USER MOD reduce.3.24.130724 H: found=0, std=0, add=264, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 264 hydrogens (15 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 NoAdj-H: A 6 DG H21 : A 6 DG N2 : A 25 BPJ C1 :(H bumps) USER MOD NoAdj-H: A 25 BPJH12A : A 25 BPJ C1 : A 6 DG N2 :(H bumps) USER MOD Single : A 1 DC O5' : rot 30:sc= 0.00307 USER MOD Single : A 4 DT C7 :methyl 150:sc= -0.895 (180deg=-0.895) USER MOD Single : A 8 DT C7 :methyl -30:sc= 0 (180deg=-0.274) USER MOD Single : A 11 DC O3' : rot 180:sc= 0 USER MOD Single : A 25 BPJ O2 : rot 180:sc= 0.165 USER MOD Single : A 25 BPJ O3 : rot -140:sc= -0.369 USER MOD Single : A 25 BPJ O4 : rot -150:sc= -0.398 USER MOD Single : B 12 DG O5' : rot 180:sc= 0 USER MOD Single : B 14 DT C7 :methyl 150:sc= -0.208 (180deg=-0.208) USER MOD Single : B 20 DT C7 :methyl 150:sc= -0.734 (180deg=-0.734) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 12.366 -17.589 4.201 1.00 0.15 O ATOM 2 C5' DC A 1 11.936 -18.499 3.180 1.00 0.12 C ATOM 3 C4' DC A 1 10.556 -18.136 2.654 1.00 0.09 C ATOM 4 O4' DC A 1 9.635 -18.106 3.743 1.00 0.11 O ATOM 5 C3' DC A 1 10.537 -16.751 2.024 1.00 0.09 C ATOM 6 O3' DC A 1 10.767 -16.734 0.597 1.00 0.10 O ATOM 7 C2' DC A 1 9.127 -16.355 2.307 1.00 0.10 C ATOM 8 C1' DC A 1 8.523 -17.342 3.281 1.00 0.09 C ATOM 9 N1 DC A 1 7.915 -16.682 4.441 1.00 0.10 N ATOM 10 C2 DC A 1 6.594 -16.922 4.778 1.00 0.11 C ATOM 11 O2 DC A 1 5.878 -17.676 4.127 1.00 0.14 O ATOM 12 N3 DC A 1 6.089 -16.291 5.865 1.00 0.13 N ATOM 13 C4 DC A 1 6.842 -15.458 6.590 1.00 0.12 C ATOM 14 N4 DC A 1 6.284 -14.882 7.647 1.00 0.13 N ATOM 15 C5 DC A 1 8.208 -15.207 6.239 1.00 0.12 C ATOM 16 C6 DC A 1 8.684 -15.846 5.164 1.00 0.11 C ATOM 0 H5' DC A 1 11.919 -19.513 3.579 1.00 0.12 H new ATOM 0 H5'' DC A 1 12.653 -18.491 2.359 1.00 0.12 H new ATOM 0 H4' DC A 1 10.288 -18.882 1.906 1.00 0.09 H new ATOM 0 H3' DC A 1 11.325 -16.107 2.414 1.00 0.09 H new ATOM 0 H2' DC A 1 9.095 -15.348 2.723 1.00 0.10 H new ATOM 0 H2'' DC A 1 8.549 -16.336 1.383 1.00 0.10 H new ATOM 0 HO5' DC A 1 11.585 -17.244 4.681 1.00 0.15 H new ATOM 0 H1' DC A 1 7.738 -17.924 2.798 1.00 0.09 H new ATOM 0 H41 DC A 1 6.827 -14.240 8.224 1.00 0.13 H new ATOM 0 H42 DC A 1 5.312 -15.081 7.882 1.00 0.13 H new ATOM 0 H5 DC A 1 8.825 -14.533 6.815 1.00 0.12 H new ATOM 0 H6 DC A 1 9.711 -15.687 4.869 1.00 0.11 H new ATOM 29 P DC A 2 10.006 -17.660 -0.509 1.00 0.09 P ATOM 30 OP1 DC A 2 10.287 -19.075 -0.177 1.00 0.12 O ATOM 31 OP2 DC A 2 10.353 -17.138 -1.850 1.00 0.13 O ATOM 32 O5' DC A 2 8.431 -17.368 -0.249 1.00 0.12 O ATOM 33 C5' DC A 2 7.411 -18.372 -0.421 1.00 0.11 C ATOM 34 C4' DC A 2 5.989 -17.837 -0.194 1.00 0.12 C ATOM 35 O4' DC A 2 5.796 -17.331 1.140 1.00 0.12 O ATOM 36 C3' DC A 2 5.620 -16.693 -1.160 1.00 0.10 C ATOM 37 O3' DC A 2 4.673 -17.061 -2.179 1.00 0.13 O ATOM 38 C2' DC A 2 5.083 -15.629 -0.239 1.00 0.11 C ATOM 39 C1' DC A 2 4.760 -16.336 1.079 1.00 0.10 C ATOM 40 N1 DC A 2 4.930 -15.420 2.206 1.00 0.09 N ATOM 41 C2 DC A 2 3.955 -15.219 3.176 1.00 0.11 C ATOM 42 O2 DC A 2 2.869 -15.790 3.157 1.00 0.13 O ATOM 43 N3 DC A 2 4.226 -14.344 4.182 1.00 0.12 N ATOM 44 C4 DC A 2 5.396 -13.700 4.228 1.00 0.10 C ATOM 45 N4 DC A 2 5.620 -12.856 5.226 1.00 0.10 N ATOM 46 C5 DC A 2 6.377 -13.926 3.216 1.00 0.09 C ATOM 47 C6 DC A 2 6.092 -14.777 2.257 1.00 0.08 C ATOM 0 H5' DC A 2 7.598 -19.193 0.272 1.00 0.11 H new ATOM 0 H5'' DC A 2 7.481 -18.783 -1.428 1.00 0.11 H new ATOM 0 H4' DC A 2 5.348 -18.701 -0.371 1.00 0.12 H new ATOM 0 H3' DC A 2 6.480 -16.370 -1.747 1.00 0.10 H new ATOM 0 H2' DC A 2 5.817 -14.837 -0.088 1.00 0.11 H new ATOM 0 H2'' DC A 2 4.193 -15.162 -0.660 1.00 0.11 H new ATOM 0 H1' DC A 2 3.741 -16.721 1.126 1.00 0.10 H new ATOM 0 H41 DC A 2 6.506 -12.354 5.280 1.00 0.10 H new ATOM 0 H42 DC A 2 4.906 -12.709 5.939 1.00 0.10 H new ATOM 0 H5 DC A 2 7.327 -13.412 3.238 1.00 0.09 H new ATOM 0 H6 DC A 2 6.825 -14.960 1.485 1.00 0.08 H new ATOM 59 P DA A 3 3.196 -17.689 -1.918 1.00 0.13 P ATOM 60 OP1 DA A 3 3.276 -18.616 -0.766 1.00 0.21 O ATOM 61 OP2 DA A 3 2.692 -18.191 -3.215 1.00 0.24 O ATOM 62 O5' DA A 3 2.266 -16.441 -1.476 1.00 0.12 O ATOM 63 C5' DA A 3 0.878 -16.660 -1.159 1.00 0.10 C ATOM 64 C4' DA A 3 0.155 -15.457 -0.594 1.00 0.09 C ATOM 65 O4' DA A 3 0.741 -15.018 0.647 1.00 0.11 O ATOM 66 C3' DA A 3 0.082 -14.249 -1.525 1.00 0.10 C ATOM 67 O3' DA A 3 -1.203 -14.126 -2.156 1.00 0.10 O ATOM 68 C2' DA A 3 0.409 -13.127 -0.569 1.00 0.08 C ATOM 69 C1' DA A 3 0.314 -13.667 0.842 1.00 0.08 C ATOM 70 N9 DA A 3 1.254 -12.985 1.760 1.00 0.08 N ATOM 71 C8 DA A 3 2.544 -12.648 1.517 1.00 0.10 C ATOM 72 N7 DA A 3 3.168 -12.059 2.553 1.00 0.10 N ATOM 73 C5 DA A 3 2.204 -12.022 3.503 1.00 0.10 C ATOM 74 C6 DA A 3 2.212 -11.535 4.810 1.00 0.11 C ATOM 75 N6 DA A 3 3.292 -10.990 5.358 1.00 0.14 N ATOM 76 N1 DA A 3 1.085 -11.638 5.522 1.00 0.11 N ATOM 77 C2 DA A 3 0.011 -12.194 4.975 1.00 0.11 C ATOM 78 N3 DA A 3 -0.123 -12.694 