USER MOD reduce.3.24.130724 H: found=0, std=0, add=234, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 234 hydrogens (0 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 DC O5' : rot 32:sc= 0.0708 USER MOD Single : A 21 DT C7 :methyl 150:sc= -0.104 (180deg=-0.104) USER MOD Single : A 21 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 9.364 5.032 4.734 1.00 0.00 O ATOM 2 C5' DC A 1 9.605 3.981 5.660 1.00 0.00 C ATOM 3 C4' DC A 1 8.401 3.028 5.716 1.00 0.00 C ATOM 4 O4' DC A 1 7.228 3.810 5.938 1.00 0.00 O ATOM 5 C3' DC A 1 8.203 2.261 4.401 1.00 0.00 C ATOM 6 O3' DC A 1 8.252 0.847 4.594 1.00 0.00 O ATOM 7 C2' DC A 1 6.818 2.721 3.932 1.00 0.00 C ATOM 8 C1' DC A 1 6.139 3.289 5.191 1.00 0.00 C ATOM 9 N1 DC A 1 5.077 4.346 5.074 1.00 0.00 N ATOM 10 C2 DC A 1 4.436 4.766 6.258 1.00 0.00 C ATOM 11 O2 DC A 1 4.662 4.243 7.352 1.00 0.00 O ATOM 12 N3 DC A 1 3.546 5.788 6.256 1.00 0.00 N ATOM 13 C4 DC A 1 3.226 6.333 5.102 1.00 0.00 C ATOM 14 N4 DC A 1 2.369 7.309 5.165 1.00 0.00 N ATOM 15 C5 DC A 1 3.759 5.898 3.859 1.00 0.00 C ATOM 16 C6 DC A 1 4.679 4.899 3.877 1.00 0.00 C ATOM 0 H5' DC A 1 9.794 4.396 6.650 1.00 0.00 H new ATOM 0 H5'' DC A 1 10.499 3.430 5.369 1.00 0.00 H new ATOM 0 H4' DC A 1 8.582 2.306 6.512 1.00 0.00 H new ATOM 0 H3' DC A 1 8.989 2.463 3.673 1.00 0.00 H new ATOM 0 H2' DC A 1 6.897 3.477 3.151 1.00 0.00 H new ATOM 0 H2'' DC A 1 6.247 1.891 3.516 1.00 0.00 H new ATOM 0 HO5' DC A 1 8.407 5.244 4.722 1.00 0.00 H new ATOM 0 H1' DC A 1 5.556 2.474 5.621 1.00 0.00 H new ATOM 0 H41 DC A 1 2.071 7.782 4.312 1.00 0.00 H new ATOM 0 H42 DC A 1 1.994 7.601 6.068 1.00 0.00 H new ATOM 0 H5 DC A 1 3.443 6.347 2.929 1.00 0.00 H new ATOM 0 H6 DC A 1 5.100 4.537 2.950 1.00 0.00 H new ATOM 29 P DG A 2 9.638 0.023 4.530 1.00 0.00 P ATOM 30 OP1 DG A 2 10.249 -0.062 5.878 1.00 0.00 O ATOM 31 OP2 DG A 2 10.443 0.571 3.421 1.00 0.00 O ATOM 32 O5' DG A 2 9.132 -1.428 4.028 1.00 0.00 O ATOM 33 C5' DG A 2 9.257 -2.652 4.769 1.00 0.00 C ATOM 34 C4' DG A 2 8.573 -2.682 6.159 1.00 0.00 C ATOM 35 O4' DG A 2 7.504 -1.756 6.247 1.00 0.00 O ATOM 36 C3' DG A 2 7.907 -4.024 6.529 1.00 0.00 C ATOM 37 O3' DG A 2 7.801 -4.118 7.953 1.00 0.00 O ATOM 38 C2' DG A 2 6.556 -3.895 5.825 1.00 0.00 C ATOM 39 C1' DG A 2 6.326 -2.386 5.784 1.00 0.00 C ATOM 40 N9 DG A 2 5.987 -1.882 4.439 1.00 0.00 N ATOM 41 C8 DG A 2 6.306 -2.370 3.193 1.00 0.00 C ATOM 42 N7 DG A 2 5.782 -1.710 2.191 1.00 0.00 N ATOM 43 C5 DG A 2 5.040 -0.713 2.841 1.00 0.00 C ATOM 44 C6 DG A 2 4.183 0.314 2.326 1.00 0.00 C ATOM 45 O6 DG A 2 3.898 0.540 1.151 1.00 0.00 O ATOM 46 N1 DG A 2 3.605 1.104 3.303 1.00 0.00 N ATOM 47 C2 DG A 2 3.789 0.903 4.635 1.00 0.00 C ATOM 48 N2 DG A 2 3.155 1.662 5.477 1.00 0.00 N ATOM 49 N3 DG A 2 4.579 -0.024 5.156 1.00 0.00 N ATOM 50 C4 DG A 2 5.176 -0.803 4.207 1.00 0.00 C ATOM 0 H5' DG A 2 10.318 -2.864 4.904 1.00 0.00 H new ATOM 0 H5'' DG A 2 8.844 -3.461 4.166 1.00 0.00 H new ATOM 0 H4' DG A 2 9.407 -2.462 6.826 1.00 0.00 H new ATOM 0 H3' DG A 2 8.441 -4.926 6.230 1.00 0.00 H new ATOM 0 H2' DG A 2 6.581 -4.326 4.824 1.00 0.00 H new ATOM 0 H2'' DG A 2 5.766 -4.408 6.373 1.00 0.00 H new ATOM 0 H1' DG A 2 5.469 -2.157 6.417 1.00 0.00 H new ATOM 0 H8 DG A 2 6.941 -3.232 3.052 1.00 0.00 H new ATOM 0 H1 DG A 2 3.009 1.878 3.009 1.00 0.00 H new ATOM 0 H21 DG A 2 3.280 1.526 6.480 1.00 0.00 H new ATOM 0 H22 DG A 2 2.532 2.394 5.135 1.00 0.00 H new ATOM 62 P DG A 3 6.951 -5.238 8.723 1.00 0.00 P ATOM 63 OP1 DG A 3 7.389 -5.271 10.135 1.00 0.00 O ATOM 64 OP2 DG A 3 6.950 -6.503 7.958 1.00 0.00 O ATOM 65 O5' DG A 3 5.456 -4.691 8.712 1.00 0.00 O ATOM 66 C5' DG A 3 5.079 -3.550 9.469 1.00 0.00 C ATOM 67 C4' DG A 3 3.683 -3.037 9.093 1.00 0.00 C ATOM 68 O4' DG A 3 3.668 -2.482 7.786 1.00 0.00 O ATOM 69 C3' DG A 3 2.566 -4.098 9.141 1.00 0.00 C ATOM 70 O3' DG A 3 1.655 -3.746 10.172 1.00 0.00 O ATOM 71 C2' DG A 3 1.950 -3.992 7.743 1.00 0.00 C ATOM 72 C1' DG A 3 2.341 -2.584 7.323 1.00 0.00 C ATOM 73 N9 DG A 3 2.257 -2.398 5.862 1.00 0.00 N ATOM 74 C8 DG A 3 2.904 -3.105 4.874 1.00 0.00 C ATOM 75 N7 DG A 3 2.589 -2.740 3.659 1.00 0.00 N ATOM 76 C5 DG A 3 1.662 -1.712 3.860 1.00 0.00 C ATOM 77 C6 DG A 3 0.972 -0.881 2.914 1.00 0.00 C ATOM 78 O6 DG A 3 1.042 -0.903 1.685 1.00 0.00 O ATOM 79 N1 DG A 3 0.146 0.061 3.488 1.00 0.00 N ATOM 80 C2 DG A 3 -0.017 0.185 4.834 1.00 0.00 C ATOM 81 N2 DG A 3 -0.908 1.045 5.237 1.00 0.00 N ATOM 82 N3 DG A 3 0.610 -0.552 5.753 1.00 0.00 N ATOM 83 C4 DG A 3 1.449 -1.489 5.203 1.00 0.00 C ATOM 0 H5' DG A 3 5.809 -2.756 9.313 1.00 0.00 H new ATOM 0 H5'' DG