 H2' DG C 5 -5.832 -1.871 -5.856 1.00 1.00 H new ATOM 0 H2'' DG C 5 -5.624 -1.241 -7.479 1.00 1.00 H new ATOM 0 HO3' DG C 5 -7.724 -2.808 -7.886 1.00 1.00 H new ATOM 0 H1' DG C 5 -5.240 0.818 -6.633 1.00 1.00 H new ATOM 0 H8 DG C 5 -6.868 -0.556 -3.401 1.00 1.00 H new ATOM 0 H1 DG C 5 -0.894 1.784 -2.906 1.00 1.00 H new ATOM 0 H21 DG C 5 -1.192 2.314 -6.343 1.00 1.00 H new ATOM 0 H22 DG C 5 -0.188 2.450 -4.895 1.00 1.00 H new TER 495 DG C 5 ATOM 496 O5' DG D 1 -7.000 -4.126 3.404 1.00 1.00 O ATOM 497 C5' DG D 1 -8.085 -3.792 4.272 1.00 1.00 C ATOM 498 C4' DG D 1 -7.574 -3.151 5.540 1.00 1.00 C ATOM 499 O4' DG D 1 -6.179 -2.815 5.348 1.00 1.00 O ATOM 500 C3' DG D 1 -8.281 -1.853 5.931 1.00 1.00 C ATOM 501 O3' DG D 1 -8.589 -1.854 7.329 1.00 1.00 O ATOM 502 C2' DG D 1 -7.267 -0.770 5.603 1.00 1.00 C ATOM 503 C1' DG D 1 -5.952 -1.496 5.810 1.00 1.00 C ATOM 504 N9 DG D 1 -4.807 -0.951 5.087 1.00 1.00 N ATOM 505 C8 DG D 1 -3.597 -0.594 5.631 1.00 1.00 C ATOM 506 N7 DG D 1 -2.741 -0.156 4.750 1.00 1.00 N ATOM 507 C5 DG D 1 -3.427 -0.222 3.547 1.00 1.00 C ATOM 508 C6 DG D 1 -3.007 0.125 2.239 1.00 1.00 C ATOM 509 O6 DG D 1 -1.900 0.554 1.880 1.00 1.00 O ATOM 510 N1 DG D 1 -4.006 -0.085 1.294 1.00 1.00 N ATOM 511 C2 DG D 1 -5.257 -0.580 1.586 1.00 1.00 C ATOM 512 N2 DG D 1 -6.101 -0.716 0.552 1.00 1.00 N ATOM 513 N3 DG D 1 -5.662 -0.913 2.802 1.00 1.00 N ATOM 514 C4 DG D 1 -4.704 -0.709 3.732 1.00 1.00 C ATOM 0 H5' DG D 1 -8.653 -4.690 4.515 1.00 1.00 H new ATOM 0 H5'' DG D 1 -8.768 -3.111 3.764 1.00 1.00 H new ATOM 0 H4' DG D 1 -7.754 -3.877 6.333 1.00 1.00 H new ATOM 0 H3' DG D 1 -9.227 -1.711 5.409 1.00 1.00 H new ATOM 0 H2' DG D 1 -7.375 -0.406 4.581 1.00 1.00 H new ATOM 0 H2'' DG D 1 -7.365 0.093 6.261 1.00 1.00 H new ATOM 0 HO5' DG D 1 -6.166 -3.762 3.768 1.00 1.00 H new ATOM 0 H1' DG D 1 -5.685 -1.409 6.863 1.00 1.00 H new ATOM 0 H8 DG D 1 -3.376 -0.669 6.686 1.00 1.00 H new ATOM 0 H1 DG D 1 -3.798 0.143 0.322 1.00 1.00 H new ATOM 0 H21 DG D 1 -7.042 -1.078 0.706 1.00 1.00 H new ATOM 0 H22 DG D 1 -5.801 -0.458 -0.388 1.00 1.00 H new ATOM 527 P DG D 2 -9.569 -0.739 7.940 1.00 1.00 