USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 249 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 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot -78:sc= 1.33 USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 16 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 20 DT C7 :methyl 150:sc= -0.36 (180deg=-0.36) USER MOD Single : A 22 DA O3' : rot -89:sc= 1.26 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -1.504 -9.242 2.428 1.00 0.00 O ATOM 2 C5' DT A 1 -2.124 -8.242 3.228 1.00 0.00 C ATOM 3 C4' DT A 1 -3.317 -8.669 4.125 1.00 0.00 C ATOM 4 O4' DT A 1 -4.504 -8.784 3.322 1.00 0.00 O ATOM 5 C3' DT A 1 -3.238 -9.979 4.968 1.00 0.00 C ATOM 6 O3' DT A 1 -3.936 -9.751 6.169 1.00 0.00 O ATOM 7 C2' DT A 1 -4.003 -10.970 4.080 1.00 0.00 C ATOM 8 C1' DT A 1 -5.075 -10.068 3.446 1.00 0.00 C ATOM 9 N1 DT A 1 -5.537 -10.492 2.114 1.00 0.00 N ATOM 10 C2 DT A 1 -6.598 -11.354 1.976 1.00 0.00 C ATOM 11 O2 DT A 1 -7.197 -11.836 2.940 1.00 0.00 O ATOM 12 N3 DT A 1 -6.971 -11.611 0.675 1.00 0.00 N ATOM 13 C4 DT A 1 -6.318 -11.211 -0.486 1.00 0.00 C ATOM 14 O4 DT A 1 -6.755 -11.546 -1.581 1.00 0.00 O ATOM 15 C5 DT A 1 -5.095 -10.422 -0.272 1.00 0.00 C ATOM 16 C7 DT A 1 -4.248 -10.021 -1.458 1.00 0.00 C ATOM 17 C6 DT A 1 -4.784 -10.109 0.991 1.00 0.00 C ATOM 0 H5' DT A 1 -2.471 -7.450 2.565 1.00 0.00 H new ATOM 0 H5'' DT A 1 -1.360 -7.807 3.872 1.00 0.00 H new ATOM 0 H4' DT A 1 -3.309 -7.868 4.865 1.00 0.00 H new ATOM 0 H3' DT A 1 -2.235 -10.321 5.223 1.00 0.00 H new ATOM 0 H2' DT A 1 -3.358 -11.427 3.329 1.00 0.00 H new ATOM 0 H2'' DT A 1 -4.443 -11.782 4.659 1.00 0.00 H new ATOM 0 HO5' DT A 1 -0.914 -9.789 2.987 1.00 0.00 H new ATOM 0 H1' DT A 1 -5.952 -10.108 4.092 1.00 0.00 H new ATOM 0 H3 DT A 1 -7.823 -12.157 0.549 1.00 0.00 H new ATOM 0 H71 DT A 1 -3.748 -9.076 -1.245 1.00 0.00 H new ATOM 0 H72 DT A 1 -3.501 -10.792 -1.649 1.00 0.00 H new ATOM 0 H73 DT A 1 -4.883 -9.906 -2.336 1.00 0.00 H new ATOM 0 H6 DT A 1 -3.893 -9.522 1.159 1.00 0.00 H new ATOM 31 P DG A 2 -3.584 -10.222 7.617 1.00 0.00 P ATOM 32 OP1 DG A 2 -4.114 -11.599 7.832 1.00 0.00 O ATOM 33 OP2 DG A 2 -4.095 -9.141 8.514 1.00 0.00 O ATOM 34 O5' DG A 2 -2.019 -10.311 7.682 1.00 0.00 O ATOM 35 C5' DG A 2 -1.162 -9.238 8.051 1.00 0.00 C ATOM 36 C4' DG A 2 -0.546 -8.495 6.838 1.00 0.00 C ATOM 37 O4' DG A 2 -0.890 -7.102 6.869 1.00 0.00 O ATOM 38 C3' DG A 2 0.998 -8.522 6.661 1.00 0.00 C ATOM 39 O3' DG A 2 1.557 -9.769 6.271 1.00 0.00 O ATOM 40 C2' DG A 2 1.218 -7.258 5.836 1.00 0.00 C ATOM 41 C1' DG A 2 0.223 -6.314 6.546 1.00 0.00 C ATOM 42 N9 DG A 2 0.771 -5.718 7.788 1.00 0.00 N ATOM 43 C8 DG A 2 1.990 -5.055 7.842 1.00 0.00 C ATOM 44 N7 DG A 2 2.117 -4.238 8.841 1.00 0.00 N ATOM 45 C5 DG A 2 0.900 -4.338 9.496 1.00 0.00 C ATOM 46 C6 DG A 2 0.444 -3.674 10.698 1.00 0.00 C ATOM 47 O6 DG A 2 1.025 -2.825 11.360 1.00 0.00 O ATOM 48 N1 DG A 2 -0.839 -4.130 11.042 1.00 0.00 N ATOM 49 C2 DG A 2 -1.546 -5.106 10.390 1.00 0.00 C ATOM 50 N2 DG A 2 -2.677 -5.458 11.043 1.00 0.00 N ATOM 51 N3 DG A 2 -1.158 -5.701 9.293 1.00 0.00 N ATOM 52 C4 DG A 2 0.065 -5.238 8.855 1.00 0.00 C ATOM 0 H5' DG A 2 -0.358 -9.624 8.677 1.00 0.00 H new ATOM 0 H5'' DG A 2 -1.724 -8.526 8.656 1.00 0.00 H new ATOM 0 H4' DG A 2 -0.973 -9.063 6.011 1.00 0.00 H new ATOM 0 H3' DG A 2 1.591 -8.481 7.574 1.00 0.00 H new ATOM 0 H2' DG A 2 2.246 -6.898 5.887 1.00 0.00 H new ATOM 0 H2'' DG A 2 0.981 -7.400 4.781 1.00 0.00 H new ATOM 0 H1' DG A 2 -0.015 -5.479 5.887 1.00 0.00 H new ATOM 0 H8 DG A 2 2.770 -5.208 7.111 1.00 0.00 H new ATOM 0 H1 DG A 2 -1.285 -3.695 11.850 1.00 0.00 H new ATOM 0 H21 DG A 2 -3.288 -6.177 10.654 1.00 0.00 H new ATOM 0 H22 DG A 2 -2.919 -5.005 11.924 1.00 0.00 H new ATOM 64 P DA A 3 1.574 -10.366 4.829 1.00 0.00 P ATOM 65 OP1 DA A 3 0.229 -10.307 4.180 1.00 0.00 O ATOM 66 OP2 DA A 3 2.226 -11.703 4.917 1.00 0.00 O ATOM 67 O5' DA A 3 2.593 -9.395 4.100 1.00 0.00 O ATOM 68 C5' DA A 3 2.352 -9.100 2.731 1.00 0.00 C ATOM 69 C4' DA A 3 3.448 -8.227 2.082 1.00 0.00 C ATOM 70 O4' DA A 3 2.991 -7.896 0.776 1.00 0.00 O ATOM 71 C3' DA A 3 3.764 -6.857 2.743 1.00 0.00 C ATOM 72 O3' DA A 3 4.557 -6.831 3.933 1.00 0.00 O ATOM 73 C2' DA A 3 4.203 -5.995 1.551 1.00 0.00 C ATOM 74 C1' DA A 3 3.545 -6.679 0.324 1.00 0.00 C ATOM 75 N9 DA A 3 2.513 -5.956 -0.402 1.00 0.00 N ATOM 76 C8 DA A 3 2.367 -5.847 -1.775 1.00 0.00 C ATOM 77 N7 DA A 3 1.187 -5.487 -2.175 1.00 0.00 N ATOM 78 C5 DA A 3 0.452 -5.350 -0.989 1.00 0.00 C ATOM 79 C6 DA A 3 -0.897 -5.055 -0.659 1.00 0.00 C ATOM 80 N6 DA A 3 -1.900 -4.860 -1.537 1.00 0.00 N ATOM 81 N1 DA A 3 -1.231 -4.988 0.650 1.00 0.00 N ATOM 82 C2 DA A 3 -0.298 -5.234 1.582 1.00 0.00 C ATOM 83 N3 DA A 3 0.978 -5.573 1.396 1.00 0.00 N ATOM 84 C4 DA A 3 1.282 -5.631 0.103 1.00 0.00 C ATOM 0 H5' DA