A 3 5.099 -3.798 10.530 1.00 0.00 H new ATOM 0 H4' DG A 3 3.476 -2.288 9.857 1.00 0.00 H new ATOM 0 H3' DG A 3 2.889 -5.115 9.362 1.00 0.00 H new ATOM 0 H2' DG A 3 2.350 -4.745 7.064 1.00 0.00 H new ATOM 0 H2'' DG A 3 0.868 -4.125 7.764 1.00 0.00 H new ATOM 0 H1' DG A 3 1.680 -1.818 7.729 1.00 0.00 H new ATOM 0 H8 DG A 3 3.611 -3.894 5.085 1.00 0.00 H new ATOM 0 H1 DG A 3 -0.367 0.695 2.876 1.00 0.00 H new ATOM 0 H21 DG A 3 -1.072 1.179 6.235 1.00 0.00 H new ATOM 0 H22 DG A 3 -1.441 1.584 4.555 1.00 0.00 H new ATOM 95 P DG A 4 0.310 -4.542 10.483 1.00 0.00 P ATOM 96 OP1 DG A 4 0.215 -4.734 11.946 1.00 0.00 O ATOM 97 OP2 DG A 4 0.205 -5.733 9.607 1.00 0.00 O ATOM 98 O5' DG A 4 -0.817 -3.508 10.049 1.00 0.00 O ATOM 99 C5' DG A 4 -0.957 -2.273 10.740 1.00 0.00 C ATOM 100 C4' DG A 4 -2.159 -1.432 10.292 1.00 0.00 C ATOM 101 O4' DG A 4 -2.008 -1.094 8.922 1.00 0.00 O ATOM 102 C3' DG A 4 -3.512 -2.152 10.428 1.00 0.00 C ATOM 103 O3' DG A 4 -4.593 -1.246 10.594 1.00 0.00 O ATOM 104 C2' DG A 4 -3.690 -2.756 9.045 1.00 0.00 C ATOM 105 C1' DG A 4 -3.109 -1.627 8.197 1.00 0.00 C ATOM 106 N9 DG A 4 -2.672 -2.070 6.863 1.00 0.00 N ATOM 107 C8 DG A 4 -1.796 -3.076 6.543 1.00 0.00 C ATOM 108 N7 DG A 4 -1.605 -3.229 5.255 1.00 0.00 N ATOM 109 C5 DG A 4 -2.411 -2.226 4.684 1.00 0.00 C ATOM 110 C6 DG A 4 -2.604 -1.815 3.316 1.00 0.00 C ATOM 111 O6 DG A 4 -2.034 -2.233 2.305 1.00 0.00 O ATOM 112 N1 DG A 4 -3.530 -0.797 3.162 1.00 0.00 N ATOM 113 C2 DG A 4 -4.174 -0.208 4.213 1.00 0.00 C ATOM 114 N2 DG A 4 -5.069 0.705 3.967 1.00 0.00 N ATOM 115 N3 DG A 4 -3.972 -0.503 5.497 1.00 0.00 N ATOM 116 C4 DG A 4 -3.084 -1.531 5.668 1.00 0.00 C ATOM 0 H5' DG A 4 -0.048 -1.688 10.602 1.00 0.00 H new ATOM 0 H5'' DG A 4 -1.048 -2.475 11.807 1.00 0.00 H new ATOM 0 H4' DG A 4 -2.171 -0.561 10.947 1.00 0.00 H new ATOM 0 H3' DG A 4 -3.513 -2.835 11.278 1.00 0.00 H new ATOM 0 H2' DG A 4 -3.146 -3.693 8.924 1.00 0.00 H new ATOM 0 H2'' DG A 4 -4.734 -2.961 8.809 1.00 0.00 H new ATOM 0 H1' DG A 4 -3.883 -0.881 8.019 1.00 0.00 H new ATOM 0 H8 DG A 4 -1.307 -3.688 7.286 1.00 0.00 H new ATOM 0 H1 DG A 4 -3.741 -0.471 2.219 1.00 0.00 H new ATOM 0 H21 DG A 4 -5.561 1.157 4.737 1.00 0.00 H new ATOM 0 H22 DG A 4 -5.278 0.968 3.004 1.00 0.00 H new ATOM 128 P DC A 5 -4.946 -0.531 11.962 1.00 0.00 P ATOM 129 OP1 DC A 5 -4.680 -1.490 13.056 1.00 0.00 O ATOM 130 OP2 DC A 5 -6.323 -0.027 11.781 1.00 0.00 O ATOM 131 O5' DC A 5 -3.925 0.682 12.120 1.00 0.00 O ATOM 132 C5' DC A 5 -3.879 1.776 11.209 1.00 0.00 C ATOM 133 C4' DC A 5 -2.963 2.907 11.718 1.00 0.00 C ATOM 134 O4' DC A 5 -3.562 3.455 12.891 1.00 0.00 O ATOM 135 C3' DC A 5 -1.548 2.430 12.103 1.00 0.00 C ATOM 136 O3' DC A 5 -0.522 3.385 11.839 1.00 0.00 O ATOM 137 C2' DC A 5 -1.664 2.278 13.614 1.00 0.00 C ATOM 138 C1' DC A 5 -2.648 3.396 13.967 1.00 0.00 C ATOM 139 N1 DC A 5 -3.353 3.170 15.261 1.00 0.00 N ATOM 140 C2 DC A 5 -3.116 4.042 16.332 1.00 0.00 C ATOM 141 O2 DC A 5 -2.415 5.052 16.214 1.00 0.00 O ATOM 142 N3 DC A 5 -3.611 3.789 17.564 1.00 0.00 N ATOM 143 C4 DC A 5 -4.346 2.713 17.726 1.00 0.00 C ATOM 144 N4 DC A 5 -4.748 2.496 18.944 1.00 0.00 N ATOM 145 C5 DC A 5 -4.670 1.811 16.680 1.00 0.00 C ATOM 146 C6 DC A 5 -4.155 2.071 15.450 1.00 0.00 C ATOM 0 H5' DC A 5 -4.886 2.165 11.057 1.00 0.00 H new ATOM 0 H5'' DC A 5 -3.522 1.427 10.240 1.00 0.00 H new ATOM 0 H4' DC A 5 -2.858 3.627 10.907 1.00 0.00 H new ATOM 0 H3' DC A 5 -1.270 1.540 11.539 1.00 0.00 H new ATOM 0 H2' DC A 5 -2.042 1.296 13.898 1.00 0.00 H new ATOM 0 H2'' DC A 5 -0.703 2.406 14.113 1.00 0.00 H new ATOM 0 H1' DC A 5 -2.114 4.336 14.106 1.00 0.00 H new ATOM 0 H41 DC A 5 -5.324 1.680 19.153 1.00 0.00 H new ATOM 0 H42 DC A 5 -4.488 3.141 19.690 1.00 0.00 H new ATOM 0 H5 DC A 5 -5.301 0.952 16.855 1.00 0.00 H new ATOM 0 H6 DC A 5 -4.376 1.414 14.622 1.00 0.00 H new ATOM 158 P DG A 6 0.243 3.478 10.431 1.00 0.00 P ATOM 159 OP1 DG A 6 0.227 2.142 9.797 1.00 0.00 O ATOM 160 OP2 DG A 6 1.551 4.111 10.712 1.00 0.00 O ATOM 161 O5' DG A 6 -0.630 4.466 9.519 1.00 0.00 O ATOM 162 C5' DG A 6 -0.723 5.863 9.796 1.00 0.00 C ATOM 163 C4' DG A 6 -1.402 6.683 8.680 1.00 0.00 C ATOM 164 O4' DG A 6 -0.584 6.699 7.515 1.00 0.00 O ATOM 165 C3' DG A 6 -2.779 6.137 8.287 1.00 0.00 C ATOM 166 O3' DG A 6 -3.724 7.192 8.111 1.00 0.00 O ATOM 167 C2' DG A 6 -2.503 5.415 6.975 1.00 0.00 C ATOM 168 C1' DG A 6 -1.293 6.159 6.409 1.00 0.00 C ATOM 169 N9 DG A 6 -0.406 5.251 5.652 1.00 0.00 N ATOM 170 C8 DG A 6 0.341 4.221 6.170 1.00 0.00 C ATOM 171 N7 DG A 6 1.014 3.539 5.285 1.00 0.00 N ATOM 172 C5 DG A 6 