3.753 1.00 0.10 N ATOM 79 C4 DA A 3 1.030 -12.575 3.055 1.00 0.09 C ATOM 0 H5' DA A 3 0.809 -17.477 -0.441 1.00 0.10 H new ATOM 0 H5'' DA A 3 0.361 -16.985 -2.062 1.00 0.10 H new ATOM 0 H4' DA A 3 -0.861 -15.822 -0.446 1.00 0.09 H new ATOM 0 H3' DA A 3 0.754 -14.289 -2.382 1.00 0.10 H new ATOM 0 H2' DA A 3 1.410 -12.742 -0.762 1.00 0.08 H new ATOM 0 H2'' DA A 3 -0.284 -12.297 -0.706 1.00 0.08 H new ATOM 0 H1' DA A 3 -0.673 -13.541 1.286 1.00 0.08 H new ATOM 0 H8 DA A 3 3.030 -12.836 0.571 1.00 0.10 H new ATOM 0 H61 DA A 3 3.258 -10.645 6.317 1.00 0.14 H new ATOM 0 H62 DA A 3 4.155 -10.916 4.820 1.00 0.14 H new ATOM 0 H2 DA A 3 -0.865 -12.246 5.604 1.00 0.11 H new ATOM 91 P DT A 4 -1.689 -12.828 -2.996 1.00 0.09 P ATOM 92 OP1 DT A 4 -2.647 -13.272 -4.034 1.00 0.16 O ATOM 93 OP2 DT A 4 -0.498 -12.037 -3.383 1.00 0.14 O ATOM 94 O5' DT A 4 -2.492 -11.998 -1.873 1.00 0.13 O ATOM 95 C5' DT A 4 -3.690 -12.526 -1.283 1.00 0.15 C ATOM 96 C4' DT A 4 -4.287 -11.597 -0.230 1.00 0.13 C ATOM 97 O4' DT A 4 -3.364 -11.399 0.863 1.00 0.13 O ATOM 98 C3' DT A 4 -4.660 -10.225 -0.802 1.00 0.12 C ATOM 99 O3' DT A 4 -5.945 -9.780 -0.343 1.00 0.15 O ATOM 100 C2' DT A 4 -3.505 -9.395 -0.286 1.00 0.10 C ATOM 101 C1' DT A 4 -3.182 -9.997 1.083 1.00 0.11 C ATOM 102 N1 DT A 4 -1.791 -9.764 1.569 1.00 0.10 N ATOM 103 C2 DT A 4 -1.589 -9.451 2.913 1.00 0.11 C ATOM 104 O2 DT A 4 -2.495 -9.354 3.733 1.00 0.13 O ATOM 105 N3 DT A 4 -0.279 -9.252 3.304 1.00 0.10 N ATOM 106 C4 DT A 4 0.827 -9.337 2.488 1.00 0.10 C ATOM 107 O4 DT A 4 1.942 -9.146 2.953 1.00 0.11 O ATOM 108 C5 DT A 4 0.529 -9.665 1.116 1.00 0.09 C ATOM 109 C7 DT A 4 1.628 -9.801 0.070 1.00 0.10 C ATOM 110 C6 DT A 4 -0.725 -9.861 0.712 1.00 0.09 C ATOM 0 H5' DT A 4 -3.471 -13.492 -0.827 1.00 0.15 H new ATOM 0 H5'' DT A 4 -4.428 -12.703 -2.065 1.00 0.15 H new ATOM 0 H4' DT A 4 -5.195 -12.086 0.124 1.00 0.13 H new ATOM 0 H3' DT A 4 -4.777 -10.187 -1.885 1.00 0.12 H new ATOM 0 H2' DT A 4 -2.647 -9.449 -0.956 1.00 0.10 H new ATOM 0 H2'' DT A 4 -3.778 -8.343 -0.203 1.00 0.10 H new ATOM 0 H1' DT A 4 -3.811 -9.542 1.848 1.00 0.11 H new ATOM 0 H3 DT A 4 -0.117 -9.022 4.284 1.00 0.10 H new ATOM 0 H71 DT A 4 1.322 -10.522 -0.688 1.00 0.10 H new ATOM 0 H72 DT A 4 1.805 -8.834 -0.400 1.00 0.10 H new ATOM 0 H73 DT A 4 2.545 -10.145 0.548 1.00 0.10 H new ATOM 0 H6 DT A 4 -0.908 -10.104 -0.324 1.00 0.09 H new ATOM 123 P DC A 5 -6.565 -8.300 -0.583 1.00 0.10 P ATOM 124 OP1 DC A 5 -7.995 -8.444 -0.940 1.00 0.16 O ATOM 125 OP2 DC A 5 -5.656 -7.536 -1.467 1.00 0.14 O ATOM 126 O5' DC A 5 -6.457 -7.674 0.894 1.00 0.13 O ATOM 127 C5' DC A 5 -6.943 -8.421 2.018 1.00 0.13 C ATOM 128 C4' DC A 5 -6.417 -7.891 3.343 1.00 0.09 C ATOM 129 O4' DC A 5 -4.973 -7.883 3.390 1.00 0.10 O ATOM 130 C3' DC A 5 -6.862 -6.475 3.671 1.00 0.07 C ATOM 131 O3' DC A 5 -7.057 -6.495 5.090 1.00 0.09 O ATOM 132 C2' DC A 5 -5.667 -5.699 3.148 1.00 0.07 C ATOM 133 C1' DC A 5 -4.498 -6.541 3.628 1.00 0.08 C ATOM 134 N1 DC A 5 -3.194 -6.391 2.936 1.00 0.07 N ATOM 135 C2 DC A 5 -2.038 -6.256 3.703 1.00 0.08 C ATOM 136 O2 DC A 5 -2.058 -6.183 4.929 1.00 0.09 O ATOM 137 N3 DC A 5 -0.847 -6.184 3.062 1.00 0.08 N ATOM 138 C4 DC A 5 -0.774 -6.238 1.734 1.00 0.08 C ATOM 139 N4 DC A 5 0.428 -6.177 1.173 1.00 0.10 N ATOM 140 C5 DC A 5 -1.946 -6.369 0.931 1.00 0.07 C ATOM 141 C6 DC A 5 -3.124 -6.439 1.577 1.00 0.07 C ATOM 0 H5' DC A 5 -6.653 -9.466 1.908 1.00 0.13 H new ATOM 0 H5'' DC A 5 -8.033 -8.391 2.026 1.00 0.13 H new ATOM 0 H4' DC A 5 -6.840 -8.581 4.073 1.00 0.09 H new ATOM 0 H3' DC A 5 -7.777 -6.054 3.254 1.00 0.07 H new ATOM 0 H2' DC A 5 -5.684 -5.609 2.062 1.00 0.07 H new ATOM 0 H2'' DC A 5 -5.632 -4.687 3.551 1.00 0.07 H new ATOM 0 H1' DC A 5 -4.261 -6.245 4.650 1.00 0.08 H new ATOM 0 H41 DC A 5 0.520 -6.216 0.158 1.00 0.10 H new ATOM 0 H42 DC A 5 1.260 -6.091 1.757 1.00 0.10 H new ATOM 0 H5 DC A 5 -1.890 -6.410 -0.147 1.00 0.07 H new ATOM 0 H6 DC A 5 -4.035 -6.535 1.005 1.00 0.07 H new ATOM 153 P DG A 6 -6.863 -5.260 6.092 1.00 0.08 P ATOM 154 OP1 DG A 6 -7.358 -5.688 7.420 1.00 0.09 O ATOM 155 OP2 DG A 6 -7.427 -4.048 5.456 1.00 0.10 O ATOM 156 O5' DG A 6 -5.260 -5.101 6.181 1.00 0.10 O ATOM 157 C5' DG A 6 -4.649 -4.059 6.955 1.00 0.10 C ATOM 158 C4' DG A 6 -4.050 -2.957 6.086 1.00 0.10 C ATOM 159 O4' DG A 6 -2.998 -3.432 5.231 1.00 0.11 O ATOM 160 C3' DG A 6 -5.044 -2.308 5.115 1.00 0.10 C ATOM 161 O3' DG A 6 -5.848 -1.277 5.706 1.00 0.12 O ATOM 162 C2' DG A 6 -4.106 -1.851 3.984 1.00 0.12 C ATOM 163 C1' DG A 6 -2.716 -2.276 4.437 1.00 0.10 C ATOM 164 N9 DG A 6 -1.724 -2.619 3.397 1.00 0.10 N ATOM 165 C8 DG A 6 -1.855 -3.149 2.143 1.00 0.11 C ATOM 166 N7 DG A 6 -0.672 -3.328 1.514 1.00 0.12 N ATOM 167 C5 DG A 6 0.239 -2.887 2.419 1.00 0.11 C ATOM 168 C6 DG A 6 1.655 -2.821 2.336 1.00 0.13 C ATOM 169 O6 DG A 6 2.395 -3.138 1.410 1.00 0.16 O ATOM 170 N1 DG A 6 2.218 -2.304 3.486 1.00 0.12 N ATOM 171 C2 DG A 6 1.523 -1.889 4.596 1.00 0.11 C ATOM 172 N2 DG