A 3 1.393 -8.590 2.642 1.00 0.00 H new ATOM 0 H5'' DA A 3 2.268 -10.035 2.176 1.00 0.00 H new ATOM 0 H4' DA A 3 4.354 -8.828 2.161 1.00 0.00 H new ATOM 0 H3' DA A 3 2.892 -6.443 3.249 1.00 0.00 H new ATOM 0 H2' DA A 3 3.867 -4.964 1.660 1.00 0.00 H new ATOM 0 H2'' DA A 3 5.289 -5.968 1.457 1.00 0.00 H new ATOM 0 H1' DA A 3 4.351 -6.769 -0.404 1.00 0.00 H new ATOM 0 H8 DA A 3 3.176 -6.047 -2.462 1.00 0.00 H new ATOM 0 H61 DA A 3 -2.840 -4.652 -1.200 1.00 0.00 H new ATOM 0 H62 DA A 3 -1.719 -4.920 -2.539 1.00 0.00 H new ATOM 0 H2 DA A 3 -0.620 -5.147 2.609 1.00 0.00 H new ATOM 96 P DG A 4 5.974 -7.503 4.069 1.00 0.00 P ATOM 97 OP1 DG A 4 6.919 -6.930 3.060 1.00 0.00 O ATOM 98 OP2 DG A 4 5.834 -8.993 4.087 1.00 0.00 O ATOM 99 O5' DG A 4 6.423 -7.131 5.516 1.00 0.00 O ATOM 100 C5' DG A 4 6.376 -5.884 6.178 1.00 0.00 C ATOM 101 C4' DG A 4 7.399 -4.824 5.697 1.00 0.00 C ATOM 102 O4' DG A 4 6.817 -3.936 4.741 1.00 0.00 O ATOM 103 C3' DG A 4 7.961 -3.876 6.785 1.00 0.00 C ATOM 104 O3' DG A 4 9.280 -3.488 6.432 1.00 0.00 O ATOM 105 C2' DG A 4 6.833 -2.815 6.818 1.00 0.00 C ATOM 106 C1' DG A 4 6.306 -2.771 5.366 1.00 0.00 C ATOM 107 N9 DG A 4 4.851 -2.728 5.246 1.00 0.00 N ATOM 108 C8 DG A 4 3.800 -2.824 6.139 1.00 0.00 C ATOM 109 N7 DG A 4 2.622 -2.805 5.575 1.00 0.00 N ATOM 110 C5 DG A 4 2.906 -2.693 4.223 1.00 0.00 C ATOM 111 C6 DG A 4 2.041 -2.592 3.077 1.00 0.00 C ATOM 112 O6 DG A 4 0.821 -2.547 3.058 1.00 0.00 O ATOM 113 N1 DG A 4 2.800 -2.479 1.892 1.00 0.00 N ATOM 114 C2 DG A 4 4.169 -2.449 1.819 1.00 0.00 C ATOM 115 N2 DG A 4 4.642 -2.343 0.562 1.00 0.00 N ATOM 116 N3 DG A 4 4.969 -2.511 2.855 1.00 0.00 N ATOM 117 C4 DG A 4 4.272 -2.644 4.020 1.00 0.00 C ATOM 0 H5' DG A 4 6.532 -6.054 7.243 1.00 0.00 H new ATOM 0 H5'' DG A 4 5.374 -5.471 6.064 1.00 0.00 H new ATOM 0 H4' DG A 4 8.201 -5.450 5.306 1.00 0.00 H new ATOM 0 H3' DG A 4 8.137 -4.251 7.793 1.00 0.00 H new ATOM 0 H2' DG A 4 6.046 -3.093 7.518 1.00 0.00 H new ATOM 0 H2'' DG A 4 7.211 -1.843 7.133 1.00 0.00 H new ATOM 0 H1' DG A 4 6.638 -1.845 4.896 1.00 0.00 H new ATOM 0 H8 DG A 4 3.940 -2.907 7.207 1.00 0.00 H new ATOM 0 H1 DG A 4 2.285 -2.414 1.014 1.00 0.00 H new ATOM 0 H21 DG A 4 5.648 -2.312 0.397 1.00 0.00 H new ATOM 0 H22 DG A 4 3.994 -2.294 -0.224 1.00 0.00 H new ATOM 129 P DG A 5 9.946 -2.070 6.483 1.00 0.00 P ATOM 130 OP1 DG A 5 11.426 -2.278 6.400 1.00 0.00 O ATOM 131 OP2 DG A 5 9.427 -1.261 7.622 1.00 0.00 O ATOM 132 O5' DG A 5 9.454 -1.383 5.145 1.00 0.00 O ATOM 133 C5' DG A 5 9.858 -1.964 3.909 1.00 0.00 C ATOM 134 C4' DG A 5 9.625 -1.050 2.698 1.00 0.00 C ATOM 135 O4' DG A 5 8.232 -0.814 2.496 1.00 0.00 O ATOM 136 C3' DG A 5 10.358 0.334 2.703 1.00 0.00 C ATOM 137 O3' DG A 5 11.304 0.323 1.645 1.00 0.00 O ATOM 138 C2' DG A 5 9.168 1.321 2.565 1.00 0.00 C ATOM 139 C1' DG A 5 8.050 0.471 1.939 1.00 0.00 C ATOM 140 N9 DG A 5 6.697 0.875 2.232 1.00 0.00 N ATOM 141 C8 DG A 5 6.173 0.979 3.513 1.00 0.00 C ATOM 142 N7 DG A 5 4.877 1.035 3.549 1.00 0.00 N ATOM 143 C5 DG A 5 4.500 0.926 2.223 1.00 0.00 C ATOM 144 C6 DG A 5 3.191 0.846 1.626 1.00 0.00 C ATOM 145 O6 DG A 5 2.102 0.810 2.190 1.00 0.00 O ATOM 146 N1 DG A 5 3.288 0.818 0.217 1.00 0.00 N ATOM 147 C2 DG A 5 4.464 0.778 -0.494 1.00 0.00 C ATOM 148 N2 DG A 5 4.325 0.754 -1.836 1.00 0.00 N ATOM 149 N3 DG A 5 5.663 0.763 0.046 1.00 0.00 N ATOM 150 C4 DG A 5 5.615 0.819 1.409 1.00 0.00 C ATOM 0 H5' DG A 5 9.314 -2.897 3.760 1.00 0.00 H new ATOM 0 H5'' DG A 5 10.917 -2.218 3.965 1.00 0.00 H new ATOM 0 H4' DG A 5 10.072 -1.619 1.882 1.00 0.00 H new ATOM 0 H3' DG A 5 10.951 0.601 3.578 1.00 0.00 H new ATOM 0 H2' DG A 5 8.869 1.723 3.533 1.00 0.00 H new ATOM 0 H2'' DG A 5 9.425 2.170 1.932 1.00 0.00 H new ATOM 0 H1' DG A 5 8.139 0.554 0.856 1.00 0.00 H new ATOM 0 H8 DG A 5 6.788 1.010 4.400 1.00 0.00 H new ATOM 0 H1 DG A 5 2.417 0.828 -0.314 1.00 0.00 H new ATOM 0 H21 DG A 5 5.151 0.724 -2.434 1.00 0.00 H new ATOM 0 H22 DG A 5 3.394 0.766 -2.253 1.00 0.00 H new ATOM 162 P DG A 6 12.276 1.524 1.340 1.00 0.00 P ATOM 163 OP1 DG A 6 13.388 0.964 0.518 1.00 0.00 O ATOM 164 OP2 DG A 6 12.621 2.261 2.590 1.00 0.00 O ATOM 165 O5' DG A 6 11.383 2.466 0.442 1.00 0.00 O ATOM 166 C5' DG A 6 10.980 1.955 -0.825 1.00 0.00 C ATOM 167 C4' DG A 6 9.921 2.814 -1.524 1.00 0.00 C ATOM 168 O4' DG A 6 8.655 2.787 -0.849 1.00 0.00 O ATOM 169 C3' DG A 6 10.321 4.311 -1.718 1.00 0.00 C ATOM 170 O3' DG A 6 10.134 4.721 -3.067 1.00 0.00 O ATOM 171 C2' DG A 6 9.314 5.018 -0.798 1.00 0.00 C ATOM 172 C1' DG A 6 8.104 4.086 -0.906 1.00 0.00 C ATOM 173 N9 DG A 6 7.073 4.222 0.091 1.00 0.00 N ATOM 174 C8 DG A 6 7.149 4.276 1.469 1.00 0.00 C ATOM 175 N7 DG A 6 5.985 4.279 2.058 1.00 0.00 N ATOM 176 C5 DG A 6 5.076 4.205 1.011 1.00 0.00 C ATOM 177 C6 DG A 6 3.638 4.106 0.994 1.00 0.00 C ATOM 178 