P ATOM 528 OP1 DG D 2 -10.258 -1.341 9.104 1.00 1.00 O ATOM 529 OP2 DG D 2 -10.374 -0.154 6.842 1.00 1.00 O ATOM 530 O5' DG D 2 -8.585 0.383 8.491 1.00 1.00 O ATOM 531 C5' DG D 2 -7.591 0.054 9.456 1.00 1.00 C ATOM 532 C4' DG D 2 -6.627 1.204 9.624 1.00 1.00 C ATOM 533 O4' DG D 2 -5.782 1.294 8.448 1.00 1.00 O ATOM 534 C3' DG D 2 -7.290 2.576 9.770 1.00 1.00 C ATOM 535 O3' DG D 2 -6.592 3.356 10.749 1.00 1.00 O ATOM 536 C2' DG D 2 -7.123 3.174 8.386 1.00 1.00 C ATOM 537 C1' DG D 2 -5.755 2.644 8.022 1.00 1.00 C ATOM 538 N9 DG D 2 -5.430 2.701 6.600 1.00 1.00 N ATOM 539 C8 DG D 2 -6.285 2.514 5.541 1.00 1.00 C ATOM 540 N7 DG D 2 -5.723 2.717 4.381 1.00 1.00 N ATOM 541 C5 DG D 2 -4.414 3.056 4.692 1.00 1.00 C ATOM 542 C6 DG D 2 -3.326 3.387 3.844 1.00 1.00 C ATOM 543 O6 DG D 2 -3.311 3.441 2.607 1.00 1.00 O ATOM 544 N1 DG D 2 -2.166 3.667 4.562 1.00 1.00 N ATOM 545 C2 DG D 2 -2.079 3.626 5.936 1.00 1.00 C ATOM 546 N2 DG D 2 -0.883 3.907 6.476 1.00 1.00 N ATOM 547 N3 DG D 2 -3.084 3.317 6.738 1.00 1.00 N ATOM 548 C4 DG D 2 -4.215 3.046 6.055 1.00 1.00 C ATOM 0 H5' DG D 2 -7.051 -0.840 9.143 1.00 1.00 H new ATOM 0 H5'' DG D 2 -8.063 -0.177 10.411 1.00 1.00 H new ATOM 0 H4' DG D 2 -6.083 0.985 10.543 1.00 1.00 H new ATOM 0 H3' DG D 2 -8.329 2.533 10.097 1.00 1.00 H new ATOM 0 H2' DG D 2 -7.895 2.839 7.694 1.00 1.00 H new ATOM 0 H2'' DG D 2 -7.156 4.263 8.398 1.00 1.00 H new ATOM 0 H1' DG D 2 -4.989 3.259 8.494 1.00 1.00 H new ATOM 0 H8 DG D 2 -7.320 2.227 5.657 1.00 1.00 H new ATOM 0 H1 DG D 2 -1.328 3.918 4.037 1.00 1.00 H new ATOM 0 H21 DG D 2 -0.764 3.891 7.489 1.00 1.00 H new ATOM 0 H22 DG D 2 -0.093 4.137 5.873 1.00 1.00 H new HETATM 560 P AZW D 3 -7.187 4.758 11.261 1.00 1.00 P HETATM 561 OP1 AZW D 3 -7.047 4.781 12.735 1.00 1.00 O HETATM 562 OP2 AZW D 3 -8.522 4.971 10.652 1.00 1.00 O HETATM 563 O5' AZW D 3 -6.189 5.845 10.662 1.00 1.00 O HETATM 564 C5' AZW D 3 -4.815 5.858 11.039 1.00 1.00 C HETATM 565 C1A AZW D 3 -3.998 6.529 9.960 1.00 1.00 C HETATM 566 C2A AZW D 3 -3.067 7.525 10.298 1.00 1.00 C HETATM 567 C6A AZW D 3 -4.160 6.147 8.622 1.00 1.00 C HETATM 568 C3A AZW D 