0.694 4.174 4.082 1.00 0.00 C ATOM 173 C6 DG A 6 1.117 3.887 2.743 1.00 0.00 C ATOM 174 O6 DG A 6 1.800 2.951 2.326 1.00 0.00 O ATOM 175 N1 DG A 6 0.683 4.796 1.815 1.00 0.00 N ATOM 176 C2 DG A 6 -0.215 5.786 2.094 1.00 0.00 C ATOM 177 N2 DG A 6 -0.711 6.433 1.072 1.00 0.00 N ATOM 178 N3 DG A 6 -0.705 6.047 3.313 1.00 0.00 N ATOM 179 C4 DG A 6 -0.177 5.227 4.285 1.00 0.00 C ATOM 0 H5' DG A 6 0.280 6.257 9.963 1.00 0.00 H new ATOM 0 H5'' DG A 6 -1.278 6.002 10.723 1.00 0.00 H new ATOM 0 H4' DG A 6 -1.535 7.687 9.082 1.00 0.00 H new ATOM 0 H3' DG A 6 -3.215 5.489 9.047 1.00 0.00 H new ATOM 0 H2' DG A 6 -2.286 4.359 7.135 1.00 0.00 H new ATOM 0 H2'' DG A 6 -3.358 5.466 6.301 1.00 0.00 H new ATOM 0 H1' DG A 6 -1.625 6.937 5.722 1.00 0.00 H new ATOM 0 H8 DG A 6 0.369 3.994 7.226 1.00 0.00 H new ATOM 0 H1 DG A 6 1.050 4.730 0.866 1.00 0.00 H new ATOM 0 H21 DG A 6 -1.386 7.183 1.222 1.00 0.00 H new ATOM 0 H22 DG A 6 -0.423 6.188 0.125 1.00 0.00 H new ATOM 191 P DG A 7 -5.300 6.914 8.174 1.00 0.00 P ATOM 192 OP1 DG A 7 -5.953 8.165 8.623 1.00 0.00 O ATOM 193 OP2 DG A 7 -5.513 5.701 8.979 1.00 0.00 O ATOM 194 O5' DG A 7 -5.777 6.522 6.707 1.00 0.00 O ATOM 195 C5' DG A 7 -5.945 7.472 5.668 1.00 0.00 C ATOM 196 C4' DG A 7 -5.971 6.788 4.289 1.00 0.00 C ATOM 197 O4' DG A 7 -4.699 6.244 3.978 1.00 0.00 O ATOM 198 C3' DG A 7 -6.925 5.591 4.166 1.00 0.00 C ATOM 199 O3' DG A 7 -8.267 5.936 3.838 1.00 0.00 O ATOM 200 C2' DG A 7 -6.272 4.765 3.059 1.00 0.00 C ATOM 201 C1' DG A 7 -4.896 5.399 2.864 1.00 0.00 C ATOM 202 N9 DG A 7 -3.827 4.382 2.760 1.00 0.00 N ATOM 203 C8 DG A 7 -3.253 3.624 3.755 1.00 0.00 C ATOM 204 N7 DG A 7 -2.366 2.752 3.338 1.00 0.00 N ATOM 205 C5 DG A 7 -2.383 2.932 1.947 1.00 0.00 C ATOM 206 C6 DG A 7 -1.668 2.253 0.903 1.00 0.00 C ATOM 207 O6 DG A 7 -0.845 1.341 1.024 1.00 0.00 O ATOM 208 N1 DG A 7 -1.982 2.687 -0.375 1.00 0.00 N ATOM 209 C2 DG A 7 -2.902 3.670 -0.619 1.00 0.00 C ATOM 210 N2 DG A 7 -3.189 3.943 -1.859 1.00 0.00 N ATOM 211 N3 DG A 7 -3.576 4.334 0.317 1.00 0.00 N ATOM 212 C4 DG A 7 -3.275 3.919 1.586 1.00 0.00 C ATOM 0 H5' DG A 7 -5.134 8.199 5.701 1.00 0.00 H new ATOM 0 H5'' DG A 7 -6.873 8.023 5.821 1.00 0.00 H new ATOM 0 H4' DG A 7 -6.297 7.589 3.625 1.00 0.00 H new ATOM 0 H3' DG A 7 -7.040 5.069 5.116 1.00 0.00 H new ATOM 0 H2' DG A 7 -6.188 3.716 3.344 1.00 0.00 H new ATOM 0 H2'' DG A 7 -6.858 4.800 2.141 1.00 0.00 H new ATOM 0 H1' DG A 7 -4.853 5.956 1.928 1.00 0.00 H new ATOM 0 H8 DG A 7 -3.512 3.738 4.797 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.507 2.255 -1.168 1.00 0.00 H new ATOM 0 H21 DG A 7 -3.870 4.670 -2.077 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.732 3.430 -2.613 1.00 0.00 H new ATOM 224 P DG A 8 -9.412 4.816 3.768 1.00 0.00 P ATOM 225 OP1 DG A 8 -10.681 5.480 4.155 1.00 0.00 O ATOM 226 OP2 DG A 8 -8.973 3.636 4.539 1.00 0.00 O ATOM 227 O5' DG A 8 -9.550 4.321 2.257 1.00 0.00 O ATOM 228 C5' DG A 8 -10.291 5.033 1.267 1.00 0.00 C ATOM 229 C4' DG A 8 -10.300 4.321 -0.103 1.00 0.00 C ATOM 230 O4' DG A 8 -8.953 4.030 -0.472 1.00 0.00 O ATOM 231 C3' DG A 8 -11.075 2.985 -0.103 1.00 0.00 C ATOM 232 O3' DG A 8 -11.688 2.685 -1.355 1.00 0.00 O ATOM 233 C2' DG A 8 -9.973 1.972 0.128 1.00 0.00 C ATOM 234 C1' DG A 8 -8.815 2.626 -0.625 1.00 0.00 C ATOM 235 N9 DG A 8 -7.509 2.157 -0.127 1.00 0.00 N ATOM 236 C8 DG A 8 -7.094 2.085 1.175 1.00 0.00 C ATOM 237 N7 DG A 8 -5.954 1.469 1.348 1.00 0.00 N ATOM 238 C5 DG A 8 -5.595 1.088 0.050 1.00 0.00 C ATOM 239 C6 DG A 8 -4.497 0.296 -0.431 1.00 0.00 C ATOM 240 O6 DG A 8 -3.606 -0.247 0.230 1.00 0.00 O ATOM 241 N1 DG A 8 -4.497 0.123 -1.807 1.00 0.00 N ATOM 242 C2 DG A 8 -5.465 0.632 -2.616 1.00 0.00 C ATOM 243 N2 DG A 8 -5.387 0.400 -3.892 1.00 0.00 N ATOM 244 N3 DG A 8 -6.518 1.334 -2.212 1.00 0.00 N ATOM 245 C4 DG A 8 -6.526 1.533 -0.862 1.00 0.00 C ATOM 0 H5' DG A 8 -9.867 6.030 1.150 1.00 0.00 H new ATOM 0 H5'' DG A 8 -11.317 5.162 1.611 1.00 0.00 H new ATOM 0 H4' DG A 8 -10.797 4.995 -0.800 1.00 0.00 H new ATOM 0 H3' DG A 8 -11.882 2.999 0.629 1.00 0.00 H new ATOM 0 H2' DG A 8 -9.752 1.836 1.187 1.00 0.00 H new ATOM 0 H2'' DG A 8 -10.224 0.990 -0.273 1.00 0.00 H new ATOM 0 H1' DG A 8 -8.850 2.352 -1.680 1.00 0.00 H new ATOM 0 H8 DG A 8 -7.662 2.503 1.993 1.00 0.00 H new ATOM 0 H1 DG A 8 -3.738 -0.410 -2.231 1.00 0.00 H new ATOM 0 H21 DG A 8 -6.099 0.769 -4.522 1.00 0.00 H new ATOM 0 H22 DG A 8 -4.614 -0.152 -4.264 1.00 0.00 H new ATOM 257 P DC A 9 -13.134 3.243 -1.743 1.00 0.00 P ATOM 258 OP1 DC A 9 -14.007 3.084 -0.561 1.00 0.00 O ATOM 259 OP2 DC A 9 -13.562 