O6 DG A 6 2.860 4.013 1.934 1.00 0.00 O ATOM 179 N1 DG A 6 3.169 4.079 -0.342 1.00 0.00 N ATOM 180 C2 DG A 6 3.939 4.042 -1.474 1.00 0.00 C ATOM 181 N2 DG A 6 3.251 3.880 -2.627 1.00 0.00 N ATOM 182 N3 DG A 6 5.252 4.058 -1.467 1.00 0.00 N ATOM 183 C4 DG A 6 5.747 4.163 -0.199 1.00 0.00 C ATOM 0 H5' DG A 6 10.588 0.946 -0.693 1.00 0.00 H new ATOM 0 H5'' DG A 6 11.855 1.875 -1.470 1.00 0.00 H new ATOM 0 H4' DG A 6 9.841 2.349 -2.507 1.00 0.00 H new ATOM 0 H3' DG A 6 11.366 4.522 -1.492 1.00 0.00 H new ATOM 0 H2' DG A 6 9.680 5.100 0.226 1.00 0.00 H new ATOM 0 H2'' DG A 6 9.086 6.029 -1.137 1.00 0.00 H new ATOM 0 H1' DG A 6 7.572 4.334 -1.825 1.00 0.00 H new ATOM 0 H8 DG A 6 8.084 4.312 2.008 1.00 0.00 H new ATOM 0 H1 DG A 6 2.158 4.088 -0.474 1.00 0.00 H new ATOM 0 H21 DG A 6 3.748 3.842 -3.517 1.00 0.00 H new ATOM 0 H22 DG A 6 2.235 3.796 -2.607 1.00 0.00 H new ATOM 195 P DT A 7 11.288 4.526 -4.110 1.00 0.00 P ATOM 196 OP1 DT A 7 12.616 4.377 -3.435 1.00 0.00 O ATOM 197 OP2 DT A 7 11.132 5.605 -5.121 1.00 0.00 O ATOM 198 O5' DT A 7 10.846 3.150 -4.778 1.00 0.00 O ATOM 199 C5' DT A 7 11.840 2.158 -5.016 1.00 0.00 C ATOM 200 C4' DT A 7 11.416 1.056 -6.026 1.00 0.00 C ATOM 201 O4' DT A 7 12.553 0.204 -6.257 1.00 0.00 O ATOM 202 C3' DT A 7 10.252 0.101 -5.640 1.00 0.00 C ATOM 203 O3' DT A 7 9.672 -0.450 -6.816 1.00 0.00 O ATOM 204 C2' DT A 7 11.031 -1.014 -4.920 1.00 0.00 C ATOM 205 C1' DT A 7 12.278 -1.109 -5.820 1.00 0.00 C ATOM 206 N1 DT A 7 13.505 -1.679 -5.226 1.00 0.00 N ATOM 207 C2 DT A 7 13.659 -3.047 -5.178 1.00 0.00 C ATOM 208 O2 DT A 7 12.761 -3.828 -5.494 1.00 0.00 O ATOM 209 N3 DT A 7 14.912 -3.475 -4.801 1.00 0.00 N ATOM 210 C4 DT A 7 15.999 -2.684 -4.448 1.00 0.00 C ATOM 211 O4 DT A 7 17.101 -3.192 -4.266 1.00 0.00 O ATOM 212 C5 DT A 7 15.717 -1.244 -4.331 1.00 0.00 C ATOM 213 C7 DT A 7 16.799 -0.322 -3.812 1.00 0.00 C ATOM 214 C6 DT A 7 14.505 -0.827 -4.722 1.00 0.00 C ATOM 0 H5' DT A 7 12.099 1.686 -4.068 1.00 0.00 H new ATOM 0 H5'' DT A 7 12.742 2.646 -5.386 1.00 0.00 H new ATOM 0 H4' DT A 7 11.053 1.630 -6.879 1.00 0.00 H new ATOM 0 H3' DT A 7 9.452 0.570 -5.067 1.00 0.00 H new ATOM 0 H2' DT A 7 11.280 -0.749 -3.892 1.00 0.00 H new ATOM 0 H2'' DT A 7 10.475 -1.951 -4.882 1.00 0.00 H new ATOM 0 H1' DT A 7 12.026 -1.817 -6.610 1.00 0.00 H new ATOM 0 H3 DT A 7 15.059 -4.484 -4.778 1.00 0.00 H new ATOM 0 H71 DT A 7 16.679 0.666 -4.256 1.00 0.00 H new ATOM 0 H72 DT A 7 16.722 -0.244 -2.728 1.00 0.00 H new ATOM 0 H73 DT A 7 17.777 -0.723 -4.078 1.00 0.00 H new ATOM 0 H6 DT A 7 14.282 0.227 -4.646 1.00 0.00 H new ATOM 227 P DG A 8 8.207 -0.143 -7.286 1.00 0.00 P ATOM 228 OP1 DG A 8 8.135 -0.541 -8.727 1.00 0.00 O ATOM 229 OP2 DG A 8 7.832 1.253 -6.918 1.00 0.00 O ATOM 230 O5' DG A 8 7.340 -1.113 -6.399 1.00 0.00 O ATOM 231 C5' DG A 8 7.048 -2.453 -6.775 1.00 0.00 C ATOM 232 C4' DG A 8 5.576 -2.723 -7.257 1.00 0.00 C ATOM 233 O4' DG A 8 4.784 -3.199 -6.153 1.00 0.00 O ATOM 234 C3' DG A 8 4.797 -1.526 -7.882 1.00 0.00 C ATOM 235 O3' DG A 8 3.973 -1.989 -8.941 1.00 0.00 O ATOM 236 C2' DG A 8 3.974 -1.059 -6.668 1.00 0.00 C ATOM 237 C1' DG A 8 3.637 -2.398 -5.982 1.00 0.00 C ATOM 238 N9 DG A 8 3.349 -2.391 -4.552 1.00 0.00 N ATOM 239 C8 DG A 8 4.287 -2.380 -3.537 1.00 0.00 C ATOM 240 N7 DG A 8 3.763 -2.321 -2.346 1.00 0.00 N ATOM 241 C5 DG A 8 2.397 -2.284 -2.577 1.00 0.00 C ATOM 242 C6 DG A 8 1.287 -2.146 -1.664 1.00 0.00 C ATOM 243 O6 DG A 8 1.305 -2.030 -0.445 1.00 0.00 O ATOM 244 N1 DG A 8 0.063 -2.120 -2.377 1.00 0.00 N ATOM 245 C2 DG A 8 -0.073 -2.214 -3.738 1.00 0.00 C ATOM 246 N2 DG A 8 -1.348 -2.160 -4.189 1.00 0.00 N ATOM 247 N3 DG A 8 0.934 -2.338 -4.581 1.00 0.00 N ATOM 248 C4 DG A 8 2.137 -2.337 -3.939 1.00 0.00 C ATOM 0 H5' DG A 8 7.257 -3.103 -5.925 1.00 0.00 H new ATOM 0 H5'' DG A 8 7.731 -2.743 -7.574 1.00 0.00 H new ATOM 0 H4' DG A 8 5.711 -3.449 -8.059 1.00 0.00 H new ATOM 0 H3' DG A 8 5.409 -0.740 -8.323 1.00 0.00 H new ATOM 0 H2' DG A 8 4.546 -0.398 -6.016 1.00 0.00 H new ATOM 0 H2'' DG A 8 3.078 -0.515 -6.966 1.00 0.00 H new ATOM 0 H1' DG A 8 2.709 -2.737 -6.442 1.00 0.00 H new ATOM 0 H8 DG A 8 5.352 -2.417 -3.714 1.00 0.00 H new ATOM 0 H1 DG A 8 -0.792 -2.023 -1.830 1.00 0.00 H new ATOM 0 H21 DG A 8 -1.538 -2.223 -5.189 1.00 0.00 H new ATOM 0 H22 DG A 8 -2.119 -2.057 -3.529 1.00 0.00 H new ATOM 260 P DG A 9 3.480 -1.052 -10.107 1.00 0.00 P ATOM 261 OP1 DG A 9 3.003 -1.970 -11.180 1.00 0.00 O ATOM 262 OP2 DG A 9 4.466 0.012 -10.440 1.00 0.00 O ATOM 263 O5' DG A 9 2.269 -0.297 -9.450 1.00 0.00 O ATOM 264 C5' DG A 9 1.022 -0.931 -9.256 1.00 0.00 C ATOM 265 C4' DG A 9 0.114 -0.137 -8.299 1.00 0.00 C ATOM 266 O4' DG A 9 0.468 -0.272 -6.930 1.00 0.00 O ATOM 267 C3' DG A 9 0.105 1.392 -8.471 1.00 0.00 C ATOM 268 O3' DG A 9 -0.489 1.776 -9.703 1.00 0.00 O