A 6 2.236 -1.367 5.599 1.00 0.12 N ATOM 173 N3 DG A 6 0.194 -1.949 4.674 1.00 0.10 N ATOM 174 C4 DG A 6 -0.378 -2.453 3.563 1.00 0.10 C ATOM 0 H5' DG A 6 -3.867 -4.488 7.582 1.00 0.10 H new ATOM 0 H5'' DG A 6 -5.392 -3.625 7.624 1.00 0.10 H new ATOM 0 H4' DG A 6 -3.701 -2.244 6.832 1.00 0.10 H new ATOM 0 H3' DG A 6 -5.831 -2.976 4.765 1.00 0.10 H new ATOM 0 H2' DG A 6 -4.373 -2.317 3.036 1.00 0.12 H new ATOM 0 H2'' DG A 6 -4.161 -0.773 3.835 1.00 0.12 H new ATOM 0 H1' DG A 6 -2.231 -1.434 4.931 1.00 0.10 H new ATOM 0 H8 DG A 6 -2.808 -3.399 1.700 1.00 0.11 H new ATOM 0 H1 DG A 6 3.234 -2.224 3.514 1.00 0.12 H new ATOM 0 H22 DG A 6 3.250 -1.291 5.518 1.00 0.12 H new ATOM 185 P DC A 7 -6.767 -0.284 4.821 1.00 0.14 P ATOM 186 OP1 DC A 7 -7.918 0.163 5.639 1.00 0.17 O ATOM 187 OP2 DC A 7 -7.000 -0.895 3.491 1.00 0.18 O ATOM 188 O5' DC A 7 -5.754 0.963 4.633 1.00 0.16 O ATOM 189 C5' DC A 7 -5.387 1.785 5.752 1.00 0.16 C ATOM 190 C4' DC A 7 -4.278 1.177 6.634 1.00 0.16 C ATOM 191 O4' DC A 7 -3.057 0.843 5.960 1.00 0.15 O ATOM 192 C3' DC A 7 -4.017 2.019 7.847 1.00 0.16 C ATOM 193 O3' DC A 7 -4.024 1.187 9.019 1.00 0.17 O ATOM 194 C2' DC A 7 -2.602 2.388 7.627 1.00 0.14 C ATOM 195 C1' DC A 7 -2.124 1.858 6.310 1.00 0.14 C ATOM 196 N1 DC A 7 -1.743 2.745 5.182 1.00 0.12 N ATOM 197 C2 DC A 7 -0.598 3.535 5.279 1.00 0.12 C ATOM 198 O2 DC A 7 0.115 3.565 6.279 1.00 0.15 O ATOM 199 N3 DC A 7 -0.257 4.304 4.215 1.00 0.11 N ATOM 200 C4 DC A 7 -0.996 4.308 3.104 1.00 0.11 C ATOM 201 N4 DC A 7 -0.607 5.073 2.092 1.00 0.14 N ATOM 202 C5 DC A 7 -2.173 3.511 2.986 1.00 0.14 C ATOM 203 C6 DC A 7 -2.503 2.749 4.048 1.00 0.14 C ATOM 0 H5' DC A 7 -6.270 1.962 6.366 1.00 0.16 H new ATOM 0 H5'' DC A 7 -5.054 2.756 5.384 1.00 0.16 H new ATOM 0 H4' DC A 7 -4.686 0.215 6.944 1.00 0.16 H new ATOM 0 H3' DC A 7 -4.729 2.834 7.977 1.00 0.16 H new ATOM 0 H2' DC A 7 -2.494 3.472 7.651 1.00 0.14 H new ATOM 0 H2'' DC A 7 -1.986 1.989 8.432 1.00 0.14 H new ATOM 0 H1' DC A 7 -1.103 1.520 6.490 1.00 0.14 H new ATOM 0 H41 DC A 7 -1.153 5.096 1.231 1.00 0.14 H new ATOM 0 H42 DC A 7 0.238 5.638 2.176 1.00 0.14 H new ATOM 0 H5 DC A 7 -2.772 3.518 2.087 1.00 0.14 H new ATOM 0 H6 DC A 7 -3.386 2.129 4.001 1.00 0.14 H new ATOM 215 P DT A 8 -4.097 1.781 10.520 1.00 0.20 P ATOM 216 OP1 DT A 8 -3.844 0.674 11.468 1.00 0.26 O ATOM 217 OP2 DT A 8 -5.350 2.560 10.635 1.00 0.27 O ATOM 218 O5' DT A 8 -2.862 2.825 10.603 1.00 0.18 O ATOM 219 C5' DT A 8 -1.574 2.542 11.182 1.00 0.19 C ATOM 220 C4' DT A 8 -0.643 3.750 11.058 1.00 0.18 C ATOM 221 O4' DT A 8 -0.392 4.059 9.677 1.00 0.17 O ATOM 222 C3' DT A 8 -1.262 4.975 11.722 1.00 0.13 C ATOM 223 O3' DT A 8 -0.563 5.288 12.948 1.00 0.21 O ATOM 224 C2' DT A 8 -1.145 5.993 10.631 1.00 0.13 C ATOM 225 C1' DT A 8 -0.129 5.460 9.618 1.00 0.15 C ATOM 226 N1 DT A 8 -0.478 5.938 8.268 1.00 0.12 N ATOM 227 C2 DT A 8 0.420 6.568 7.449 1.00 0.14 C ATOM 228 O2 DT A 8 1.593 6.769 7.743 1.00 0.17 O ATOM 229 N3 DT A 8 -0.084 6.962 6.232 1.00 0.12 N ATOM 230 C4 DT A 8 -1.363 6.792 5.762 1.00 0.12 C ATOM 231 O4 DT A 8 -1.649 7.185 4.636 1.00 0.14 O ATOM 232 C5 DT A 8 -2.220 6.118 6.706 1.00 0.11 C ATOM 233 C7 DT A 8 -3.689 5.817 6.463 1.00 0.15 C ATOM 234 C6 DT A 8 -1.739 5.738 7.875 1.00 0.08 C ATOM 0 H5' DT A 8 -1.128 1.681 10.684 1.00 0.19 H new ATOM 0 H5'' DT A 8 -1.693 2.276 12.232 1.00 0.19 H new ATOM 0 H4' DT A 8 0.294 3.495 11.554 1.00 0.18 H new ATOM 0 H3' DT A 8 -2.294 4.876 12.059 1.00 0.13 H new ATOM 0 H2' DT A 8 -2.111 6.159 10.155 1.00 0.13 H new ATOM 0 H2'' DT A 8 -0.819 6.952 11.034 1.00 0.13 H new ATOM 0 H1' DT A 8 0.901 5.754 9.820 1.00 0.15 H new ATOM 0 H3 DT A 8 0.567 7.435 5.606 1.00 0.12 H new ATOM 0 H71 DT A 8 -4.114 6.580 5.811 1.00 0.15 H new ATOM 0 H72 DT A 8 -3.787 4.840 5.990 1.00 0.15 H new ATOM 0 H73 DT A 8 -4.222 5.814 7.414 1.00 0.15 H new ATOM 0 H6 DT A 8 -2.407 5.233 8.557 1.00 0.08 H new ATOM 247 P DA A 9 -0.160 6.748 13.542 1.00 0.21 P ATOM 248 OP1 DA A 9 0.262 6.567 14.948 1.00 0.30 O ATOM 249 OP2 DA A 9 -1.249 7.699 13.227 1.00 0.22 O ATOM 250 O5' DA A 9 1.140 7.176 12.676 1.00 0.23 O ATOM 251 C5' DA A 9 2.349 6.397 12.737 1.00 0.25 C ATOM 252 C4' DA A 9 3.561 7.030 12.053 1.00 0.22 C ATOM 253 O4' DA A 9 3.367 7.271 10.654 1.00 0.23 O ATOM 254 C3' DA A 9 3.993 8.302 12.707 1.00 0.22 C ATOM 255 O3' DA A 9 5.423 8.353 12.793 1.00 0.24 O ATOM 256 C2' DA A 9 3.359 9.258 11.809 1.00 0.24 C ATOM 257 C1' DA A 9 3.464 8.683 10.449 1.00 0.20 C ATOM 258 N9 DA A 9 2.325 9.059 9.613 1.00 0.17 N ATOM 259 C8 DA A 9 1.026 8.942 9.936 1.00 0.21 C ATOM 260 N7 DA A 9 0.175 9.301 8.955 1.00 0.17 N ATOM 261 C5 DA A 9 1.024 9.672 7.957 1.00 0.15 C ATOM 262 C6 DA A 9 0.800 10.148 6.663 1.00 0.15 C ATOM 263 N6 DA A 9 -0.422 10.301 6.172 1.00 0.17 N ATOM 264 N1 DA A 9 1.874 10.433 5.911 1.00 0.13 N ATOM 265 C2 DA A 9 3.092 10.252 6.413 1.00 0.14 C ATOM 266 N3 DA A 9 3.429 9.808 7.608 1.00 0.16 N ATOM 267 C4 DA A 9 2.333 9.535 8.338 1.00 0.16 C