2.604 -3.008 1.00 0.00 O ATOM 260 O5' DC A 9 -12.963 4.808 -2.028 1.00 0.00 O ATOM 261 C5' DC A 9 -12.226 5.268 -3.158 1.00 0.00 C ATOM 262 C4' DC A 9 -12.388 6.779 -3.361 1.00 0.00 C ATOM 263 O4' DC A 9 -11.600 7.169 -4.488 1.00 0.00 O ATOM 264 C3' DC A 9 -13.847 7.176 -3.678 1.00 0.00 C ATOM 265 O3' DC A 9 -14.142 8.431 -3.071 1.00 0.00 O ATOM 266 C2' DC A 9 -13.775 7.312 -5.194 1.00 0.00 C ATOM 267 C1' DC A 9 -12.421 8.005 -5.276 1.00 0.00 C ATOM 268 N1 DC A 9 -11.925 8.240 -6.658 1.00 0.00 N ATOM 269 C2 DC A 9 -11.644 9.558 -7.051 1.00 0.00 C ATOM 270 O2 DC A 9 -11.643 10.502 -6.258 1.00 0.00 O ATOM 271 N3 DC A 9 -11.353 9.855 -8.337 1.00 0.00 N ATOM 272 C4 DC A 9 -11.325 8.870 -9.203 1.00 0.00 C ATOM 273 N4 DC A 9 -11.021 9.236 -10.410 1.00 0.00 N ATOM 274 C5 DC A 9 -11.552 7.507 -8.873 1.00 0.00 C ATOM 275 C6 DC A 9 -11.849 7.225 -7.579 1.00 0.00 C ATOM 0 H5' DC A 9 -12.563 4.742 -4.051 1.00 0.00 H new ATOM 0 H5'' DC A 9 -11.171 5.029 -3.027 1.00 0.00 H new ATOM 0 H4' DC A 9 -12.080 7.268 -2.437 1.00 0.00 H new ATOM 0 H3' DC A 9 -14.610 6.483 -3.324 1.00 0.00 H new ATOM 0 H2' DC A 9 -13.794 6.352 -5.709 1.00 0.00 H new ATOM 0 H2'' DC A 9 -14.586 7.912 -5.607 1.00 0.00 H new ATOM 0 H1' DC A 9 -12.451 9.031 -4.910 1.00 0.00 H new ATOM 0 H41 DC A 9 -10.973 8.542 -11.156 1.00 0.00 H new ATOM 0 H42 DC A 9 -10.830 10.217 -10.612 1.00 0.00 H new ATOM 0 H5 DC A 9 -11.491 6.729 -9.619 1.00 0.00 H new ATOM 0 H6 DC A 9 -12.025 6.204 -7.275 1.00 0.00 H new ATOM 287 P DG A 10 -15.580 9.125 -3.102 1.00 0.00 P ATOM 288 OP1 DG A 10 -15.527 10.212 -2.105 1.00 0.00 O ATOM 289 OP2 DG A 10 -16.597 8.067 -2.938 1.00 0.00 O ATOM 290 O5' DG A 10 -15.807 9.781 -4.552 1.00 0.00 O ATOM 291 C5' DG A 10 -14.997 10.859 -5.016 1.00 0.00 C ATOM 292 C4' DG A 10 -15.099 11.092 -6.534 1.00 0.00 C ATOM 293 O4' DG A 10 -14.649 9.930 -7.221 1.00 0.00 O ATOM 294 C3' DG A 10 -16.520 11.394 -7.034 1.00 0.00 C ATOM 295 O3' DG A 10 -16.506 12.523 -7.898 1.00 0.00 O ATOM 296 C2' DG A 10 -16.889 10.137 -7.816 1.00 0.00 C ATOM 297 C1' DG A 10 -15.521 9.659 -8.299 1.00 0.00 C ATOM 298 N9 DG A 10 -15.459 8.214 -8.634 1.00 0.00 N ATOM 299 C8 DG A 10 -15.900 7.143 -7.892 1.00 0.00 C ATOM 300 N7 DG A 10 -15.658 5.975 -8.426 1.00 0.00 N ATOM 301 C5 DG A 10 -15.038 6.294 -9.643 1.00 0.00 C ATOM 302 C6 DG A 10 -14.545 5.459 -10.711 1.00 0.00 C ATOM 303 O6 DG A 10 -14.554 4.230 -10.829 1.00 0.00 O ATOM 304 N1 DG A 10 -13.964 6.172 -11.732 1.00 0.00 N ATOM 305 C2 DG A 10 -13.874 7.519 -11.764 1.00 0.00 C ATOM 306 N2 DG A 10 -13.275 8.007 -12.814 1.00 0.00 N ATOM 307 N3 DG A 10 -14.328 8.344 -10.816 1.00 0.00 N ATOM 308 C4 DG A 10 -14.903 7.665 -9.771 1.00 0.00 C ATOM 0 H5' DG A 10 -13.957 10.661 -4.756 1.00 0.00 H new ATOM 0 H5'' DG A 10 -15.287 11.772 -4.496 1.00 0.00 H new ATOM 0 H4' DG A 10 -14.483 11.968 -6.736 1.00 0.00 H new ATOM 0 H3' DG A 10 -17.220 11.623 -6.231 1.00 0.00 H new ATOM 0 H2' DG A 10 -17.384 9.395 -7.189 1.00 0.00 H new ATOM 0 H2'' DG A 10 -17.563 10.354 -8.645 1.00 0.00 H new ATOM 0 H1' DG A 10 -15.264 10.169 -9.227 1.00 0.00 H new ATOM 0 H8 DG A 10 -16.405 7.258 -6.945 1.00 0.00 H new ATOM 0 H1 DG A 10 -13.575 5.650 -12.517 1.00 0.00 H new ATOM 0 H21 DG A 10 -13.165 9.016 -12.916 1.00 0.00 H new ATOM 0 H22 DG A 10 -12.916 7.380 -13.534 1.00 0.00 H new ATOM 320 P DC A 11 -17.484 13.758 -7.663 1.00 0.00 P ATOM 321 OP1 DC A 11 -18.874 13.262 -7.730 1.00 0.00 O ATOM 322 OP2 DC A 11 -17.073 14.829 -8.596 1.00 0.00 O ATOM 323 O5' DC A 11 -17.202 14.273 -6.177 1.00 0.00 O ATOM 324 C5' DC A 11 -17.472 15.625 -5.811 1.00 0.00 C ATOM 325 C4' DC A 11 -16.929 15.999 -4.427 1.00 0.00 C ATOM 326 O4' DC A 11 -17.761 15.468 -3.408 1.00 0.00 O ATOM 327 C3' DC A 11 -15.497 15.504 -4.157 1.00 0.00 C ATOM 328 O3' DC A 11 -14.630 16.548 -3.730 1.00 0.00 O ATOM 329 C2' DC A 11 -15.715 14.541 -2.991 1.00 0.00 C ATOM 330 C1' DC A 11 -16.936 15.151 -2.304 1.00 0.00 C ATOM 331 N1 DC A 11 -17.688 14.304 -1.325 1.00 0.00 N ATOM 332 C2 DC A 11 -18.783 14.883 -0.654 1.00 0.00 C ATOM 333 O2 DC A 11 -19.063 16.082 -0.780 1.00 0.00 O ATOM 334 N3 DC A 11 -19.555 14.153 0.195 1.00 0.00 N ATOM 335 C4 DC A 11 -19.192 12.908 0.436 1.00 0.00 C ATOM 336 N4 DC A 11 -19.909 12.253 1.301 1.00 0.00 N ATOM 337 C5 DC A 11 -18.054 12.290 -0.142 1.00 0.00 C ATOM 338 C6 DC A 11 -17.320 13.011 -1.022 1.00 0.00 C ATOM 0 H5' DC A 11 -18.549 15.790 -5.828 1.00 0.00 H new ATOM 0 H5'' DC A 11 -17.036 16.290 -6.557 1.00 0.00 H new ATOM 0 H4' DC A 11 -16.917 17.089 -4.416 1.00 0.00 H new ATOM 0 H3' DC A 11 -15.032 15.078 -5.046 1.00 0.00 