ATOM 269 C2' DG A 9 -0.564 1.848 -7.169 1.00 0.00 C ATOM 270 C1' DG A 9 -0.286 0.666 -6.196 1.00 0.00 C ATOM 271 N9 DG A 9 0.379 0.932 -4.936 1.00 0.00 N ATOM 272 C8 DG A 9 1.695 0.856 -4.535 1.00 0.00 C ATOM 273 N7 DG A 9 1.854 0.961 -3.243 1.00 0.00 N ATOM 274 C5 DG A 9 0.566 1.137 -2.754 1.00 0.00 C ATOM 275 C6 DG A 9 0.042 1.240 -1.416 1.00 0.00 C ATOM 276 O6 DG A 9 0.646 1.161 -0.353 1.00 0.00 O ATOM 277 N1 DG A 9 -1.366 1.427 -1.441 1.00 0.00 N ATOM 278 C2 DG A 9 -2.138 1.501 -2.577 1.00 0.00 C ATOM 279 N2 DG A 9 -3.436 1.800 -2.398 1.00 0.00 N ATOM 280 N3 DG A 9 -1.677 1.343 -3.794 1.00 0.00 N ATOM 281 C4 DG A 9 -0.335 1.139 -3.801 1.00 0.00 C ATOM 0 H5' DG A 9 1.183 -1.932 -8.856 1.00 0.00 H new ATOM 0 H5'' DG A 9 0.521 -1.048 -10.217 1.00 0.00 H new ATOM 0 H4' DG A 9 -0.846 -0.579 -8.565 1.00 0.00 H new ATOM 0 H3' DG A 9 1.074 1.879 -8.578 1.00 0.00 H new ATOM 0 H2' DG A 9 -0.137 2.781 -6.802 1.00 0.00 H new ATOM 0 H2'' DG A 9 -1.632 2.017 -7.303 1.00 0.00 H new ATOM 0 H1' DG A 9 -1.268 0.331 -5.863 1.00 0.00 H new ATOM 0 H8 DG A 9 2.516 0.722 -5.223 1.00 0.00 H new ATOM 0 H1 DG A 9 -1.843 1.513 -0.544 1.00 0.00 H new ATOM 0 H21 DG A 9 -4.059 1.869 -3.203 1.00 0.00 H new ATOM 0 H22 DG A 9 -3.798 1.958 -1.458 1.00 0.00 H new ATOM 293 P DG A 10 -0.404 3.292 -10.105 1.00 0.00 P ATOM 294 OP1 DG A 10 -0.742 3.369 -11.554 1.00 0.00 O ATOM 295 OP2 DG A 10 0.890 3.895 -9.643 1.00 0.00 O ATOM 296 O5' DG A 10 -1.640 3.841 -9.292 1.00 0.00 O ATOM 297 C5' DG A 10 -1.635 5.113 -8.666 1.00 0.00 C ATOM 298 C4' DG A 10 -2.739 5.216 -7.597 1.00 0.00 C ATOM 299 O4' DG A 10 -2.334 4.526 -6.401 1.00 0.00 O ATOM 300 C3' DG A 10 -3.093 6.670 -7.180 1.00 0.00 C ATOM 301 O3' DG A 10 -4.459 6.771 -6.809 1.00 0.00 O ATOM 302 C2' DG A 10 -2.235 6.821 -5.919 1.00 0.00 C ATOM 303 C1' DG A 10 -2.405 5.414 -5.312 1.00 0.00 C ATOM 304 N9 DG A 10 -1.426 5.032 -4.321 1.00 0.00 N ATOM 305 C8 DG A 10 -0.075 4.777 -4.453 1.00 0.00 C ATOM 306 N7 DG A 10 0.518 4.533 -3.319 1.00 0.00 N ATOM 307 C5 DG A 10 -0.503 4.631 -2.379 1.00 0.00 C ATOM 308 C6 DG A 10 -0.498 4.500 -0.946 1.00 0.00 C ATOM 309 O6 DG A 10 0.449 4.236 -0.221 1.00 0.00 O ATOM 310 N1 DG A 10 -1.802 4.662 -0.418 1.00 0.00 N ATOM 311 C2 DG A 10 -2.922 4.963 -1.148 1.00 0.00 C ATOM 312 N2 DG A 10 -4.063 5.046 -0.438 1.00 0.00 N ATOM 313 N3 DG A 10 -2.937 5.109 -2.454 1.00 0.00 N ATOM 314 C4 DG A 10 -1.698 4.936 -2.998 1.00 0.00 C ATOM 0 H5' DG A 10 -1.779 5.890 -9.416 1.00 0.00 H new ATOM 0 H5'' DG A 10 -0.663 5.290 -8.206 1.00 0.00 H new ATOM 0 H4' DG A 10 -3.619 4.771 -8.060 1.00 0.00 H new ATOM 0 H3' DG A 10 -2.925 7.407 -7.965 1.00 0.00 H new ATOM 0 H2' DG A 10 -1.195 7.054 -6.148 1.00 0.00 H new ATOM 0 H2'' DG A 10 -2.600 7.607 -5.258 1.00 0.00 H new ATOM 0 H1' DG A 10 -3.350 5.395 -4.769 1.00 0.00 H new ATOM 0 H8 DG A 10 0.439 4.780 -5.403 1.00 0.00 H new ATOM 0 H1 DG A 10 -1.917 4.545 0.589 1.00 0.00 H new ATOM 0 H21 DG A 10 -4.941 5.266 -0.908 1.00 0.00 H new ATOM 0 H22 DG A 10 -4.049 4.889 0.570 1.00 0.00 H new ATOM 326 P DT A 11 -5.329 8.026 -7.166 1.00 0.00 P ATOM 327 OP1 DT A 11 -4.471 9.229 -7.340 1.00 0.00 O ATOM 328 OP2 DT A 11 -6.437 8.094 -6.162 1.00 0.00 O ATOM 329 O5' DT A 11 -5.910 7.651 -8.580 1.00 0.00 O ATOM 330 C5' DT A 11 -6.910 6.646 -8.684 1.00 0.00 C ATOM 331 C4' DT A 11 -7.180 6.234 -10.143 1.00 0.00 C ATOM 332 O4' DT A 11 -7.753 7.334 -10.873 1.00 0.00 O ATOM 333 C3' DT A 11 -5.938 5.746 -10.950 1.00 0.00 C ATOM 334 O3' DT A 11 -6.316 4.742 -11.874 1.00 0.00 O ATOM 335 C2' DT A 11 -5.579 7.020 -11.728 1.00 0.00 C ATOM 336 C1' DT A 11 -6.978 7.591 -12.017 1.00 0.00 C ATOM 337 N1 DT A 11 -7.021 9.034 -12.329 1.00 0.00 N ATOM 338 C2 DT A 11 -6.663 9.439 -13.592 1.00 0.00 C ATOM 339 O2 DT A 11 -6.246 8.662 -14.454 1.00 0.00 O ATOM 340 N3 DT A 11 -6.820 10.780 -13.842 1.00 0.00 N ATOM 341 C4 DT A 11 -7.366 11.730 -12.989 1.00 0.00 C ATOM 342 O4 DT A 11 -7.601 12.857 -13.408 1.00 0.00 O ATOM 343 C5 DT A 11 -7.542 11.286 -11.596 1.00 0.00 C ATOM 344 C7 DT A 11 -7.934 12.318 -10.558 1.00 0.00 C ATOM 345 C6 DT A 11 -7.370 9.979 -11.345 1.00 0.00 C ATOM 0 H5' DT A 11 -7.834 7.010 -8.235 1.00 0.00 H new ATOM 0 H5'' DT A 11 -6.601 5.770 -8.113 1.00 0.00 H new ATOM 0 H4' DT A 11 -7.857 5.385 -10.052 1.00 0.00 H new ATOM 0 H3' DT A 11 -5.141 5.330 -10.334 1.00 0.00 H new ATOM 0 H2' DT A 11 -4.968 7.704 -11.139 1.00 0.00 H new ATOM 0 H2'' DT A 11 -5.025 6.803 -12.641 1.00 0.00 H new ATOM 0 H1' DT A 11 -7.353 7.108 -12.919 1.00 0.00 H new ATOM 0 H3 DT A 11 -6.501 11.114 -14.752 1.00 0.00 H new ATOM 0 H71 DT A 11 -8.521 11.840 -9.774 1.00 0.00 H new ATOM 0 H72 DT A 11 -7.036 12.756 -10.123 1.00 0.00 H new ATOM 0 H73 DT A 11 -8.527 13.101 -11.030 1.00 0.00 H new ATOM 0 H6 DT A 11 -7.507 9.632 -10.331 1.00 0.00 H new ATOM 358 P DA