ATOM 0 H5' DA A 9 2.160 5.425 12.282 1.00 0.25 H new ATOM 0 H5'' DA A 9 2.595 6.216 13.784 1.00 0.25 H new ATOM 0 H4' DA A 9 4.348 6.284 12.165 1.00 0.22 H new ATOM 0 H3' DA A 9 3.708 8.469 13.746 1.00 0.22 H new ATOM 0 H2' DA A 9 2.316 9.418 12.084 1.00 0.24 H new ATOM 0 H2'' DA A 9 3.854 10.228 11.861 1.00 0.24 H new ATOM 0 H1' DA A 9 4.377 9.023 9.961 1.00 0.20 H new ATOM 0 H8 DA A 9 0.692 8.590 10.901 1.00 0.21 H new ATOM 0 H61 DA A 9 -0.550 10.651 5.223 1.00 0.17 H new ATOM 0 H62 DA A 9 -1.234 10.069 6.744 1.00 0.17 H new ATOM 0 H2 DA A 9 3.912 10.501 5.756 1.00 0.14 H new ATOM 279 P DC A 10 6.224 9.625 13.365 1.00 0.23 P ATOM 280 OP1 DC A 10 7.635 9.229 13.572 1.00 0.27 O ATOM 281 OP2 DC A 10 5.451 10.208 14.485 1.00 0.32 O ATOM 282 O5' DC A 10 6.146 10.630 12.105 1.00 0.20 O ATOM 283 C5' DC A 10 7.034 10.508 10.981 1.00 0.17 C ATOM 284 C4' DC A 10 6.800 11.605 9.952 1.00 0.16 C ATOM 285 O4' DC A 10 5.537 11.454 9.325 1.00 0.17 O ATOM 286 C3' DC A 10 6.831 12.971 10.632 1.00 0.19 C ATOM 287 O3' DC A 10 8.031 13.736 10.408 1.00 0.24 O ATOM 288 C2' DC A 10 5.616 13.601 10.065 1.00 0.18 C ATOM 289 C1' DC A 10 5.169 12.771 8.915 1.00 0.17 C ATOM 290 N1 DC A 10 3.712 12.741 8.836 1.00 0.17 N ATOM 291 C2 DC A 10 3.010 13.144 7.715 1.00 0.16 C ATOM 292 O2 DC A 10 3.556 13.605 6.717 1.00 0.20 O ATOM 293 N3 DC A 10 1.659 13.028 7.755 1.00 0.16 N ATOM 294 C4 DC A 10 1.037 12.543 8.835 1.00 0.18 C ATOM 295 N4 DC A 10 -0.285 12.460 8.764 1.00 0.22 N ATOM 296 C5 DC A 10 1.778 12.130 10.000 1.00 0.20 C ATOM 297 C6 DC A 10 3.100 12.259 9.927 1.00 0.19 C ATOM 0 H5' DC A 10 6.894 9.534 10.512 1.00 0.17 H new ATOM 0 H5'' DC A 10 8.067 10.550 11.328 1.00 0.17 H new ATOM 0 H4' DC A 10 7.589 11.530 9.204 1.00 0.16 H new ATOM 0 H3' DC A 10 6.839 12.903 11.720 1.00 0.19 H new ATOM 0 H2' DC A 10 4.831 13.664 10.819 1.00 0.18 H new ATOM 0 H2'' DC A 10 5.829 14.620 9.741 1.00 0.18 H new ATOM 0 H1' DC A 10 5.581 13.131 7.972 1.00 0.17 H new ATOM 0 H41 DC A 10 -0.817 12.098 9.556 1.00 0.22 H new ATOM 0 H42 DC A 10 -0.770 12.758 7.918 1.00 0.22 H new ATOM 0 H5 DC A 10 1.289 11.739 10.880 1.00 0.20 H new ATOM 0 H6 DC A 10 3.701 11.966 10.775 1.00 0.19 H new ATOM 309 P DC A 11 8.651 14.126 8.956 1.00 0.28 P ATOM 310 OP1 DC A 11 8.669 12.917 8.102 1.00 0.31 O ATOM 311 OP2 DC A 11 9.904 14.878 9.194 1.00 0.36 O ATOM 312 O5' DC A 11 7.573 15.156 8.336 1.00 0.28 O ATOM 313 C5' DC A 11 7.778 15.805 7.069 1.00 0.29 C ATOM 314 C4' DC A 11 6.664 16.806 6.761 1.00 0.26 C ATOM 315 O4' DC A 11 5.366 16.200 6.693 1.00 0.23 O ATOM 316 C3' DC A 11 6.536 17.833 7.864 1.00 0.27 C ATOM 317 O3' DC A 11 7.507 18.879 7.858 1.00 0.35 O ATOM 318 C2' DC A 11 5.107 18.298 7.721 1.00 0.27 C ATOM 319 C1' DC A 11 4.423 17.279 6.821 1.00 0.21 C ATOM 320 N1 DC A 11 3.216 16.785 7.498 1.00 0.20 N ATOM 321 C2 DC A 11 1.962 16.920 6.937 1.00 0.19 C ATOM 322 O2 DC A 11 1.786 17.451 5.846 1.00 0.19 O ATOM 323 N3 DC A 11 0.902 16.436 7.633 1.00 0.19 N ATOM 324 C4 DC A 11 1.066 15.846 8.822 1.00 0.19 C ATOM 325 N4 DC A 11 -0.011 15.405 9.457 1.00 0.21 N ATOM 326 C5 DC A 11 2.369 15.707 9.395 1.00 0.20 C ATOM 327 C6 DC A 11 3.389 16.194 8.693 1.00 0.20 C ATOM 0 H5' DC A 11 7.823 15.055 6.279 1.00 0.29 H new ATOM 0 H5'' DC A 11 8.739 16.320 7.075 1.00 0.29 H new ATOM 0 H4' DC A 11 6.948 17.239 5.802 1.00 0.26 H new ATOM 0 H3' DC A 11 6.751 17.405 8.843 1.00 0.27 H new ATOM 0 H2' DC A 11 4.615 18.353 8.692 1.00 0.27 H new ATOM 0 H2'' DC A 11 5.063 19.296 7.285 1.00 0.27 H new ATOM 0 HO3' DC A 11 7.336 19.488 8.606 1.00 0.35 H new ATOM 0 H1' DC A 11 4.139 17.697 5.855 1.00 0.21 H new ATOM 0 H41 DC A 11 0.083 14.951 10.365 1.00 0.21 H new ATOM 0 H42 DC A 11 -0.933 15.520 9.037 1.00 0.21 H new ATOM 0 H5 DC A 11 2.518 15.229 10.352 1.00 0.20 H new ATOM 0 H6 DC A 11 4.388 16.112 9.096 1.00 0.20 H new TER 340 DC A 11 ATOM 341 O5' DG B 12 -8.845 15.471 2.488 1.00 0.30 O ATOM 342 C5' DG B 12 -8.452 16.343 1.425 1.00 0.30 C ATOM 343 C4' DG B 12 -6.939 16.384 1.250 1.00 0.26 C ATOM 344 O4' DG B 12 -6.265 16.842 2.444 1.00 0.21 O ATOM 345 C3' DG B 12 -6.361 15.000 0.892 1.00 0.25 C ATOM 346 O3' DG B 12 -5.263 15.064 -0.026 1.00 0.26 O ATOM 347 C2' DG B 12 -5.811 14.633 2.229 1.00 0.22 C ATOM 348 C1' DG B 12 -5.189 15.930 2.679 1.00 0.18 C ATOM 349 N9 DG B 12 -4.782 15.828 4.078 1.00 0.13 N ATOM 350 C8 DG B 12 -5.520 15.435 5.137 1.00 0.12 C ATOM 351 N7 DG B 12 -4.832 15.426 6.301 1.00 0.09 N ATOM 352 C5 DG B 12 -3.591 15.842 5.926 1.00 0.09 C ATOM 353 C6 DG B 12 -2.417 16.038 6.704 1.00 0.11 C ATOM 354 O6 DG B 12 -2.230 15.870 7.906 1.00 0.16 O ATOM 355 N1 DG B 12 -1.363 16.471 5.933 1.00 0.12 N ATOM 356 C2 DG B 12 -1.413 16.695 4.580 1.00 0.10 C ATOM 357 N2 DG B 12 -0.308 17.105 3.991 1.00 0.12 N ATOM 358 N3 DG B 12 -2.495 16.519 3.837 1.00 0.10 N ATOM 359 C4 DG B 12 -3.543 16.092 4.576 1.00 0.09 C ATOM 0 H5' DG B 12 -8.821 17.349 1.626 1.00 0.30 H new ATOM 0 H5'' DG B 12 -8.916 16.013 0.495 1.00 0.30 H new ATOM 