3 -2.299 8.133 9.298 1.00 1.00 C HETATM 569 C5A AZW D 3 -3.392 6.754 7.623 1.00 1.00 C HETATM 570 C4A AZW D 3 -2.460 7.748 7.960 1.00 1.00 C HETATM 571 N5A AZW D 3 -1.680 8.353 6.952 1.00 1.00 N HETATM 572 C1B AZW D 3 1.351 9.429 3.057 1.00 1.00 C HETATM 573 C2B AZW D 3 1.695 9.589 4.409 1.00 1.00 C HETATM 574 C6B AZW D 3 0.211 8.688 2.712 1.00 1.00 C HETATM 575 C3B AZW D 3 0.907 9.009 5.408 1.00 1.00 C HETATM 576 C5B AZW D 3 -0.579 8.108 3.713 1.00 1.00 C HETATM 577 C4B AZW D 3 -0.228 8.266 5.061 1.00 1.00 C HETATM 578 N5B AZW D 3 -1.012 7.669 6.071 1.00 1.00 N HETATM 579 C3' AZW D 3 2.215 10.029 1.967 1.00 1.00 C HETATM 580 O3' AZW D 3 2.956 11.145 2.450 1.00 1.00 O ATOM 593 P DG D 4 4.554 11.055 2.585 1.00 1.00 P ATOM 594 OP1 DG D 4 5.041 12.339 3.137 1.00 1.00 O ATOM 595 OP2 DG D 4 5.092 10.558 1.295 1.00 1.00 O ATOM 596 O5' DG D 4 4.786 9.928 3.684 1.00 1.00 O ATOM 597 C5' DG D 4 5.895 9.036 3.599 1.00 1.00 C ATOM 598 C4' DG D 4 6.041 8.276 4.896 1.00 1.00 C ATOM 599 O4' DG D 4 4.743 7.775 5.302 1.00 1.00 O ATOM 600 C3' DG D 4 6.954 7.051 4.835 1.00 1.00 C ATOM 601 O3' DG D 4 7.604 6.870 6.100 1.00 1.00 O ATOM 602 C2' DG D 4 5.976 5.924 4.557 1.00 1.00 C ATOM 603 C1' DG D 4 4.783 6.357 5.389 1.00 1.00 C ATOM 604 N9 DG D 4 3.487 5.832 4.963 1.00 1.00 N ATOM 605 C8 DG D 4 2.560 5.218 5.769 1.00 1.00 C ATOM 606 N7 DG D 4 1.480 4.851 5.135 1.00 1.00 N ATOM 607 C5 DG D 4 1.708 5.244 3.824 1.00 1.00 C ATOM 608 C6 DG D 4 0.886 5.105 2.680 1.00 1.00 C ATOM 609 O6 DG D 4 -0.234 4.581 2.603 1.00 1.00 O ATOM 610 N1 DG D 4 1.481 5.634 1.539 1.00 1.00 N ATOM 611 C2 DG D 4 2.724 6.223 1.517 1.00 1.00 C ATOM 612 N2 DG D 4 3.140 6.686 0.330 1.00 1.00 N ATOM 613 N3 DG D 4 3.504 6.358 2.578 1.00 1.00 N ATOM 614 C4 DG D 4 2.939 5.850 3.695 1.00 1.00 C ATOM 0 H5' DG D 4 6.807 9.594 3.389 1.00 1.00 H new ATOM 0 H5'' DG D 4 5.751 8.340 2.773 1.00 1.00 H new ATOM 0 H4' DG D 4 6.482 8.995 5.587 1.00 1.00 H new ATOM 0 H3' DG D 4 7.748 7.119 4.091 1.00 1.00 H new ATOM 0 H2' DG D 4 5.731 5.843 3.498 1.00 1.00 H new ATOM 0 H2'' DG D 4 6.365 4.955 4.869 1.00 1.00 H new ATOM 0 H1' DG D 4 4.927 5.963 