A 12 -5.752 3.286 -11.907 1.00 0.00 P ATOM 359 OP1 DA A 12 -4.274 3.286 -11.631 1.00 0.00 O ATOM 360 OP2 DA A 12 -6.235 2.672 -13.171 1.00 0.00 O ATOM 361 O5' DA A 12 -6.498 2.560 -10.734 1.00 0.00 O ATOM 362 C5' DA A 12 -5.971 2.515 -9.419 1.00 0.00 C ATOM 363 C4' DA A 12 -6.959 1.868 -8.431 1.00 0.00 C ATOM 364 O4' DA A 12 -8.085 2.732 -8.250 1.00 0.00 O ATOM 365 C3' DA A 12 -7.542 0.490 -8.840 1.00 0.00 C ATOM 366 O3' DA A 12 -7.872 -0.271 -7.681 1.00 0.00 O ATOM 367 C2' DA A 12 -8.825 0.910 -9.585 1.00 0.00 C ATOM 368 C1' DA A 12 -9.254 2.170 -8.817 1.00 0.00 C ATOM 369 N9 DA A 12 -9.942 3.207 -9.574 1.00 0.00 N ATOM 370 C8 DA A 12 -10.173 3.458 -10.913 1.00 0.00 C ATOM 371 N7 DA A 12 -10.735 4.605 -11.153 1.00 0.00 N ATOM 372 C5 DA A 12 -10.881 5.200 -9.897 1.00 0.00 C ATOM 373 C6 DA A 12 -11.364 6.439 -9.405 1.00 0.00 C ATOM 374 N6 DA A 12 -11.884 7.425 -10.156 1.00 0.00 N ATOM 375 N1 DA A 12 -11.319 6.651 -8.072 1.00 0.00 N ATOM 376 C2 DA A 12 -10.833 5.696 -7.263 1.00 0.00 C ATOM 377 N3 DA A 12 -10.354 4.497 -7.607 1.00 0.00 N ATOM 378 C4 DA A 12 -10.390 4.328 -8.923 1.00 0.00 C ATOM 0 H5' DA A 12 -5.734 3.526 -9.087 1.00 0.00 H new ATOM 0 H5'' DA A 12 -5.037 1.953 -9.420 1.00 0.00 H new ATOM 0 H4' DA A 12 -6.359 1.712 -7.534 1.00 0.00 H new ATOM 0 H3' DA A 12 -6.863 -0.129 -9.426 1.00 0.00 H new ATOM 0 H2' DA A 12 -8.633 1.121 -10.637 1.00 0.00 H new ATOM 0 H2'' DA A 12 -9.588 0.133 -9.550 1.00 0.00 H new ATOM 0 H1' DA A 12 -9.995 1.832 -8.092 1.00 0.00 H new ATOM 0 H8 DA A 12 -9.909 2.760 -11.694 1.00 0.00 H new ATOM 0 H61 DA A 12 -12.208 8.286 -9.715 1.00 0.00 H new ATOM 0 H62 DA A 12 -11.955 7.313 -11.167 1.00 0.00 H new ATOM 0 H2 DA A 12 -10.829 5.924 -6.207 1.00 0.00 H new ATOM 390 P DG A 13 -7.269 -1.721 -7.511 1.00 0.00 P ATOM 391 OP1 DG A 13 -5.786 -1.685 -7.659 1.00 0.00 O ATOM 392 OP2 DG A 13 -8.020 -2.665 -8.405 1.00 0.00 O ATOM 393 O5' DG A 13 -7.588 -1.999 -6.011 1.00 0.00 O ATOM 394 C5' DG A 13 -8.742 -2.697 -5.576 1.00 0.00 C ATOM 395 C4' DG A 13 -9.079 -2.384 -4.105 1.00 0.00 C ATOM 396 O4' DG A 13 -7.971 -2.717 -3.254 1.00 0.00 O ATOM 397 C3' DG A 13 -9.452 -0.907 -3.805 1.00 0.00 C ATOM 398 O3' DG A 13 -10.407 -0.847 -2.751 1.00 0.00 O ATOM 399 C2' DG A 13 -8.090 -0.348 -3.358 1.00 0.00 C ATOM 400 C1' DG A 13 -7.494 -1.556 -2.607 1.00 0.00 C ATOM 401 N9 DG A 13 -6.046 -1.606 -2.515 1.00 0.00 N ATOM 402 C8 DG A 13 -5.047 -1.591 -3.470 1.00 0.00 C ATOM 403 N7 DG A 13 -3.838 -1.662 -2.973 1.00 0.00 N ATOM 404 C5 DG A 13 -4.046 -1.731 -1.600 1.00 0.00 C ATOM 405 C6 DG A 13 -3.136 -1.761 -0.480 1.00 0.00 C ATOM 406 O6 DG A 13 -1.913 -1.734 -0.497 1.00 0.00 O ATOM 407 N1 DG A 13 -3.850 -1.814 0.747 1.00 0.00 N ATOM 408 C2 DG A 13 -5.213 -1.793 0.874 1.00 0.00 C ATOM 409 N2 DG A 13 -5.716 -1.800 2.126 1.00 0.00 N ATOM 410 N3 DG A 13 -6.046 -1.743 -0.135 1.00 0.00 N ATOM 411 C4 DG A 13 -5.402 -1.707 -1.327 1.00 0.00 C ATOM 0 H5' DG A 13 -8.584 -3.769 -5.693 1.00 0.00 H new ATOM 0 H5'' DG A 13 -9.589 -2.429 -6.208 1.00 0.00 H new ATOM 0 H4' DG A 13 -9.962 -2.992 -3.906 1.00 0.00 H new ATOM 0 H3' DG A 13 -9.903 -0.365 -4.636 1.00 0.00 H new ATOM 0 H2' DG A 13 -7.473 -0.046 -4.204 1.00 0.00 H new ATOM 0 H2'' DG A 13 -8.196 0.524 -2.713 1.00 0.00 H new ATOM 0 H1' DG A 13 -7.816 -1.470 -1.569 1.00 0.00 H new ATOM 0 H8 DG A 13 -5.246 -1.527 -4.530 1.00 0.00 H new ATOM 0 H1 DG A 13 -3.301 -1.873 1.605 1.00 0.00 H new ATOM 0 H21 DG A 13 -6.726 -1.785 2.270 1.00 0.00 H new ATOM 0 H22 DG A 13 -5.087 -1.820 2.928 1.00 0.00 H new ATOM 423 P DG A 14 -11.397 0.360 -2.557 1.00 0.00 P ATOM 424 OP1 DG A 14 -12.705 -0.207 -2.109 1.00 0.00 O ATOM 425 OP2 DG A 14 -11.397 1.238 -3.769 1.00 0.00 O ATOM 426 O5' DG A 14 -10.737 1.183 -1.388 1.00 0.00 O ATOM 427 C5' DG A 14 -10.955 0.764 -0.046 1.00 0.00 C ATOM 428 C4' DG A 14 -10.097 1.502 0.995 1.00 0.00 C ATOM 429 O4' DG A 14 -8.742 1.083 0.920 1.00 0.00 O ATOM 430 C3' DG A 14 -10.065 3.064 1.003 1.00 0.00 C ATOM 431 O3' DG A 14 -11.108 3.560 1.833 1.00 0.00 O ATOM 432 C2' DG A 14 -8.606 3.349 1.462 1.00 0.00 C ATOM 433 C1' DG A 14 -7.966 1.963 1.692 1.00 0.00 C ATOM 434 N9 DG A 14 -6.597 1.788 1.294 1.00 0.00 N ATOM 435 C8 DG A 14 -6.133 1.708 -0.002 1.00 0.00 C ATOM 436 N7 DG A 14 -4.842 1.565 -0.070 1.00 0.00 N ATOM 437 C5 DG A 14 -4.425 1.550 1.245 1.00 0.00 C ATOM 438 C6 DG A 14 -3.104 1.429 1.801 1.00 0.00 C ATOM 439 O6 DG A 14 -2.038 1.329 1.199 1.00 0.00 O ATOM 440 N1 DG A 14 -3.168 1.431 3.218 1.00 0.00 N ATOM 441 C2 DG A 14 -4.319 1.575 3.960 1.00 0.00 C ATOM 442 N2 DG A 14 -4.152 1.619 5.300 1.00 0.00 N ATOM 443 N3 DG A 14 -5.531 1.700 3.454 1.00 0.00 N ATOM 444 C4 DG A 14 -5.510 1.678 2.095 1.00 0.00 C ATOM 0 H5' DG A 14 -10.753 -0.305 0.026 1.00 0.00 H new ATOM 0 H5'' DG A 14 -12.007 0.907 0.200 1.00 0.00 H new ATOM 