0 H4' DG B 12 -6.764 17.084 0.433 1.00 0.26 H new ATOM 0 H3' DG B 12 -7.088 14.335 0.426 1.00 0.25 H new ATOM 0 H2' DG B 12 -6.590 14.296 2.912 1.00 0.22 H new ATOM 0 H2'' DG B 12 -5.077 13.830 2.162 1.00 0.22 H new ATOM 0 HO5' DG B 12 -9.822 15.474 2.569 1.00 0.30 H new ATOM 0 H1' DG B 12 -4.274 16.232 2.168 1.00 0.18 H new ATOM 0 H8 DG B 12 -6.560 15.155 5.062 1.00 0.12 H new ATOM 0 H1 DG B 12 -0.474 16.639 6.404 1.00 0.12 H new ATOM 0 H21 DG B 12 -0.301 17.283 2.987 1.00 0.12 H new ATOM 0 H22 DG B 12 0.541 17.244 4.539 1.00 0.12 H new ATOM 372 P DG B 13 -5.406 15.440 -1.582 1.00 0.31 P ATOM 373 OP1 DG B 13 -6.003 16.791 -1.686 1.00 0.35 O ATOM 374 OP2 DG B 13 -6.045 14.299 -2.276 1.00 0.39 O ATOM 375 O5' DG B 13 -3.866 15.514 -2.041 1.00 0.26 O ATOM 376 C5' DG B 13 -3.002 16.655 -1.888 1.00 0.22 C ATOM 377 C4' DG B 13 -1.648 16.261 -1.298 1.00 0.16 C ATOM 378 O4' DG B 13 -1.655 16.042 0.120 1.00 0.18 O ATOM 379 C3' DG B 13 -1.053 15.037 -1.972 1.00 0.15 C ATOM 380 O3' DG B 13 0.262 15.259 -2.507 1.00 0.14 O ATOM 381 C2' DG B 13 -1.040 14.126 -0.820 1.00 0.15 C ATOM 382 C1' DG B 13 -0.751 14.963 0.361 1.00 0.14 C ATOM 383 N9 DG B 13 -1.092 14.327 1.632 1.00 0.13 N ATOM 384 C8 DG B 13 -2.267 13.753 1.950 1.00 0.14 C ATOM 385 N7 DG B 13 -2.323 13.302 3.225 1.00 0.14 N ATOM 386 C5 DG B 13 -1.093 13.617 3.718 1.00 0.12 C ATOM 387 C6 DG B 13 -0.535 13.396 5.011 1.00 0.13 C ATOM 388 O6 DG B 13 -1.037 12.897 6.013 1.00 0.17 O ATOM 389 N1 DG B 13 0.756 13.862 5.100 1.00 0.14 N ATOM 390 C2 DG B 13 1.447 14.473 4.084 1.00 0.14 C ATOM 391 N2 DG B 13 2.688 14.843 4.338 1.00 0.17 N ATOM 392 N3 DG B 13 0.943 14.694 2.874 1.00 0.13 N ATOM 393 C4 DG B 13 -0.327 14.241 2.761 1.00 0.11 C ATOM 0 H5' DG B 13 -3.481 17.391 -1.242 1.00 0.22 H new ATOM 0 H5'' DG B 13 -2.853 17.131 -2.857 1.00 0.22 H new ATOM 0 H4' DG B 13 -1.026 17.134 -1.496 1.00 0.16 H new ATOM 0 H3' DG B 13 -1.598 14.688 -2.849 1.00 0.15 H new ATOM 0 H2' DG B 13 -1.999 13.619 -0.713 1.00 0.15 H new ATOM 0 H2'' DG B 13 -0.283 13.352 -0.944 1.00 0.15 H new ATOM 0 H1' DG B 13 0.306 15.209 0.460 1.00 0.14 H new ATOM 0 H8 DG B 13 -3.088 13.661 1.254 1.00 0.14 H new ATOM 0 H1 DG B 13 1.238 13.744 5.991 1.00 0.14 H new ATOM 0 H21 DG B 13 3.242 15.301 3.614 1.00 0.17 H new ATOM 0 H22 DG B 13 3.093 14.671 5.258 1.00 0.17 H new ATOM 405 P DT B 14 1.096 14.106 -3.272 1.00 0.14 P ATOM 406 OP1 DT B 14 0.535 13.988 -4.637 1.00 0.22 O ATOM 407 OP2 DT B 14 1.151 12.906 -2.406 1.00 0.17 O ATOM 408 O5' DT B 14 2.584 14.728 -3.417 1.00 0.18 O ATOM 409 C5' DT B 14 3.456 15.226 -2.378 1.00 0.14 C ATOM 410 C4' DT B 14 3.908 14.194 -1.325 1.00 0.11 C ATOM 411 O4' DT B 14 2.962 13.853 -0.291 1.00 0.13 O ATOM 412 C3' DT B 14 4.473 12.904 -1.921 1.00 0.11 C ATOM 413 O3' DT B 14 5.894 12.774 -1.706 1.00 0.11 O ATOM 414 C2' DT B 14 3.549 11.947 -1.233 1.00 0.13 C ATOM 415 C1' DT B 14 3.339 12.538 0.140 1.00 0.11 C ATOM 416 N1 DT B 14 2.332 11.931 1.027 1.00 0.08 N ATOM 417 C2 DT B 14 2.576 11.769 2.383 1.00 0.10 C ATOM 418 O2 DT B 14 3.621 12.085 2.942 1.00 0.11 O ATOM 419 N3 DT B 14 1.546 11.215 3.110 1.00 0.09 N ATOM 420 C4 DT B 14 0.323 10.823 2.615 1.00 0.09 C ATOM 421 O4 DT B 14 -0.511 10.356 3.381 1.00 0.14 O ATOM 422 C5 DT B 14 0.182 11.037 1.193 1.00 0.09 C ATOM 423 C7 DT B 14 -1.069 10.703 0.415 1.00 0.13 C ATOM 424 C6 DT B 14 1.168 11.564 0.487 1.00 0.08 C ATOM 0 H5' DT B 14 2.948 16.042 -1.864 1.00 0.14 H new ATOM 0 H5'' DT B 14 4.344 15.649 -2.848 1.00 0.14 H new ATOM 0 H4' DT B 14 4.703 14.758 -0.837 1.00 0.11 H new ATOM 0 H3' DT B 14 4.475 12.780 -3.004 1.00 0.11 H new ATOM 0 H2' DT B 14 2.606 11.851 -1.771 1.00 0.13 H new ATOM 0 H2'' DT B 14 3.985 10.950 -1.173 1.00 0.13 H new ATOM 0 H1' DT B 14 4.204 12.417 0.791 1.00 0.11 H new ATOM 0 H3 DT B 14 1.704 11.083 4.109 1.00 0.09 H new ATOM 0 H71 DT B 14 -1.165 11.385 -0.430 1.00 0.13 H new ATOM 0 H72 DT B 14 -1.007 9.678 0.050 1.00 0.13 H new ATOM 0 H73 DT B 14 -1.939 10.805 1.064 1.00 0.13 H new ATOM 0 H6 DT B 14 1.025 11.704 -0.574 1.00 0.08 H new ATOM 437 P DA B 15 6.681 11.808 -0.666 1.00 0.06 P ATOM 438 OP1 DA B 15 8.117 11.833 -1.020 1.00 0.13 O ATOM 439 OP2 DA B 15 5.970 10.513 -0.617 1.00 0.12 O ATOM 440 O5' DA B 15 6.497 12.558 0.749 1.00 0.12 O ATOM 441 C5' DA B 15 7.418 12.506 1.858 1.00 0.13 C ATOM 442 C4' DA B 15 7.612 11.113 2.484 1.00 0.12 C ATOM 443 O4' DA B 15 6.332 10.550 2.796 1.00 0.12 O ATOM 444 C3' DA B 15 8.383 10.070 1.662 1.00 0.11 C ATOM 445 O3' DA B 15 9.575 9.724 2.373 1.00 0.15 O ATOM 446 C2' DA B 15 7.367 8.979 1.470 1.00 0.10 C ATOM 447 C1' DA B 15 6.368 9.140 2.577 1.00 0.10 C ATOM 448 N9 DA B 15 4.987 8.817 2.198 1.00 0.08 N ATOM 449 C8 DA B 15 4.375 8.908 0.991 1.00 0.08 C ATOM 450 N7 DA B 15 3.065 8.583 1.016 1.00 0.08 N ATOM 451 C5 DA B 15 2.861 8.270 2.321 1.00 0.09 C ATOM 452 C6 DA B 15 1.729 7.853 3.024 1.00 0.10 C ATOM 453 N6 DA B 15 0.527 7.687 2.481 1.00 0.11 N ATOM 454 N1 DA B 15 1.883 7.624 4.329 1.00 0.11 N