H new ATOM 0 H2' DC A 11 -15.904 13.523 -3.332 1.00 0.00 H new ATOM 0 H2'' DC A 11 -14.851 14.500 -2.328 1.00 0.00 H new ATOM 0 H1' DC A 11 -16.618 15.974 -1.664 1.00 0.00 H new ATOM 0 H41 DC A 11 -19.677 11.286 1.528 1.00 0.00 H new ATOM 0 H42 DC A 11 -20.704 12.706 1.752 1.00 0.00 H new ATOM 0 H5 DC A 11 -17.781 11.276 0.112 1.00 0.00 H new ATOM 0 H6 DC A 11 -16.448 12.574 -1.486 1.00 0.00 H new ATOM 350 P DG A 12 -13.906 17.529 -4.757 1.00 0.00 P ATOM 351 OP1 DG A 12 -13.152 18.529 -3.966 1.00 0.00 O ATOM 352 OP2 DG A 12 -14.863 17.971 -5.801 1.00 0.00 O ATOM 353 O5' DG A 12 -12.815 16.615 -5.469 1.00 0.00 O ATOM 354 C5' DG A 12 -11.973 17.188 -6.459 1.00 0.00 C ATOM 355 C4' DG A 12 -10.908 16.229 -6.995 1.00 0.00 C ATOM 356 O4' DG A 12 -10.090 16.975 -7.893 1.00 0.00 O ATOM 357 C3' DG A 12 -10.008 15.678 -5.879 1.00 0.00 C ATOM 358 O3' DG A 12 -9.617 14.342 -6.171 1.00 0.00 O ATOM 359 C2' DG A 12 -8.855 16.670 -5.908 1.00 0.00 C ATOM 360 C1' DG A 12 -8.763 17.017 -7.391 1.00 0.00 C ATOM 361 N9 DG A 12 -8.169 18.352 -7.627 1.00 0.00 N ATOM 362 C8 DG A 12 -8.487 19.545 -7.025 1.00 0.00 C ATOM 363 N7 DG A 12 -7.743 20.554 -7.387 1.00 0.00 N ATOM 364 C5 DG A 12 -6.867 19.982 -8.324 1.00 0.00 C ATOM 365 C6 DG A 12 -5.805 20.557 -9.104 1.00 0.00 C ATOM 366 O6 DG A 12 -5.437 21.732 -9.153 1.00 0.00 O ATOM 367 N1 DG A 12 -5.135 19.643 -9.893 1.00 0.00 N ATOM 368 C2 DG A 12 -5.473 18.332 -9.973 1.00 0.00 C ATOM 369 N2 DG A 12 -4.700 17.559 -10.685 1.00 0.00 N ATOM 370 N3 DG A 12 -6.481 17.762 -9.313 1.00 0.00 N ATOM 371 C4 DG A 12 -7.131 18.639 -8.485 1.00 0.00 C ATOM 0 H5' DG A 12 -11.480 18.065 -6.040 1.00 0.00 H new ATOM 0 H5'' DG A 12 -12.588 17.534 -7.290 1.00 0.00 H new ATOM 0 H4' DG A 12 -11.403 15.384 -7.472 1.00 0.00 H new ATOM 0 H3' DG A 12 -10.470 15.604 -4.895 1.00 0.00 H new ATOM 0 H2' DG A 12 -9.059 17.549 -5.296 1.00 0.00 H new ATOM 0 H2'' DG A 12 -7.930 16.230 -5.535 1.00 0.00 H new ATOM 0 H1' DG A 12 -8.109 16.307 -7.896 1.00 0.00 H new ATOM 0 H8 DG A 12 -9.290 19.640 -6.309 1.00 0.00 H new ATOM 0 H1 DG A 12 -4.343 19.972 -10.446 1.00 0.00 H new ATOM 0 H21 DG A 12 -4.914 16.566 -10.774 1.00 0.00 H new ATOM 0 H22 DG A 12 -3.881 17.948 -11.153 1.00 0.00 H new ATOM 383 P DA A 13 -8.698 13.472 -5.190 1.00 0.00 P ATOM 384 OP1 DA A 13 -8.916 12.055 -5.529 1.00 0.00 O ATOM 385 OP2 DA A 13 -8.901 13.929 -3.797 1.00 0.00 O ATOM 386 O5' DA A 13 -7.198 13.829 -5.568 1.00 0.00 O ATOM 387 C5' DA A 13 -6.700 13.605 -6.875 1.00 0.00 C ATOM 388 C4' DA A 13 -5.400 14.368 -7.141 1.00 0.00 C ATOM 389 O4' DA A 13 -5.622 15.765 -7.007 1.00 0.00 O ATOM 390 C3' DA A 13 -4.246 14.010 -6.185 1.00 0.00 C ATOM 391 O3' DA A 13 -3.091 13.542 -6.875 1.00 0.00 O ATOM 392 C2' DA A 13 -3.901 15.357 -5.551 1.00 0.00 C ATOM 393 C1' DA A 13 -4.387 16.326 -6.624 1.00 0.00 C ATOM 394 N9 DA A 13 -4.499 17.742 -6.195 1.00 0.00 N ATOM 395 C8 DA A 13 -3.836 18.807 -6.757 1.00 0.00 C ATOM 396 N7 DA A 13 -4.143 19.971 -6.252 1.00 0.00 N ATOM 397 C5 DA A 13 -5.087 19.641 -5.267 1.00 0.00 C ATOM 398 C6 DA A 13 -5.877 20.392 -4.364 1.00 0.00 C ATOM 399 N6 DA A 13 -5.886 21.709 -4.285 1.00 0.00 N ATOM 400 N1 DA A 13 -6.709 19.803 -3.503 1.00 0.00 N ATOM 401 C2 DA A 13 -6.758 18.476 -3.514 1.00 0.00 C ATOM 402 N3 DA A 13 -6.111 17.637 -4.315 1.00 0.00 N ATOM 403 C4 DA A 13 -5.286 18.285 -5.193 1.00 0.00 C ATOM 0 H5' DA A 13 -7.452 13.907 -7.604 1.00 0.00 H new ATOM 0 H5'' DA A 13 -6.528 12.538 -7.018 1.00 0.00 H new ATOM 0 H4' DA A 13 -5.108 14.081 -8.151 1.00 0.00 H new ATOM 0 H3' DA A 13 -4.535 13.221 -5.491 1.00 0.00 H new ATOM 0 H2' DA A 13 -4.412 15.507 -4.600 1.00 0.00 H new ATOM 0 H2'' DA A 13 -2.833 15.459 -5.358 1.00 0.00 H new ATOM 0 H1' DA A 13 -3.670 16.415 -7.440 1.00 0.00 H new ATOM 0 H8 DA A 13 -3.117 18.690 -7.554 1.00 0.00 H new ATOM 0 H61 DA A 13 -6.486 22.175 -3.605 1.00 0.00 H new ATOM 0 H62 DA A 13 -5.293 22.261 -4.904 1.00 0.00 H new ATOM 0 H2 DA A 13 -7.406 18.022 -2.779 1.00 0.00 H new ATOM 415 P DG A 14 -2.966 12.038 -7.399 1.00 0.00 P ATOM 416 OP1 DG A 14 -1.595 11.907 -7.930 1.00 0.00 O ATOM 417 OP2 DG A 14 -4.100 11.737 -8.300 1.00 0.00 O ATOM 418 O5' DG A 14 -3.123 11.132 -6.089 1.00 0.00 O ATOM 419 C5' DG A 14 -1.997 10.602 -5.396 1.00 0.00 C ATOM 420 C4' DG A 14 -1.377 9.392 -6.116 1.00 0.00 C ATOM 421 O4' DG A 14 -0.503 8.757 -5.199 1.00 0.00 O ATOM 422 C3' DG A 14 -2.412 8.353 -6.581 1.00 0.00 C ATOM 423 O3' DG A 14 -2.421 8.253 -8.002 1.00 0.00 O ATOM 424 C2' DG A 14 -1.963 7.056 -5.910 1.00 0.00 C ATOM 425 C1' DG A 14 -0.558 7.361 -5.396 1.00 0.00 C ATOM 426 N9 