0 H4' DG A 14 -10.622 1.219 1.908 1.00 0.00 H new ATOM 0 H3' DG A 14 -10.264 3.570 0.058 1.00 0.00 H new ATOM 0 H2' DG A 14 -8.060 3.912 0.705 1.00 0.00 H new ATOM 0 H2'' DG A 14 -8.591 3.944 2.375 1.00 0.00 H new ATOM 0 H1' DG A 14 -7.951 1.798 2.769 1.00 0.00 H new ATOM 0 H8 DG A 14 -6.774 1.759 -0.870 1.00 0.00 H new ATOM 0 H1 DG A 14 -2.292 1.317 3.728 1.00 0.00 H new ATOM 0 H21 DG A 14 -4.961 1.724 5.912 1.00 0.00 H new ATOM 0 H22 DG A 14 -3.216 1.547 5.700 1.00 0.00 H new ATOM 456 P DG A 15 -11.313 5.108 2.064 1.00 0.00 P ATOM 457 OP1 DG A 15 -12.682 5.263 2.635 1.00 0.00 O ATOM 458 OP2 DG A 15 -10.976 5.866 0.823 1.00 0.00 O ATOM 459 O5' DG A 15 -10.254 5.495 3.170 1.00 0.00 O ATOM 460 C5' DG A 15 -10.364 4.863 4.442 1.00 0.00 C ATOM 461 C4' DG A 15 -9.194 5.146 5.399 1.00 0.00 C ATOM 462 O4' DG A 15 -7.953 4.663 4.866 1.00 0.00 O ATOM 463 C3' DG A 15 -8.978 6.630 5.833 1.00 0.00 C ATOM 464 O3' DG A 15 -8.813 6.719 7.244 1.00 0.00 O ATOM 465 C2' DG A 15 -7.648 6.966 5.135 1.00 0.00 C ATOM 466 C1' DG A 15 -6.936 5.601 5.145 1.00 0.00 C ATOM 467 N9 DG A 15 -5.877 5.410 4.182 1.00 0.00 N ATOM 468 C8 DG A 15 -5.959 5.442 2.803 1.00 0.00 C ATOM 469 N7 DG A 15 -4.834 5.170 2.207 1.00 0.00 N ATOM 470 C5 DG A 15 -3.949 4.937 3.248 1.00 0.00 C ATOM 471 C6 DG A 15 -2.547 4.608 3.243 1.00 0.00 C ATOM 472 O6 DG A 15 -1.818 4.410 2.279 1.00 0.00 O ATOM 473 N1 DG A 15 -2.064 4.497 4.572 1.00 0.00 N ATOM 474 C2 DG A 15 -2.811 4.646 5.712 1.00 0.00 C ATOM 475 N2 DG A 15 -2.146 4.444 6.871 1.00 0.00 N ATOM 476 N3 DG A 15 -4.094 4.934 5.727 1.00 0.00 N ATOM 477 C4 DG A 15 -4.593 5.075 4.467 1.00 0.00 C ATOM 0 H5' DG A 15 -10.442 3.786 4.293 1.00 0.00 H new ATOM 0 H5'' DG A 15 -11.291 5.187 4.916 1.00 0.00 H new ATOM 0 H4' DG A 15 -9.498 4.607 6.296 1.00 0.00 H new ATOM 0 H3' DG A 15 -9.807 7.290 5.577 1.00 0.00 H new ATOM 0 H2' DG A 15 -7.800 7.341 4.123 1.00 0.00 H new ATOM 0 H2'' DG A 15 -7.083 7.726 5.675 1.00 0.00 H new ATOM 0 H1' DG A 15 -6.438 5.502 6.110 1.00 0.00 H new ATOM 0 H8 DG A 15 -6.870 5.671 2.270 1.00 0.00 H new ATOM 0 H1 DG A 15 -1.073 4.288 4.690 1.00 0.00 H new ATOM 0 H21 DG A 15 -2.634 4.537 7.762 1.00 0.00 H new ATOM 0 H22 DG A 15 -1.156 4.199 6.855 1.00 0.00 H new ATOM 489 P DT A 16 -10.005 7.122 8.181 1.00 0.00 P ATOM 490 OP1 DT A 16 -10.805 8.220 7.557 1.00 0.00 O ATOM 491 OP2 DT A 16 -9.423 7.360 9.539 1.00 0.00 O ATOM 492 O5' DT A 16 -10.894 5.811 8.204 1.00 0.00 O ATOM 493 C5' DT A 16 -10.966 5.052 9.411 1.00 0.00 C ATOM 494 C4' DT A 16 -11.737 3.725 9.272 1.00 0.00 C ATOM 495 O4' DT A 16 -13.126 3.984 9.009 1.00 0.00 O ATOM 496 C3' DT A 16 -11.196 2.763 8.167 1.00 0.00 C ATOM 497 O3' DT A 16 -11.070 1.423 8.642 1.00 0.00 O ATOM 498 C2' DT A 16 -12.294 2.903 7.100 1.00 0.00 C ATOM 499 C1' DT A 16 -13.552 3.176 7.938 1.00 0.00 C ATOM 500 N1 DT A 16 -14.622 3.882 7.222 1.00 0.00 N ATOM 501 C2 DT A 16 -15.738 3.220 6.771 1.00 0.00 C ATOM 502 O2 DT A 16 -15.950 2.024 6.984 1.00 0.00 O ATOM 503 N3 DT A 16 -16.629 4.004 6.076 1.00 0.00 N ATOM 504 C4 DT A 16 -16.514 5.353 5.756 1.00 0.00 C ATOM 505 O4 DT A 16 -17.401 5.912 5.125 1.00 0.00 O ATOM 506 C5 DT A 16 -15.275 6.001 6.222 1.00 0.00 C ATOM 507 C7 DT A 16 -15.042 7.462 5.898 1.00 0.00 C ATOM 508 C6 DT A 16 -14.417 5.240 6.915 1.00 0.00 C ATOM 0 H5' DT A 16 -11.443 5.658 10.181 1.00 0.00 H new ATOM 0 H5'' DT A 16 -9.954 4.838 9.754 1.00 0.00 H new ATOM 0 H4' DT A 16 -11.594 3.218 10.226 1.00 0.00 H new ATOM 0 H3' DT A 16 -10.194 3.002 7.810 1.00 0.00 H new ATOM 0 H2' DT A 16 -12.084 3.719 6.409 1.00 0.00 H new ATOM 0 H2'' DT A 16 -12.395 1.997 6.503 1.00 0.00 H new ATOM 0 H1' DT A 16 -13.981 2.219 8.235 1.00 0.00 H new ATOM 0 H3 DT A 16 -17.479 3.539 5.756 1.00 0.00 H new ATOM 0 H71 DT A 16 -14.441 7.918 6.685 1.00 0.00 H new ATOM 0 H72 DT A 16 -14.517 7.544 4.946 1.00 0.00 H new ATOM 0 H73 DT A 16 -16.000 7.977 5.829 1.00 0.00 H new ATOM 0 H6 DT A 16 -13.504 5.701 7.262 1.00 0.00 H new ATOM 521 P DG A 17 -10.245 0.372 7.823 1.00 0.00 P ATOM 522 OP1 DG A 17 -9.583 1.014 6.637 1.00 0.00 O ATOM 523 OP2 DG A 17 -11.130 -0.803 7.564 1.00 0.00 O ATOM 524 O5' DG A 17 -9.130 -0.046 8.867 1.00 0.00 O ATOM 525 C5' DG A 17 -8.202 -1.026 8.384 1.00 0.00 C ATOM 526 C4' DG A 17 -6.970 -1.206 9.314 1.00 0.00 C ATOM 527 O4' DG A 17 -6.000 -2.088 8.709 1.00 0.00 O ATOM 528 C3' DG A 17 -6.226 0.113 9.623 1.00 0.00 C ATOM 529 O3' DG A 17 -5.639 0.089 10.922 1.00 0.00 O ATOM 530 C2' DG A 17 -5.211 0.118 8.472 1.00 0.00 C ATOM 531 C1' DG A 17 -4.843 -1.376 8.313 1.00 0.00 C ATOM 532 N9 DG A 17 -4.497 -1.754 6.947 1.00 0.00 N ATOM 533 C8 DG A 17 -5.354 -1.693 5.860 1.00 0.00 C ATOM 534 N7 DG A 17 -4.760 -1.777 4.709 1.00 0.00 N ATOM 535 C5 DG A 17 -3.421 -1.898 5.039 1.00 0.00 C ATOM 536 C6 DG A 17 -2.264 -2.018 4.190 1.00 0.00 