ATOM 455 C2 DA B 15 3.060 7.790 4.915 1.00 0.12 C ATOM 456 N3 DA B 15 4.189 8.178 4.366 1.00 0.11 N ATOM 457 C4 DA B 15 4.015 8.403 3.049 1.00 0.09 C ATOM 0 H5' DA B 15 7.069 13.189 2.632 1.00 0.13 H new ATOM 0 H5'' DA B 15 8.387 12.874 1.522 1.00 0.13 H new ATOM 0 H4' DA B 15 8.235 11.314 3.356 1.00 0.12 H new ATOM 0 H3' DA B 15 8.755 10.381 0.686 1.00 0.11 H new ATOM 0 H2' DA B 15 6.886 9.062 0.496 1.00 0.10 H new ATOM 0 H2'' DA B 15 7.838 7.997 1.510 1.00 0.10 H new ATOM 0 H1' DA B 15 6.662 8.493 3.403 1.00 0.10 H new ATOM 0 H8 DA B 15 4.889 9.213 0.091 1.00 0.08 H new ATOM 0 H61 DA B 15 -0.255 7.379 3.058 1.00 0.11 H new ATOM 0 H62 DA B 15 0.387 7.868 1.487 1.00 0.11 H new ATOM 0 H2 DA B 15 3.096 7.581 5.974 1.00 0.12 H new ATOM 469 P DG B 16 10.835 8.923 1.760 1.00 0.15 P ATOM 470 OP1 DG B 16 12.077 9.602 2.194 1.00 0.26 O ATOM 471 OP2 DG B 16 10.594 8.664 0.322 1.00 0.19 O ATOM 472 O5' DG B 16 10.691 7.543 2.568 1.00 0.17 O ATOM 473 C5' DG B 16 10.716 7.492 4.007 1.00 0.16 C ATOM 474 C4' DG B 16 9.741 6.444 4.529 1.00 0.14 C ATOM 475 O4' DG B 16 8.378 6.748 4.198 1.00 0.15 O ATOM 476 C3' DG B 16 10.055 5.111 3.889 1.00 0.13 C ATOM 477 O3' DG B 16 11.059 4.411 4.643 1.00 0.14 O ATOM 478 C2' DG B 16 8.680 4.472 3.972 1.00 0.13 C ATOM 479 C1' DG B 16 7.682 5.521 4.439 1.00 0.14 C ATOM 480 N9 DG B 16 6.460 5.450 3.624 1.00 0.12 N ATOM 481 C8 DG B 16 6.417 5.588 2.289 1.00 0.12 C ATOM 482 N7 DG B 16 5.186 5.456 1.759 1.00 0.13 N ATOM 483 C5 DG B 16 4.409 5.219 2.848 1.00 0.12 C ATOM 484 C6 DG B 16 3.010 4.994 2.926 1.00 0.13 C ATOM 485 O6 DG B 16 2.172 4.972 2.030 1.00 0.14 O ATOM 486 N1 DG B 16 2.595 4.787 4.215 1.00 0.14 N ATOM 487 C2 DG B 16 3.400 4.793 5.323 1.00 0.14 C ATOM 488 N2 DG B 16 2.804 4.570 6.485 1.00 0.17 N ATOM 489 N3 DG B 16 4.718 5.006 5.273 1.00 0.14 N ATOM 490 C4 DG B 16 5.158 5.211 4.005 1.00 0.12 C ATOM 0 H5' DG B 16 10.458 8.470 4.414 1.00 0.16 H new ATOM 0 H5'' DG B 16 11.724 7.260 4.350 1.00 0.16 H new ATOM 0 H4' DG B 16 9.852 6.425 5.613 1.00 0.14 H new ATOM 0 H3' DG B 16 10.472 5.137 2.882 1.00 0.13 H new ATOM 0 H2' DG B 16 8.387 4.078 2.999 1.00 0.13 H new ATOM 0 H2'' DG B 16 8.696 3.630 4.665 1.00 0.13 H new ATOM 0 H1' DG B 16 7.368 5.401 5.476 1.00 0.14 H new ATOM 0 H8 DG B 16 7.294 5.788 1.692 1.00 0.12 H new ATOM 0 H1 DG B 16 1.601 4.613 4.362 1.00 0.14 H new ATOM 0 H21 DG B 16 3.351 4.562 7.346 1.00 0.17 H new ATOM 0 H22 DG B 16 1.798 4.406 6.519 1.00 0.17 H new ATOM 502 P DC B 17 11.840 3.086 4.127 1.00 0.12 P ATOM 503 OP1 DC B 17 13.035 2.891 4.979 1.00 0.17 O ATOM 504 OP2 DC B 17 11.995 3.180 2.657 1.00 0.17 O ATOM 505 O5' DC B 17 10.795 1.898 4.449 1.00 0.11 O ATOM 506 C5' DC B 17 10.297 1.705 5.782 1.00 0.12 C ATOM 507 C4' DC B 17 9.320 0.541 5.899 1.00 0.15 C ATOM 508 O4' DC B 17 8.242 0.634 4.954 1.00 0.16 O ATOM 509 C3' DC B 17 9.966 -0.819 5.613 1.00 0.15 C ATOM 510 O3' DC B 17 10.636 -1.460 6.717 1.00 0.16 O ATOM 511 C2' DC B 17 8.773 -1.636 5.152 1.00 0.17 C ATOM 512 C1' DC B 17 7.609 -0.655 4.971 1.00 0.16 C ATOM 513 N1 DC B 17 6.820 -0.903 3.734 1.00 0.15 N ATOM 514 C2 DC B 17 5.600 -1.561 3.852 1.00 0.14 C ATOM 515 O2 DC B 17 5.132 -1.899 4.934 1.00 0.14 O ATOM 516 N3 DC B 17 4.888 -1.816 2.732 1.00 0.14 N ATOM 517 C4 DC B 17 5.332 -1.447 1.533 1.00 0.16 C ATOM 518 N4 DC B 17 4.576 -1.739 0.481 1.00 0.17 N ATOM 519 C5 DC B 17 6.580 -0.764 1.380 1.00 0.17 C ATOM 520 C6 DC B 17 7.287 -0.513 2.502 1.00 0.16 C ATOM 0 H5' DC B 17 9.804 2.619 6.114 1.00 0.12 H new ATOM 0 H5'' DC B 17 11.137 1.534 6.455 1.00 0.12 H new ATOM 0 H4' DC B 17 8.971 0.607 6.929 1.00 0.15 H new ATOM 0 H3' DC B 17 10.783 -0.714 4.899 1.00 0.15 H new ATOM 0 H2' DC B 17 8.994 -2.150 4.217 1.00 0.17 H new ATOM 0 H2'' DC B 17 8.522 -2.402 5.885 1.00 0.17 H new ATOM 0 H1' DC B 17 6.872 -0.755 5.768 1.00 0.16 H new ATOM 0 H41 DC B 17 4.881 -1.473 -0.455 1.00 0.17 H new ATOM 0 H42 DC B 17 3.691 -2.229 0.610 1.00 0.17 H new ATOM 0 H5 DC B 17 6.941 -0.462 0.408 1.00 0.17 H new ATOM 0 H6 DC B 17 8.234 0.002 2.430 1.00 0.16 H new ATOM 532 P DG B 18 10.123 -1.521 8.253 1.00 0.15 P ATOM 533 OP1 DG B 18 10.217 -0.157 8.821 1.00 0.15 O ATOM 534 OP2 DG B 18 10.824 -2.640 8.923 1.00 0.18 O ATOM 535 O5' DG B 18 8.563 -1.925 8.114 1.00 0.16 O ATOM 536 C5' DG B 18 7.502 -1.081 8.600 1.00 0.13 C ATOM 537 C4' DG B 18 6.196 -1.813 8.797 1.00 0.11 C ATOM 538 O4' DG B 18 5.525 -2.262 7.613 1.00 0.12 O ATOM 539 C3' DG B 18 6.371 -3.024 9.716 1.00 0.12 C ATOM 540 O3' DG B 18 5.717 -2.819 10.984 1.00 0.13 O ATOM 541 C2' DG B 18 5.819 -4.110 8.831 1.00 0.12 C ATOM 542 C1' DG B 18 4.767 -3.416 8.004 1.00 0.11 C ATOM 543 N9 DG B 18 4.407 -4.156 6.790 1.00 0.10 N ATOM 544 C8 DG B 18 5.287 -4.677 5.918 1.00 0.12 C ATOM 545 N7 DG B 18 4.721 -5.268 4.848 1.00 0.12 N ATOM 546 C5 DG B 18 3.392 -5.105 5.079 1.00 0.11 C ATOM 547 C6 DG B 18 2.283 -5.522 4.298 1.00 0.11 C ATOM 548 O6 DG B 18 2.264 -6.112 3.222 1.00 0.13 O ATOM 549 N1 DG B 18 1.087 -5.172 4.877 