6.395 1.00 1.00 H new ATOM 0 H8 DG D 4 2.710 5.055 6.826 1.00 1.00 H new ATOM 0 H1 DG D 4 0.962 5.582 0.662 1.00 1.00 H new ATOM 0 H21 DG D 4 4.053 7.133 0.249 1.00 1.00 H new ATOM 0 H22 DG D 4 2.544 6.591 -0.492 1.00 1.00 H new ATOM 626 P DG D 5 8.810 5.824 6.263 1.00 1.00 P ATOM 627 OP1 DG D 5 9.543 6.195 7.495 1.00 1.00 O ATOM 628 OP2 DG D 5 9.548 5.738 4.981 1.00 1.00 O ATOM 629 O5' DG D 5 8.087 4.431 6.526 1.00 1.00 O ATOM 630 C5' DG D 5 7.345 4.230 7.726 1.00 1.00 C ATOM 631 C4' DG D 5 6.494 2.982 7.650 1.00 1.00 C ATOM 632 O4' DG D 5 5.315 3.213 6.853 1.00 1.00 O ATOM 633 C3' DG D 5 7.121 1.767 6.970 1.00 1.00 C ATOM 634 O3' DG D 5 7.998 1.065 7.860 1.00 1.00 O ATOM 635 C2' DG D 5 5.897 0.927 6.634 1.00 1.00 C ATOM 636 C1' DG D 5 4.752 1.939 6.568 1.00 1.00 C ATOM 637 N9 DG D 5 4.077 1.993 5.274 1.00 1.00 N ATOM 638 C8 DG D 5 4.612 2.367 4.065 1.00 1.00 C ATOM 639 N7 DG D 5 3.768 2.266 3.074 1.00 1.00 N ATOM 640 C5 DG D 5 2.602 1.795 3.662 1.00 1.00 C ATOM 641 C6 DG D 5 1.337 1.488 3.086 1.00 1.00 C ATOM 642 O6 DG D 5 0.995 1.557 1.894 1.00 1.00 O ATOM 643 N1 DG D 5 0.425 1.040 4.038 1.00 1.00 N ATOM 644 C2 DG D 5 0.706 0.908 5.379 1.00 1.00 C ATOM 645 N2 DG D 5 -0.298 0.476 6.157 1.00 1.00 N ATOM 646 N3 DG D 5 1.878 1.186 5.927 1.00 1.00 N ATOM 647 C4 DG D 5 2.775 1.623 5.019 1.00 1.00 C ATOM 0 H5' DG D 5 6.708 5.095 7.910 1.00 1.00 H new ATOM 0 H5'' DG D 5 8.030 4.153 8.570 1.00 1.00 H new ATOM 0 H4' DG D 5 6.321 2.771 8.705 1.00 1.00 H new ATOM 0 H3' DG D 5 7.737 2.018 6.106 1.00 1.00 H new ATOM 0 H2' DG D 5 6.021 0.404 5.686 1.00 1.00 H new ATOM 0 H2'' DG D 5 5.714 0.168 7.395 1.00 1.00 H new ATOM 0 HO3' DG D 5 8.383 0.292 7.397 1.00 1.00 H new ATOM 0 H1' DG D 5 3.990 1.636 7.286 1.00 1.00 H new ATOM 0 H8 DG D 5 5.629 2.710 3.946 1.00 1.00 H new ATOM 0 H1 DG D 5 -0.513 0.794 3.721 1.00 1.00 H new ATOM 0 H21 DG D 5 -0.152 0.358 7.160 1.00 1.00 H new ATOM 0 H22 DG D 5 -1.208 0.266 5.746 1.00 1.00 H new TER 660 DG D 5 HETATM 661 K K A 101 1.307 -4.054 -0.571 1.00 1.00 K HETATM 662 K K A 102 -0.073 -0.522 0.126 1.00 1.00 K HETATM 663 K K C 101 -1.406 3.015 0.792 1.00 1.00 K