C ATOM 537 O6 DG A 17 -2.204 -1.955 2.968 1.00 0.00 O ATOM 538 N1 DG A 17 -1.105 -2.219 4.969 1.00 0.00 N ATOM 539 C2 DG A 17 -1.064 -2.295 6.338 1.00 0.00 C ATOM 540 N2 DG A 17 0.164 -2.544 6.846 1.00 0.00 N ATOM 541 N3 DG A 17 -2.106 -2.142 7.124 1.00 0.00 N ATOM 542 C4 DG A 17 -3.253 -1.903 6.416 1.00 0.00 C ATOM 0 H5' DG A 17 -7.861 -0.736 7.390 1.00 0.00 H new ATOM 0 H5'' DG A 17 -8.714 -1.983 8.279 1.00 0.00 H new ATOM 0 H4' DG A 17 -7.378 -1.612 10.240 1.00 0.00 H new ATOM 0 H3' DG A 17 -6.840 1.013 9.663 1.00 0.00 H new ATOM 0 H2' DG A 17 -5.642 0.525 7.558 1.00 0.00 H new ATOM 0 H2'' DG A 17 -4.337 0.724 8.710 1.00 0.00 H new ATOM 0 H1' DG A 17 -3.959 -1.596 8.911 1.00 0.00 H new ATOM 0 H8 DG A 17 -6.424 -1.585 5.962 1.00 0.00 H new ATOM 0 H1 DG A 17 -0.220 -2.316 4.471 1.00 0.00 H new ATOM 0 H21 DG A 17 0.293 -2.618 7.855 1.00 0.00 H new ATOM 0 H22 DG A 17 0.961 -2.658 6.220 1.00 0.00 H new ATOM 554 P DG A 18 -4.951 1.403 11.472 1.00 0.00 P ATOM 555 OP1 DG A 18 -5.148 1.449 12.952 1.00 0.00 O ATOM 556 OP2 DG A 18 -5.353 2.586 10.660 1.00 0.00 O ATOM 557 O5' DG A 18 -3.429 1.137 11.175 1.00 0.00 O ATOM 558 C5' DG A 18 -2.737 0.169 11.952 1.00 0.00 C ATOM 559 C4' DG A 18 -1.263 0.049 11.553 1.00 0.00 C ATOM 560 O4' DG A 18 -1.120 -0.512 10.248 1.00 0.00 O ATOM 561 C3' DG A 18 -0.420 1.346 11.539 1.00 0.00 C ATOM 562 O3' DG A 18 -0.085 1.718 12.863 1.00 0.00 O ATOM 563 C2' DG A 18 0.742 0.908 10.661 1.00 0.00 C ATOM 564 C1' DG A 18 0.029 0.004 9.629 1.00 0.00 C ATOM 565 N9 DG A 18 -0.395 0.663 8.392 1.00 0.00 N ATOM 566 C8 DG A 18 -1.657 1.060 7.999 1.00 0.00 C ATOM 567 N7 DG A 18 -1.769 1.276 6.720 1.00 0.00 N ATOM 568 C5 DG A 18 -0.494 1.013 6.227 1.00 0.00 C ATOM 569 C6 DG A 18 0.038 0.964 4.889 1.00 0.00 C ATOM 570 O6 DG A 18 -0.557 1.102 3.827 1.00 0.00 O ATOM 571 N1 DG A 18 1.436 0.709 4.922 1.00 0.00 N ATOM 572 C2 DG A 18 2.172 0.446 6.049 1.00 0.00 C ATOM 573 N2 DG A 18 3.490 0.238 5.875 1.00 0.00 N ATOM 574 N3 DG A 18 1.673 0.363 7.255 1.00 0.00 N ATOM 575 C4 DG A 18 0.347 0.653 7.264 1.00 0.00 C ATOM 0 H5' DG A 18 -3.222 -0.800 11.837 1.00 0.00 H new ATOM 0 H5'' DG A 18 -2.805 0.437 13.006 1.00 0.00 H new ATOM 0 H4' DG A 18 -0.880 -0.584 12.354 1.00 0.00 H new ATOM 0 H3' DG A 18 -0.896 2.248 11.155 1.00 0.00 H new ATOM 0 H2' DG A 18 1.240 1.755 10.189 1.00 0.00 H new ATOM 0 H2'' DG A 18 1.501 0.366 11.226 1.00 0.00 H new ATOM 0 H1' DG A 18 0.759 -0.749 9.331 1.00 0.00 H new ATOM 0 H8 DG A 18 -2.478 1.181 8.690 1.00 0.00 H new ATOM 0 H1 DG A 18 1.934 0.723 4.032 1.00 0.00 H new ATOM 0 H21 DG A 18 4.085 0.038 6.679 1.00 0.00 H new ATOM 0 H22 DG A 18 3.894 0.280 4.939 1.00 0.00 H new ATOM 587 P DG A 19 0.046 3.213 13.313 1.00 0.00 P ATOM 588 OP1 DG A 19 0.291 3.193 14.784 1.00 0.00 O ATOM 589 OP2 DG A 19 -1.106 4.021 12.812 1.00 0.00 O ATOM 590 O5' DG A 19 1.324 3.729 12.546 1.00 0.00 O ATOM 591 C5' DG A 19 2.594 3.156 12.825 1.00 0.00 C ATOM 592 C4' DG A 19 3.705 3.670 11.882 1.00 0.00 C ATOM 593 O4' DG A 19 3.473 3.248 10.524 1.00 0.00 O ATOM 594 C3' DG A 19 3.883 5.216 11.866 1.00 0.00 C ATOM 595 O3' DG A 19 5.259 5.568 11.793 1.00 0.00 O ATOM 596 C2' DG A 19 3.136 5.578 10.575 1.00 0.00 C ATOM 597 C1' DG A 19 3.457 4.371 9.672 1.00 0.00 C ATOM 598 N9 DG A 19 2.510 4.164 8.597 1.00 0.00 N ATOM 599 C8 DG A 19 1.135 4.040 8.682 1.00 0.00 C ATOM 600 N7 DG A 19 0.541 3.961 7.524 1.00 0.00 N ATOM 601 C5 DG A 19 1.586 4.018 6.615 1.00 0.00 C ATOM 602 C6 DG A 19 1.586 4.017 5.175 1.00 0.00 C ATOM 603 O6 DG A 19 0.632 3.954 4.413 1.00 0.00 O ATOM 604 N1 DG A 19 2.909 4.082 4.683 1.00 0.00 N ATOM 605 C2 DG A 19 4.043 4.184 5.443 1.00 0.00 C ATOM 606 N2 DG A 19 5.181 4.288 4.728 1.00 0.00 N ATOM 607 N3 DG A 19 4.058 4.223 6.756 1.00 0.00 N ATOM 608 C4 DG A 19 2.800 4.133 7.274 1.00 0.00 C ATOM 0 H5' DG A 19 2.525 2.072 12.739 1.00 0.00 H new ATOM 0 H5'' DG A 19 2.868 3.377 13.856 1.00 0.00 H new ATOM 0 H4' DG A 19 4.616 3.232 12.290 1.00 0.00 H new ATOM 0 H3' DG A 19 3.514 5.729 12.754 1.00 0.00 H new ATOM 0 H2' DG A 19 2.065 5.690 10.741 1.00 0.00 H new ATOM 0 H2'' DG A 19 3.492 6.515 10.146 1.00 0.00 H new ATOM 0 H1' DG A 19 4.409 4.546 9.171 1.00 0.00 H new ATOM 0 H8 DG A 19 0.602 4.011 9.621 1.00 0.00 H new ATOM 0 H1 DG A 19 3.030 4.050 3.671 1.00 0.00 H new ATOM 0 H21 DG A 19 6.078 4.369 5.206 1.00 0.00 H new ATOM 0 H22 DG A 19 5.145 4.286 3.709 1.00 0.00 H new ATOM 620 P DT A 20 5.713 7.062 12.036 1.00 0.00 P ATOM 621 OP1 DT A 20 6.856 7.009 12.993 1.00 0.00 O ATOM 622 OP2 DT A 20 4.538 7.920 12.392 1.00 0.00 O ATOM 623 O5' DT A 20 6.197 7.518 10.607 1.00 0.00 O ATOM 624 C5' DT A 20 7.318 6.885 10.006 1.00 0.00 C ATOM 625 C4' DT A 20 7.599 7.319 8.552 1.00 0.00 C ATOM 626 O4' DT A 20 6.529 6.877 7.697 1.00 0.00 O ATOM 627 C3' DT A 20 7.832 8.841 8.252 1.00 0.00 