1.00 0.10 N ATOM 550 C2 DG B 18 0.944 -4.499 6.060 1.00 0.10 C ATOM 551 N2 DG B 18 -0.298 -4.261 6.450 1.00 0.12 N ATOM 552 N3 DG B 18 1.974 -4.094 6.809 1.00 0.11 N ATOM 553 C4 DG B 18 3.168 -4.430 6.260 1.00 0.10 C ATOM 0 H5' DG B 18 7.349 -0.262 7.897 1.00 0.13 H new ATOM 0 H5'' DG B 18 7.807 -0.636 9.547 1.00 0.13 H new ATOM 0 H4' DG B 18 5.562 -1.044 9.239 1.00 0.11 H new ATOM 0 H3' DG B 18 7.383 -3.254 10.050 1.00 0.12 H new ATOM 0 H2' DG B 18 6.596 -4.545 8.203 1.00 0.12 H new ATOM 0 H2'' DG B 18 5.392 -4.923 9.418 1.00 0.12 H new ATOM 0 H1' DG B 18 3.827 -3.262 8.533 1.00 0.11 H new ATOM 0 H8 DG B 18 6.356 -4.626 6.063 1.00 0.12 H new ATOM 0 H1 DG B 18 0.234 -5.436 4.384 1.00 0.10 H new ATOM 0 H21 DG B 18 -0.472 -3.763 7.323 1.00 0.12 H new ATOM 0 H22 DG B 18 -1.081 -4.575 5.877 1.00 0.12 H new ATOM 565 P DA B 19 5.145 -3.984 11.950 1.00 0.15 P ATOM 566 OP1 DA B 19 5.100 -3.461 13.334 1.00 0.20 O ATOM 567 OP2 DA B 19 5.875 -5.240 11.661 1.00 0.19 O ATOM 568 O5' DA B 19 3.630 -4.153 11.416 1.00 0.16 O ATOM 569 C5' DA B 19 2.601 -3.179 11.685 1.00 0.18 C ATOM 570 C4' DA B 19 1.206 -3.818 11.703 1.00 0.17 C ATOM 571 O4' DA B 19 0.786 -4.319 10.423 1.00 0.15 O ATOM 572 C3' DA B 19 1.076 -4.923 12.725 1.00 0.18 C ATOM 573 O3' DA B 19 -0.193 -4.892 13.393 1.00 0.22 O ATOM 574 C2' DA B 19 1.302 -6.081 11.839 1.00 0.13 C ATOM 575 C1' DA B 19 0.626 -5.738 10.533 1.00 0.12 C ATOM 576 N9 DA B 19 1.352 -6.309 9.386 1.00 0.10 N ATOM 577 C8 DA B 19 2.683 -6.210 9.168 1.00 0.11 C ATOM 578 N7 DA B 19 3.102 -6.790 8.030 1.00 0.10 N ATOM 579 C5 DA B 19 1.954 -7.282 7.505 1.00 0.08 C ATOM 580 C6 DA B 19 1.704 -7.992 6.331 1.00 0.08 C ATOM 581 N6 DA B 19 2.682 -8.287 5.491 1.00 0.10 N ATOM 582 N1 DA B 19 0.441 -8.359 6.064 1.00 0.08 N ATOM 583 C2 DA B 19 -0.517 -8.028 6.928 1.00 0.10 C ATOM 584 N3 DA B 19 -0.409 -7.360 8.068 1.00 0.10 N ATOM 585 C4 DA B 19 0.872 -7.009 8.304 1.00 0.09 C ATOM 0 H5' DA B 19 2.633 -2.397 10.927 1.00 0.18 H new ATOM 0 H5'' DA B 19 2.795 -2.701 12.645 1.00 0.18 H new ATOM 0 H4' DA B 19 0.548 -2.995 11.983 1.00 0.17 H new ATOM 0 H3' DA B 19 1.754 -4.890 13.578 1.00 0.18 H new ATOM 0 H2' DA B 19 2.367 -6.259 11.693 1.00 0.13 H new ATOM 0 H2'' DA B 19 0.883 -6.990 12.269 1.00 0.13 H new ATOM 0 H1' DA B 19 -0.400 -6.105 10.524 1.00 0.12 H new ATOM 0 H8 DA B 19 3.353 -5.708 9.850 1.00 0.11 H new ATOM 0 H61 DA B 19 2.481 -8.807 4.637 1.00 0.10 H new ATOM 0 H62 DA B 19 3.637 -7.994 5.697 1.00 0.10 H new ATOM 0 H2 DA B 19 -1.515 -8.346 6.665 1.00 0.10 H new ATOM 597 P DT B 20 -0.639 -5.951 14.530 1.00 0.26 P ATOM 598 OP1 DT B 20 -1.732 -5.331 15.313 1.00 0.33 O ATOM 599 OP2 DT B 20 0.575 -6.438 15.226 1.00 0.30 O ATOM 600 O5' DT B 20 -1.251 -7.166 13.664 1.00 0.24 O ATOM 601 C5' DT B 20 -2.508 -7.028 12.977 1.00 0.23 C ATOM 602 C4' DT B 20 -2.828 -8.228 12.083 1.00 0.20 C ATOM 603 O4' DT B 20 -1.901 -8.377 10.994 1.00 0.19 O ATOM 604 C3' DT B 20 -2.929 -9.538 12.839 1.00 0.21 C ATOM 605 O3' DT B 20 -4.188 -10.169 12.576 1.00 0.22 O ATOM 606 C2' DT B 20 -1.725 -10.256 12.258 1.00 0.16 C ATOM 607 C1' DT B 20 -1.670 -9.776 10.810 1.00 0.15 C ATOM 608 N1 DT B 20 -0.375 -9.932 10.106 1.00 0.12 N ATOM 609 C2 DT B 20 -0.360 -10.471 8.832 1.00 0.11 C ATOM 610 O2 DT B 20 -1.361 -10.865 8.241 1.00 0.14 O ATOM 611 N3 DT B 20 0.876 -10.551 8.232 1.00 0.10 N ATOM 612 C4 DT B 20 2.076 -10.153 8.768 1.00 0.09 C ATOM 613 O4 DT B 20 3.096 -10.286 8.099 1.00 0.11 O ATOM 614 C5 DT B 20 1.962 -9.605 10.100 1.00 0.09 C ATOM 615 C7 DT B 20 3.155 -9.086 10.887 1.00 0.11 C ATOM 616 C6 DT B 20 0.777 -9.521 10.696 1.00 0.12 C ATOM 0 H5' DT B 20 -2.488 -6.123 12.370 1.00 0.23 H new ATOM 0 H5'' DT B 20 -3.306 -6.903 13.709 1.00 0.23 H new ATOM 0 H4' DT B 20 -3.813 -7.998 11.676 1.00 0.20 H new ATOM 0 H3' DT B 20 -2.910 -9.487 13.928 1.00 0.21 H new ATOM 0 H2' DT B 20 -0.812 -10.004 12.797 1.00 0.16 H new ATOM 0 H2'' DT B 20 -1.840 -11.338 12.315 1.00 0.16 H new ATOM 0 H1' DT B 20 -2.363 -10.348 10.193 1.00 0.15 H new ATOM 0 H3 DT B 20 0.904 -10.947 7.292 1.00 0.10 H new ATOM 0 H71 DT B 20 2.831 -8.289 11.556 1.00 0.11 H new ATOM 0 H72 DT B 20 3.586 -9.898 11.473 1.00 0.11 H new ATOM 0 H73 DT B 20 3.905 -8.699 10.197 1.00 0.11 H new ATOM 0 H6 DT B 20 0.728 -9.108 11.693 1.00 0.12 H new ATOM 629 P DG B 21 -4.635 -11.494 13.375 1.00 0.26 P ATOM 630 OP1 DG B 21 -6.102 -11.648 13.238 1.00 0.32 O ATOM 631 OP2 DG B 21 -4.025 -11.461 14.724 1.00 0.32 O ATOM 632 O5' DG B 21 -3.901 -12.638 12.512 1.00 0.24 O ATOM 633 C5' DG B 21 -4.498 -13.172 11.322 1.00 0.30 C ATOM 634 C4' DG B 21 -3.579 -14.124 10.565 1.00 0.27 C ATOM 635 O4' DG B 21 -2.464 -13.513 9.908 1.00 0.23 O ATOM 636 C3' DG B 21 -3.019 -15.237 11.452 1.00 0.22 C ATOM 637 O3' DG B 21 -3.825 -16.429 11.360 1.00 0.28 O ATOM 638 C2' DG B 21 -1.587 -15.319 10.943 1.00 0.17 C ATOM 639 C1' DG B 21 -1.580 -14.607 9.627 1.00 0.17 C ATOM 640 N9 DG B 21 -0.253 -14.083 9.310 1.00 0.14 N ATOM 641 C8 DG B 21 0.506 -13.305 10.100 1.00 0.14 C ATOM 642 N7 DG B 21 1.698 -12.975 9.552 1.00 0.12 N ATOM 643 C5 DG B 21 1.660 -13.592 8.339 1.00 0.11 C ATOM 644 C6 DG B 21 2.627 -13.618 7.292 1.00 0.11 C ATOM 645 O6 DG B 21 3.733 -13.090 7.220 1.00 0.13 O ATOM 646 N1 DG B 21 2.196 -14.364 6.219 1.00 0.11 N ATOM 647 C2 DG B 21 0.990 -15.013 6.143 1.00 0.11 C ATOM 648 N2 DG B 21 0.747 -15.696 5.040 1.00 0.12 N ATOM 649 N3 DG B 21 0.076 -15.002 7.106 1.00 0.12 N ATOM 650 C4 DG B 21 0.477 -14.273 8.172 1.00 0.12 C ATOM 0 H5' DG B 21 -4.780 -12.350 10.664 1.00 0.30 H new ATOM 0 H5'' DG B 21 -5.415 -13.697 11.588 1.00 0.30 H new ATOM 0 H4' DG B 21 -4.248 -14.523 9.803 1.00 0.27 H new ATOM 0 H3' DG B 21 -3.036 -15.069 12.529 1.00 0.22 H new ATOM 0 H2' DG B 21 -0.896 -14.851 11.644 1.00 0.17 H new ATOM 0 H2'' DG B 21 -1.272 -16.356 10.828 1.00 0.17 H new ATOM 0 H1' DG B 21 -1.861 -15.240 8.785 1.00 0.17 H new ATOM 0 H8 DG B 21 0.194 -12.974 11.080 1.00 0.14 H new ATOM 0 H1 DG B 21 2.822 -14.440 5.418 1.00 0.11 H new ATOM 0 H21 DG B 21 -0.135 -16.196 4.934 1.00 0.12 H new ATOM 0 H22 DG B 21 1.442 -15.723 4.294 1.00 0.12 H new ATOM 662 P DG B 22 -3.298 -17.956 11.257 1.00 0.29 P ATOM 663 OP1 DG B 22 -4.444 -18.863 11.498 1.00 0.38 O ATOM 664 OP2 DG B 22 -2.068 -18.096 12.068 1.00 0.32 O ATOM 665 O5' DG B 22 -2.876 -18.078 9.699 1.00 0.21 O ATOM 666 C5' DG B 22 -3.838 -17.992 8.629 1.00 0.20 C ATOM 667 C4' DG B 22 -3.433 -18.799 7.381 1.00 0.19 C ATOM 668 O4' DG B 22 -2.239 -18.315 6.738 1.00 0.20 O ATOM 669 C3' DG B 22 -3.218 -20.262 7.643 1.00 0.20 C ATOM 670 O3' DG B 22 -3.393 -20.992 6.431 1.00 0.20 O ATOM 671 C2' DG B 22 -1.790 -20.210 8.001 1.00 0.21 C ATOM 672 C1' DG B 22 -1.184 -19.252 7.008 1.00 0.20 C ATOM 673 N9 DG B 22 -0.052 -18.512 7.580 1.00 0.18 N ATOM 674 C8 DG B 22 0.037 -17.957 8.815 1.00 0.18 C ATOM 675 N7 DG B 22 1.199 -17.313 9.040 1.00 0.18 N ATOM 676 C5 DG B 22 1.873 -17.480 7.873 1.00 0.17 C ATOM 677 C6 DG B 22 3.161 -17.022 7.502 1.00 0.17 C ATOM 678 O6 DG B 22 3.968 -16.352 8.139 1.00 0.17 O ATOM 679 N1 DG B 22 3.491 -17.402 6.223 1.00 0.16 N ATOM 680 C2 DG B 22 2.693 -18.134 5.380 1.00 0.17 C ATOM 681 N2 DG B 22 3.177 -18.412 4.183 1.00 0.17 N ATOM 682 N3 DG B 22 1.480 -18.570 5.707 1.00 0.17 N ATOM 683 C4 DG B 22 1.134 -18.207 6.968 1.00 0.17 C ATOM 0 H5' DG B 22 -3.969 -16.946 8.351 1.00 0.20 H new ATOM 0 H5'' DG B 22 -4.803 -18.350 8.987 1.00 0.20 H new ATOM 0 H4' DG B 22 -4.294 -18.660 6.728 1.00 0.19 H new ATOM 0 H3' DG B 22 -3.877 -20.728 8.375 1.00 0.20 H new ATOM 0 H2' DG B 22 -1.650 -19.861 9.024 1.00 0.21 H new ATOM 0 H2'' DG B 22 -1.328 -21.195 7.934 1.00 0.21 H new ATOM 0 HO3' DG B 22 -3.251 -21.947 6.601 1.00 0.20 H new ATOM 0 H1' DG B 22 -0.812 -19.782 6.131 1.00 0.20 H new ATOM 0 H8 DG B 22 -0.751 -18.025 9.550 1.00 0.18 H new ATOM 0 H1 DG B 22 4.405 -17.116 5.871 1.00 0.16 H new ATOM 0 H21 DG B 22 2.621 -18.954 3.521 1.00 0.17 H new ATOM 0 H22 DG B 22 4.107 -18.085 3.920 1.00 0.17 H new TER 696 DG B 22 HETATM 697 C1 BPJ A 25 1.710 -0.468 6.449 1.00 0.12 C HETATM 698 C2 BPJ A 25 1.419 -1.006 7.883 1.00 0.12 C HETATM 699 O2 BPJ A 25 0.293 -1.874 8.081 1.00 0.15 O HETATM 700 C3 BPJ A 25 1.274 0.224 8.833 1.00 0.13 C HETATM 701 O3 BPJ A 25 0.347 1.231 8.382 1.00 0.16 O HETATM 702 C4 BPJ A 25 2.698 0.842 8.930 1.00 0.12 C HETATM 703 O4 BPJ A 25 3.477 -0.044 9.727 1.00 0.14 O HETATM 704 C5 BPJ A 25 4.559 1.732 7.634 1.00 0.13 C HETATM 705 C6 BPJ A 25 5.203 2.021 6.429 1.00 0.13 C HETATM 706 C7 BPJ A 25 5.285 2.025 4.085 1.00 0.14 C HETATM 707 C8 BPJ A 25 4.756 1.776 2.807 1.00 0.14 C HETATM 708 C9 BPJ A 25 2.830 1.318 1.405 1.00 0.14 C HETATM 709 C10 BPJ A 25 1.444 1.122 1.263 1.00 0.14 C HETATM 710 C11 BPJ A 25 0.643 1.016 2.414 1.00 0.12 C HETATM 711 C12 BPJ A 25 1.232 1.079 3.688 1.00 0.11 C HETATM 712 C13 BPJ A 25 2.714 0.597 6.404 1.00 0.11 C HETATM 713 C14 BPJ A 25 3.331 1.020 7.639 1.00 0.12 C HETATM 714 C15 BPJ A 25 4.554 1.726 5.230 1.00 0.12 C HETATM 715 C16 BPJ A 25 3.268 1.141 5.178 1.00 0.11 C HETATM 716 C17 BPJ A 25 2.635 1.201 3.886 1.00 0.11 C HETATM 717 C18 BPJ A 25 3.402 1.398 2.694 1.00 0.12 C HETATM 0 H11A BPJ A 25 0.781 -0.096 6.016 1.00 0.12 H new HETATM 0 HO4 BPJ A 25 4.164 0.465 10.206 1.00 0.14 H new HETATM 0 HO3 BPJ A 25 0.714 2.120 8.569 1.00 0.16 H new HETATM 0 HO2 BPJ A 25 0.239 -2.130 9.026 1.00 0.15 H new HETATM 0 H9 BPJ A 25 3.462 1.408 0.521 1.00 0.14 H new HETATM 0 H8 BPJ A 25 5.381 1.873 1.919 1.00 0.14 H new HETATM 0 H7 BPJ A 25 6.281 2.458 4.180 1.00 0.14 H new HETATM 0 H6 BPJ A 25 6.196 2.470 6.425 1.00 0.13 H new HETATM 0 H5 BPJ A 25 5.002 2.055 8.576 1.00 0.13 H new HETATM 0 H4 BPJ A 25 2.622 1.838 9.367 1.00 0.12 H new HETATM 0 H3 BPJ A 25 0.869 -0.118 9.786 1.00 0.13 H new HETATM 0 H2 BPJ A 25 2.268 -1.656 8.096 1.00 0.12 H new HETATM 0 H12 BPJ A 25 0.585 1.032 4.564 1.00 0.11 H new HETATM 0 H11 BPJ A 25 -0.435 0.885 2.318 1.00 0.12 H new HETATM 0 H10 BPJ A 25 0.996 1.053 0.272 1.00 0.14 H new