DG A 14 -0.295 6.693 -4.101 1.00 0.00 N ATOM 427 C8 DG A 14 -0.828 6.998 -2.866 1.00 0.00 C ATOM 428 N7 DG A 14 -0.427 6.223 -1.891 1.00 0.00 N ATOM 429 C5 DG A 14 0.435 5.323 -2.536 1.00 0.00 C ATOM 430 C6 DG A 14 1.179 4.207 -2.023 1.00 0.00 C ATOM 431 O6 DG A 14 1.199 3.762 -0.875 1.00 0.00 O ATOM 432 N1 DG A 14 1.941 3.555 -2.977 1.00 0.00 N ATOM 433 C2 DG A 14 1.938 3.895 -4.295 1.00 0.00 C ATOM 434 N2 DG A 14 2.592 3.120 -5.114 1.00 0.00 N ATOM 435 N3 DG A 14 1.259 4.916 -4.824 1.00 0.00 N ATOM 436 C4 DG A 14 0.524 5.602 -3.886 1.00 0.00 C ATOM 0 H5' DG A 14 -2.299 10.307 -4.391 1.00 0.00 H new ATOM 0 H5'' DG A 14 -1.243 11.381 -5.286 1.00 0.00 H new ATOM 0 H4' DG A 14 -0.873 9.762 -7.009 1.00 0.00 H new ATOM 0 H3' DG A 14 -3.435 8.613 -6.308 1.00 0.00 H new ATOM 0 H2' DG A 14 -2.632 6.777 -5.096 1.00 0.00 H new ATOM 0 H2'' DG A 14 -1.956 6.225 -6.616 1.00 0.00 H new ATOM 0 H1' DG A 14 0.184 7.004 -6.110 1.00 0.00 H new ATOM 0 H8 DG A 14 -1.522 7.812 -2.716 1.00 0.00 H new ATOM 0 H1 DG A 14 2.534 2.781 -2.677 1.00 0.00 H new ATOM 0 H21 DG A 14 2.617 3.336 -6.111 1.00 0.00 H new ATOM 0 H22 DG A 14 3.079 2.297 -4.758 1.00 0.00 H new ATOM 448 P DG A 15 -3.609 7.546 -8.803 1.00 0.00 P ATOM 449 OP1 DG A 15 -3.587 8.050 -10.199 1.00 0.00 O ATOM 450 OP2 DG A 15 -4.858 7.702 -8.028 1.00 0.00 O ATOM 451 O5' DG A 15 -3.280 5.991 -8.817 1.00 0.00 O ATOM 452 C5' DG A 15 -2.282 5.451 -9.669 1.00 0.00 C ATOM 453 C4' DG A 15 -1.911 4.006 -9.309 1.00 0.00 C ATOM 454 O4' DG A 15 -1.239 3.980 -8.059 1.00 0.00 O ATOM 455 C3' DG A 15 -3.094 3.033 -9.177 1.00 0.00 C ATOM 456 O3' DG A 15 -3.373 2.360 -10.403 1.00 0.00 O ATOM 457 C2' DG A 15 -2.611 2.074 -8.087 1.00 0.00 C ATOM 458 C1' DG A 15 -1.272 2.641 -7.617 1.00 0.00 C ATOM 459 N9 DG A 15 -1.129 2.537 -6.155 1.00 0.00 N ATOM 460 C8 DG A 15 -1.737 3.291 -5.190 1.00 0.00 C ATOM 461 N7 DG A 15 -1.528 2.881 -3.966 1.00 0.00 N ATOM 462 C5 DG A 15 -0.724 1.749 -4.141 1.00 0.00 C ATOM 463 C6 DG A 15 -0.175 0.823 -3.188 1.00 0.00 C ATOM 464 O6 DG A 15 -0.304 0.828 -1.959 1.00 0.00 O ATOM 465 N1 DG A 15 0.585 -0.183 -3.764 1.00 0.00 N ATOM 466 C2 DG A 15 0.774 -0.289 -5.118 1.00 0.00 C ATOM 467 N2 DG A 15 1.426 -1.310 -5.592 1.00 0.00 N ATOM 468 N3 DG A 15 0.295 0.552 -6.027 1.00 0.00 N ATOM 469 C4 DG A 15 -0.456 1.549 -5.477 1.00 0.00 C ATOM 0 H5' DG A 15 -1.389 6.074 -9.616 1.00 0.00 H new ATOM 0 H5'' DG A 15 -2.634 5.485 -10.700 1.00 0.00 H new ATOM 0 H4' DG A 15 -1.296 3.674 -10.146 1.00 0.00 H new ATOM 0 H3' DG A 15 -4.035 3.526 -8.930 1.00 0.00 H new ATOM 0 H2' DG A 15 -3.326 2.020 -7.266 1.00 0.00 H new ATOM 0 H2'' DG A 15 -2.495 1.062 -8.476 1.00 0.00 H new ATOM 0 H1' DG A 15 -0.434 2.078 -8.029 1.00 0.00 H new ATOM 0 H8 DG A 15 -2.341 4.156 -5.420 1.00 0.00 H new ATOM 0 H1 DG A 15 1.022 -0.874 -3.155 1.00 0.00 H new ATOM 0 H21 DG A 15 1.573 -1.399 -6.597 1.00 0.00 H new ATOM 0 H22 DG A 15 1.791 -2.021 -4.958 1.00 0.00 H new ATOM 481 P DG A 16 -4.558 1.280 -10.584 1.00 0.00 P ATOM 482 OP1 DG A 16 -4.806 1.192 -12.037 1.00 0.00 O ATOM 483 OP2 DG A 16 -5.688 1.641 -9.693 1.00 0.00 O ATOM 484 O5' DG A 16 -3.964 -0.124 -10.096 1.00 0.00 O ATOM 485 C5' DG A 16 -2.999 -0.803 -10.887 1.00 0.00 C ATOM 486 C4' DG A 16 -2.425 -2.080 -10.256 1.00 0.00 C ATOM 487 O4' DG A 16 -1.881 -1.800 -8.972 1.00 0.00 O ATOM 488 C3' DG A 16 -3.447 -3.223 -10.064 1.00 0.00 C ATOM 489 O3' DG A 16 -2.925 -4.538 -10.286 1.00 0.00 O ATOM 490 C2' DG A 16 -3.756 -3.123 -8.579 1.00 0.00 C ATOM 491 C1' DG A 16 -2.367 -2.766 -8.061 1.00 0.00 C ATOM 492 N9 DG A 16 -2.412 -2.214 -6.699 1.00 0.00 N ATOM 493 C8 DG A 16 -3.022 -1.056 -6.286 1.00 0.00 C ATOM 494 N7 DG A 16 -3.016 -0.874 -4.993 1.00 0.00 N ATOM 495 C5 DG A 16 -2.368 -2.022 -4.517 1.00 0.00 C ATOM 496 C6 DG A 16 -2.107 -2.457 -3.176 1.00 0.00 C ATOM 497 O6 DG A 16 -2.409 -1.896 -2.122 1.00 0.00 O ATOM 498 N1 DG A 16 -1.432 -3.656 -3.098 1.00 0.00 N ATOM 499 C2 DG A 16 -1.083 -4.393 -4.185 1.00 0.00 C ATOM 500 N2 DG A 16 -0.539 -5.561 -3.968 1.00 0.00 N ATOM 501 N3 DG A 16 -1.306 -4.036 -5.455 1.00 0.00 N ATOM 502 C4 DG A 16 -1.964 -2.835 -5.554 1.00 0.00 C ATOM 0 H5' DG A 16 -2.177 -0.119 -11.097 1.00 0.00 H new ATOM 0 H5'' DG A 16 -3.452 -1.061 -11.844 1.00 0.00 H new ATOM 0 H4' DG A 16 -1.670 -2.414 -10.968 1.00 0.00 H new ATOM 0 H3' DG A 16 -4.274 -3.110 -10.765 1.00 0.00 H new ATOM 0 H2' DG A 16 -4.497 -2.356 -8.355 1.00 0.00 H new ATOM 0 H2'' DG A 16 -4.131 -4.059 -8.164 1.00 0.00 H new ATOM 0 H1' DG A 16 -1.728 -3.647 -7.999 1.00 0.00 H new ATOM 0 H8 DG A 16 -3.470 -0.354 -6.973 1.00 0.00 