C ATOM 628 O3' DT A 20 8.873 8.982 7.296 1.00 0.00 O ATOM 629 C2' DT A 20 6.502 9.215 7.580 1.00 0.00 C ATOM 630 C1' DT A 20 6.218 7.917 6.797 1.00 0.00 C ATOM 631 N1 DT A 20 4.860 7.711 6.307 1.00 0.00 N ATOM 632 C2 DT A 20 4.589 7.531 4.971 1.00 0.00 C ATOM 633 O2 DT A 20 5.457 7.488 4.099 1.00 0.00 O ATOM 634 N3 DT A 20 3.252 7.396 4.670 1.00 0.00 N ATOM 635 C4 DT A 20 2.173 7.400 5.547 1.00 0.00 C ATOM 636 O4 DT A 20 1.036 7.239 5.122 1.00 0.00 O ATOM 637 C5 DT A 20 2.526 7.578 6.965 1.00 0.00 C ATOM 638 C7 DT A 20 1.421 7.648 7.995 1.00 0.00 C ATOM 639 C6 DT A 20 3.828 7.687 7.258 1.00 0.00 C ATOM 0 H5' DT A 20 7.163 5.806 10.026 1.00 0.00 H new ATOM 0 H5'' DT A 20 8.202 7.091 10.610 1.00 0.00 H new ATOM 0 H4' DT A 20 8.562 6.846 8.358 1.00 0.00 H new ATOM 0 H3' DT A 20 8.099 9.437 9.125 1.00 0.00 H new ATOM 0 H2' DT A 20 5.720 9.444 8.304 1.00 0.00 H new ATOM 0 H2'' DT A 20 6.595 10.083 6.927 1.00 0.00 H new ATOM 0 H1' DT A 20 6.812 7.959 5.884 1.00 0.00 H new ATOM 0 H3 DT A 20 3.025 7.279 3.682 1.00 0.00 H new ATOM 0 H71 DT A 20 1.784 7.255 8.945 1.00 0.00 H new ATOM 0 H72 DT A 20 1.111 8.685 8.126 1.00 0.00 H new ATOM 0 H73 DT A 20 0.571 7.055 7.658 1.00 0.00 H new ATOM 0 H6 DT A 20 4.104 7.762 8.300 1.00 0.00 H new ATOM 652 P DA A 21 9.813 10.237 7.163 1.00 0.00 P ATOM 653 OP1 DA A 21 11.204 9.739 7.363 1.00 0.00 O ATOM 654 OP2 DA A 21 9.319 11.383 8.000 1.00 0.00 O ATOM 655 O5' DA A 21 9.674 10.566 5.640 1.00 0.00 O ATOM 656 C5' DA A 21 8.739 11.459 5.047 1.00 0.00 C ATOM 657 C4' DA A 21 7.921 10.760 3.931 1.00 0.00 C ATOM 658 O4' DA A 21 6.626 10.376 4.421 1.00 0.00 O ATOM 659 C3' DA A 21 7.684 11.543 2.599 1.00 0.00 C ATOM 660 O3' DA A 21 7.829 10.634 1.506 1.00 0.00 O ATOM 661 C2' DA A 21 6.210 11.962 2.764 1.00 0.00 C ATOM 662 C1' DA A 21 5.653 10.717 3.470 1.00 0.00 C ATOM 663 N9 DA A 21 4.373 10.829 4.151 1.00 0.00 N ATOM 664 C8 DA A 21 4.048 10.999 5.479 1.00 0.00 C ATOM 665 N7 DA A 21 2.772 10.944 5.722 1.00 0.00 N ATOM 666 C5 DA A 21 2.181 10.731 4.468 1.00 0.00 C ATOM 667 C6 DA A 21 0.861 10.619 3.964 1.00 0.00 C ATOM 668 N6 DA A 21 -0.260 10.658 4.707 1.00 0.00 N ATOM 669 N1 DA A 21 0.703 10.474 2.629 1.00 0.00 N ATOM 670 C2 DA A 21 1.781 10.430 1.830 1.00 0.00 C ATOM 671 N3 DA A 21 3.067 10.533 2.185 1.00 0.00 N ATOM 672 C4 DA A 21 3.187 10.667 3.498 1.00 0.00 C ATOM 0 H5' DA A 21 9.266 12.317 4.631 1.00 0.00 H new ATOM 0 H5'' DA A 21 8.062 11.841 5.812 1.00 0.00 H new ATOM 0 H4' DA A 21 8.566 9.919 3.675 1.00 0.00 H new ATOM 0 H3' DA A 21 8.361 12.376 2.412 1.00 0.00 H new ATOM 0 H2' DA A 21 6.099 12.865 3.364 1.00 0.00 H new ATOM 0 H2'' DA A 21 5.722 12.152 1.808 1.00 0.00 H new ATOM 0 H1' DA A 21 5.453 9.984 2.689 1.00 0.00 H new ATOM 0 H8 DA A 21 4.787 11.163 6.249 1.00 0.00 H new ATOM 0 H61 DA A 21 -1.172 10.569 4.259 1.00 0.00 H new ATOM 0 H62 DA A 21 -0.198 10.776 5.718 1.00 0.00 H new ATOM 0 H2 DA A 21 1.587 10.296 0.776 1.00 0.00 H new ATOM 684 P DA A 22 8.291 11.187 0.101 1.00 0.00 P ATOM 685 OP1 DA A 22 9.698 11.665 0.192 1.00 0.00 O ATOM 686 OP2 DA A 22 7.273 12.153 -0.417 1.00 0.00 O ATOM 687 O5' DA A 22 8.290 9.910 -0.812 1.00 0.00 O ATOM 688 C5' DA A 22 7.413 8.804 -0.706 1.00 0.00 C ATOM 689 C4' DA A 22 6.159 8.827 -1.608 1.00 0.00 C ATOM 690 O4' DA A 22 5.440 7.597 -1.411 1.00 0.00 O ATOM 691 C3' DA A 22 5.083 9.922 -1.418 1.00 0.00 C ATOM 692 O3' DA A 22 5.367 11.186 -2.010 1.00 0.00 O ATOM 693 C2' DA A 22 3.906 9.251 -2.096 1.00 0.00 C ATOM 694 C1' DA A 22 4.064 7.788 -1.617 1.00 0.00 C ATOM 695 N9 DA A 22 3.363 7.509 -0.358 1.00 0.00 N ATOM 696 C8 DA A 22 3.822 7.306 0.925 1.00 0.00 C ATOM 697 N7 DA A 22 2.876 7.148 1.801 1.00 0.00 N ATOM 698 C5 DA A 22 1.688 7.259 1.064 1.00 0.00 C ATOM 699 C6 DA A 22 0.307 7.311 1.367 1.00 0.00 C ATOM 700 N6 DA A 22 -0.221 7.210 2.600 1.00 0.00 N ATOM 701 N1 DA A 22 -0.555 7.503 0.347 1.00 0.00 N ATOM 702 C2 DA A 22 -0.090 7.666 -0.902 1.00 0.00 C ATOM 703 N3 DA A 22 1.185 7.668 -1.309 1.00 0.00 N ATOM 704 C4 DA A 22 2.002 7.469 -0.282 1.00 0.00 C ATOM 0 H5' DA A 22 7.086 8.727 0.331 1.00 0.00 H new ATOM 0 H5'' DA A 22 7.977 7.899 -0.930 1.00 0.00 H new ATOM 0 H4' DA A 22 6.604 9.015 -2.585 1.00 0.00 H new ATOM 0 H3' DA A 22 4.958 10.201 -0.372 1.00 0.00 H new ATOM 0 H2' DA A 22 2.954 9.683 -1.787 1.00 0.00 H new ATOM 0 H2'' DA A 22 3.956 9.334 -3.182 1.00 0.00 H new ATOM 0 HO3' DA A 22 5.865 11.741 -1.374 1.00 0.00 H new ATOM 0 H1' DA A 22 3.634 7.122 -2.365 1.00 0.00 H new ATOM 0 H8 DA A 22 4.871 7.281 1.179 1.00 0.00 H new ATOM 0 H61 DA A 22 -1.232 7.258 2.727 1.00 0.00 H new ATOM 0 H62 DA A 22 0.390 7.085 3.408 1.00 0.00 H new ATOM 0 H2 DA A 22 -0.834 7.813 -1.671 1.00 0.00 H new TER 717 DA A 22 HETATM 718 K K A 31 -0.283 -0.834 1.382 1.00 0.00 K HETATM 719 K K A 30 0.396 2.952 2.001 1.00 0.00 K