H new ATOM 0 H1 DG A 16 -1.181 -4.009 -2.175 1.00 0.00 H new ATOM 0 H21 DG A 16 -0.261 -6.148 -4.754 1.00 0.00 H new ATOM 0 H22 DG A 16 -0.392 -5.885 -3.012 1.00 0.00 H new ATOM 514 P DA A 17 -2.277 -4.981 -11.678 1.00 0.00 P ATOM 515 OP1 DA A 17 -2.986 -4.258 -12.751 1.00 0.00 O ATOM 516 OP2 DA A 17 -2.210 -6.459 -11.725 1.00 0.00 O ATOM 517 O5' DA A 17 -0.777 -4.439 -11.652 1.00 0.00 O ATOM 518 C5' DA A 17 0.154 -4.775 -10.628 1.00 0.00 C ATOM 519 C4' DA A 17 1.555 -4.202 -10.923 1.00 0.00 C ATOM 520 O4' DA A 17 2.080 -4.825 -12.094 1.00 0.00 O ATOM 521 C3' DA A 17 1.534 -2.690 -11.191 1.00 0.00 C ATOM 522 O3' DA A 17 2.712 -2.033 -10.732 1.00 0.00 O ATOM 523 C2' DA A 17 1.453 -2.627 -12.715 1.00 0.00 C ATOM 524 C1' DA A 17 2.177 -3.896 -13.167 1.00 0.00 C ATOM 525 N9 DA A 17 1.588 -4.469 -14.409 1.00 0.00 N ATOM 526 C8 DA A 17 0.440 -5.215 -14.545 1.00 0.00 C ATOM 527 N7 DA A 17 0.145 -5.547 -15.778 1.00 0.00 N ATOM 528 C5 DA A 17 1.198 -4.976 -16.515 1.00 0.00 C ATOM 529 C6 DA A 17 1.559 -4.939 -17.886 1.00 0.00 C ATOM 530 N6 DA A 17 0.903 -5.503 -18.880 1.00 0.00 N ATOM 531 N1 DA A 17 2.665 -4.320 -18.289 1.00 0.00 N ATOM 532 C2 DA A 17 3.409 -3.709 -17.380 1.00 0.00 C ATOM 533 N3 DA A 17 3.219 -3.673 -16.063 1.00 0.00 N ATOM 534 C4 DA A 17 2.081 -4.326 -15.690 1.00 0.00 C ATOM 0 H5' DA A 17 0.216 -5.859 -10.534 1.00 0.00 H new ATOM 0 H5'' DA A 17 -0.202 -4.392 -9.672 1.00 0.00 H new ATOM 0 H4' DA A 17 2.164 -4.396 -10.040 1.00 0.00 H new ATOM 0 H3' DA A 17 0.717 -2.190 -10.671 1.00 0.00 H new ATOM 0 H2' DA A 17 0.420 -2.610 -13.061 1.00 0.00 H new ATOM 0 H2'' DA A 17 1.934 -1.730 -13.105 1.00 0.00 H new ATOM 0 H1' DA A 17 3.215 -3.666 -13.406 1.00 0.00 H new ATOM 0 H8 DA A 17 -0.170 -5.504 -13.702 1.00 0.00 H new ATOM 0 H61 DA A 17 1.250 -5.415 -19.835 1.00 0.00 H new ATOM 0 H62 DA A 17 0.048 -6.027 -18.694 1.00 0.00 H new ATOM 0 H2 DA A 17 4.272 -3.177 -17.751 1.00 0.00 H new ATOM 546 P DG A 18 2.927 -1.634 -9.188 1.00 0.00 P ATOM 547 OP1 DG A 18 1.662 -1.844 -8.449 1.00 0.00 O ATOM 548 OP2 DG A 18 3.508 -0.274 -9.187 1.00 0.00 O ATOM 549 O5' DG A 18 3.988 -2.651 -8.582 1.00 0.00 O ATOM 550 C5' DG A 18 5.257 -2.856 -9.190 1.00 0.00 C ATOM 551 C4' DG A 18 6.402 -3.043 -8.182 1.00 0.00 C ATOM 552 O4' DG A 18 6.517 -1.879 -7.369 1.00 0.00 O ATOM 553 C3' DG A 18 6.200 -4.234 -7.237 1.00 0.00 C ATOM 554 O3' DG A 18 7.457 -4.821 -6.916 1.00 0.00 O ATOM 555 C2' DG A 18 5.609 -3.578 -6.000 1.00 0.00 C ATOM 556 C1' DG A 18 6.312 -2.223 -6.006 1.00 0.00 C ATOM 557 N9 DG A 18 5.499 -1.200 -5.314 1.00 0.00 N ATOM 558 C8 DG A 18 4.746 -0.198 -5.874 1.00 0.00 C ATOM 559 N7 DG A 18 4.119 0.568 -5.014 1.00 0.00 N ATOM 560 C5 DG A 18 4.463 -0.003 -3.779 1.00 0.00 C ATOM 561 C6 DG A 18 4.078 0.336 -2.436 1.00 0.00 C ATOM 562 O6 DG A 18 3.298 1.211 -2.060 1.00 0.00 O ATOM 563 N1 DG A 18 4.666 -0.451 -1.463 1.00 0.00 N ATOM 564 C2 DG A 18 5.499 -1.491 -1.744 1.00 0.00 C ATOM 565 N2 DG A 18 5.976 -2.190 -0.750 1.00 0.00 N ATOM 566 N3 DG A 18 5.866 -1.852 -2.970 1.00 0.00 N ATOM 567 C4 DG A 18 5.317 -1.072 -3.953 1.00 0.00 C ATOM 0 H5' DG A 18 5.485 -2.004 -9.831 1.00 0.00 H new ATOM 0 H5'' DG A 18 5.204 -3.734 -9.833 1.00 0.00 H new ATOM 0 H4' DG A 18 7.296 -3.225 -8.778 1.00 0.00 H new ATOM 0 H3' DG A 18 5.579 -5.025 -7.657 1.00 0.00 H new ATOM 0 H2' DG A 18 4.526 -3.478 -6.067 1.00 0.00 H new ATOM 0 H2'' DG A 18 5.821 -4.146 -5.094 1.00 0.00 H new ATOM 0 H1' DG A 18 7.261 -2.274 -5.472 1.00 0.00 H new ATOM 0 H8 DG A 18 4.675 -0.052 -6.942 1.00 0.00 H new ATOM 0 H1 DG A 18 4.466 -0.242 -0.485 1.00 0.00 H new ATOM 0 H21 DG A 18 6.602 -2.974 -0.932 1.00 0.00 H new ATOM 0 H22 DG A 18 5.723 -1.952 0.209 1.00 0.00 H new ATOM 579 P DG A 19 7.704 -6.392 -7.012 1.00 0.00 P ATOM 580 OP1 DG A 19 9.135 -6.652 -6.768 1.00 0.00 O ATOM 581 OP2 DG A 19 7.099 -6.891 -8.269 1.00 0.00 O ATOM 582 O5' DG A 19 6.926 -7.036 -5.780 1.00 0.00 O ATOM 583 C5' DG A 19 5.586 -7.487 -5.917 1.00 0.00 C ATOM 584 C4' DG A 19 4.991 -7.871 -4.561 1.00 0.00 C ATOM 585 O4' DG A 19 4.854 -6.701 -3.758 1.00 0.00 O ATOM 586 C3' DG A 19 3.598 -8.487 -4.746 1.00 0.00 C ATOM 587 O3' DG A 19 3.440 -9.612 -3.896 1.00 0.00 O ATOM 588 C2' DG A 19 2.669 -7.356 -4.342 1.00 0.00 C ATOM 589 C1' DG A 19 3.517 -6.619 -3.306 1.00 0.00 C ATOM 590 N9 DG A 19 3.100 -5.211 -3.138 1.00 0.00 N ATOM 591 C8 DG A 19 2.613 -4.340 -4.084 1.00 0.00 C ATOM 592 N7 DG A 19 2.155 -3.219 -3.600 1.00 0.00 N ATOM 593 C5 DG A 19 2.383 -3.343 -2.229 1.00 0.00 C ATOM 594 C6 DG A 19 2.063 -2.458 -1.148 1.00 0.00 C ATOM 595 O6 DG A 19 1.488 -1.369 -1.208 1.00 0.00 O ATOM 596 N1 DG A 19 2.446 -2.929 0.094 1.00 0.00 N ATOM 597 C2 DG A 19 3.080 -4.124 0.267 1.00 0.00 C ATOM 598 N2 DG A 19 3.424 -4.452 1.478 1.00 0.00 N ATOM 599 N3 DG A 19 3.365 -4.992 -0.701 1.00 0.00 N ATOM 600 C4 DG A 19 2.993 -4.543 -1.938 1.00 0.00 C ATOM 0 H5' DG A 19 5.555 -8.346 -6.587 1.00 0.00 H new ATOM 0 H5'' DG A 19 4.981 -6.704 -6.374 1.00 0.00 H new ATOM 0 H4' DG A 19 5.653 -8.593 -4.083 1.00 0.00 H new ATOM 0 H3' DG A 19 3.409 -8.849 -5.756 1.00 0.00 H new ATOM 0 H2' DG A 19 2.408 -6.718 -5.187 1.00 0.00 H new ATOM 0 H2'' DG A 19 1.734 -7.724 -3.920 1.00 0.00 H new ATOM 0 H1' DG A 19 3.396 -7.077 -2.324 1.00 0.00 H new ATOM 0 H8 DG A 19 2.610 -4.566 -5.140 1.00 0.00 H new ATOM 0 H1 DG A 19 2.246 -2.359 0.916 1.00 0.00 H new ATOM 0 H21 DG A 19 3.900 -5.337 1.651 1.00 0.00 H new ATOM 0 H22 DG A 19 3.217 -3.824 2.255 1.00 0.00 H new ATOM 612 P DG A 20 2.275 -10.685 -4.104 1.00 0.00 P ATOM 613 OP1 DG A 20 2.938 -11.970 -4.411 1.00 0.00 O ATOM 614 OP2 DG A 20 1.286 -10.165 -5.079 1.00 0.00 O ATOM 615 O5' DG A 20 1.588 -10.784 -2.657 1.00 0.00 O ATOM 616 C5' DG A 20 2.071 -11.714 -1.686 1.00 0.00 C ATOM 617 C4' DG A 20 1.785 -11.325 -0.230 1.00 0.00 C ATOM 618 O4' DG A 20 2.363 -10.051 0.048 1.00 0.00 O ATOM 619 C3' DG A 20 0.304 -11.285 0.159 1.00 0.00 C ATOM 620 O3' DG A 20 -0.146 -12.526 0.710 1.00 0.00 O ATOM 621 C2' DG A 20 0.345 -10.222 1.250 1.00 0.00 C ATOM 622 C1' DG A 20 1.527 -9.319 0.930 1.00 0.00 C ATOM 623 N9 DG A 20 1.056 -8.070 0.285 1.00 0.00 N ATOM 624 C8 DG A 20 0.806 -7.833 -1.046 1.00 0.00 C ATOM 625 N7 DG A 20 0.284 -6.660 -1.304 1.00 0.00 N ATOM 626 C5 DG A 20 0.155 -6.079 -0.032 1.00 0.00 C ATOM 627 C6 DG A 20 -0.385 -4.812 0.390 1.00 0.00 C ATOM 628 O6 DG A 20 -0.807 -3.885 -0.298 1.00 0.00 O ATOM 629 N1 DG A 20 -0.429 -4.642 1.759 1.00 0.00 N ATOM 630 C2 DG A 20 0.087 -5.545 2.635 1.00 0.00 C ATOM 631 N2 DG A 20 0.043 -5.254 3.906 1.00 0.00 N ATOM 632 N3 DG A 20 0.648 -6.706 2.294 1.00 0.00 N ATOM 633 C4 DG A 20 0.631 -6.932 0.942 1.00 0.00 C ATOM 0 H5' DG A 20 3.148 -11.826 -1.813 1.00 0.00 H new ATOM 0 H5'' DG A 20 1.624 -12.689 -1.882 1.00 0.00 H new ATOM 0 H4' DG A 20 2.233 -12.119 0.367 1.00 0.00 H new ATOM 0 H3' DG A 20 -0.367 -11.091 -0.678 1.00 0.00 H new ATOM 0 H2' DG A 20 -0.584 -9.652 1.271 1.00 0.00 H new ATOM 0 H2'' DG A 20 0.461 -10.679 2.233 1.00 0.00 H new ATOM 0 H1' DG A 20 2.066 -9.034 1.833 1.00 0.00 H new ATOM 0 H8 DG A 20 1.023 -8.557 -1.818 1.00 0.00 H new ATOM 0 H1 DG A 20 -0.869 -3.800 2.131 1.00 0.00 H new ATOM 0 H21 DG A 20 0.421 -5.907 4.592 1.00 0.00 H new ATOM 0 H22 DG A 20 -0.369 -4.373 4.213 1.00 0.00 H new ATOM 645 P DT A 21 -1.707 -12.860 0.895 1.00 0.00 P ATOM 646 OP1 DT A 21 -1.827 -14.153 1.607 1.00 0.00 O ATOM 647 OP2 DT A 21 -2.365 -12.716 -0.421 1.00 0.00 O ATOM 648 O5' DT A 21 -2.295 -11.725 1.840 1.00 0.00 O ATOM 649 C5' DT A 21 -2.030 -11.682 3.236 1.00 0.00 C ATOM 650 C4' DT A 21 -2.713 -10.462 3.869 1.00 0.00 C ATOM 651 O4' DT A 21 -2.297 -9.256 3.229 1.00 0.00 O ATOM 652 C3' DT A 21 -4.238 -10.582 3.728 1.00 0.00 C ATOM 653 O3' DT A 21 -4.909 -10.492 4.976 1.00 0.00 O ATOM 654 C2' DT A 21 -4.626 -9.437 2.814 1.00 0.00 C ATOM 655 C1' DT A 21 -3.431 -8.483 2.863 1.00 0.00 C ATOM 656 N1 DT A 21 -3.244 -7.832 1.535 1.00 0.00 N ATOM 657 C2 DT A 21 -3.649 -6.499 1.387 1.00 0.00 C ATOM 658 O2 DT A 21 -4.130 -5.831 2.304 1.00 0.00 O ATOM 659 N3 DT A 21 -3.566 -5.956 0.125 1.00 0.00 N ATOM 660 C4 DT A 21 -3.226 -6.640 -1.022 1.00 0.00 C ATOM 661 O4 DT A 21 -3.263 -6.048 -2.100 1.00 0.00 O ATOM 662 C5 DT A 21 -2.860 -8.041 -0.812 1.00 0.00 C ATOM 663 C7 DT A 21 -2.483 -8.914 -1.996 1.00 0.00 C ATOM 664 C6 DT A 21 -2.873 -8.583 0.437 1.00 0.00 C ATOM 0 H5' DT A 21 -0.955 -11.636 3.408 1.00 0.00 H new ATOM 0 H5'' DT A 21 -2.389 -12.595 3.710 1.00 0.00 H new ATOM 0 H4' DT A 21 -2.430 -10.431 4.921 1.00 0.00 H new ATOM 0 H3' DT A 21 -4.525 -11.555 3.329 1.00 0.00 H new ATOM 0 H2' DT A 21 -4.813 -9.786 1.799 1.00 0.00 H new ATOM 0 H2'' DT A 21 -5.538 -8.948 3.156 1.00 0.00 H new ATOM 0 HO3' DT A 21 -5.875 -10.572 4.834 1.00 0.00 H new ATOM 0 H1' DT A 21 -3.587 -7.685 3.589 1.00 0.00 H new ATOM 0 H3 DT A 21 -3.774 -4.962 0.031 1.00 0.00 H new ATOM 0 H71 DT A 21 -1.771 -9.675 -1.675 1.00 0.00 H new ATOM 0 H72 DT A 21 -3.377 -9.397 -2.391 1.00 0.00 H new ATOM 0 H73 DT A 21 -2.030 -8.298 -2.773 1.00 0.00 H new ATOM 0 H6 DT A 21 -2.589 -9.616 0.571 1.00 0.00 H new TER 678 DT A 21 HETATM 679 K K A 22 1.672 1.357 0.031 1.00 0.00 K HETATM 680 K K A 23 -1.055 -1.183 -0.019 1.00 0.00 K