USER MOD reduce.3.24.130724 H: found=0, std=0, add=261, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 261 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 DA O5' : rot -75:sc= 1.09 USER MOD Single : A 5 DT C7 :methyl -30:sc= -0.148 (180deg=-2.43!) USER MOD Single : A 6 DT C7 :methyl 150:sc= -1.71 (180deg=-1.71) USER MOD Single : A 11 DT C7 :methyl -30:sc= -2.72! (180deg=-7.25!) USER MOD Single : A 12 DT C7 :methyl -30:sc= -1.61 (180deg=-3.4!) USER MOD Single : A 17 DT C7 :methyl -30:sc= 0 (180deg=-0.129) USER MOD Single : A 18 DT C7 :methyl 150:sc= -2.61! (180deg=-2.61!) USER MOD Single : A 23 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 -5.770 2.973 6.989 1.00 0.30 O ATOM 2 C5' DA A 1 -4.773 3.079 8.009 1.00 0.16 C ATOM 3 C4' DA A 1 -3.938 4.348 7.848 1.00 0.15 C ATOM 4 O4' DA A 1 -4.778 5.525 7.880 1.00 0.18 O ATOM 5 C3' DA A 1 -2.903 4.475 8.965 1.00 0.12 C ATOM 6 O3' DA A 1 -1.570 4.495 8.434 1.00 0.15 O ATOM 7 C2' DA A 1 -3.218 5.775 9.652 1.00 0.14 C ATOM 8 C1' DA A 1 -4.227 6.497 8.788 1.00 0.14 C ATOM 9 N9 DA A 1 -5.285 7.109 9.611 1.00 0.13 N ATOM 10 C8 DA A 1 -6.513 6.635 9.927 1.00 0.14 C ATOM 11 N7 DA A 1 -7.265 7.374 10.673 1.00 0.13 N ATOM 12 C5 DA A 1 -6.442 8.484 10.887 1.00 0.10 C ATOM 13 C6 DA A 1 -6.619 9.671 11.607 1.00 0.11 C ATOM 14 N6 DA A 1 -7.735 9.957 12.277 1.00 0.14 N ATOM 15 N1 DA A 1 -5.603 10.552 11.608 1.00 0.12 N ATOM 16 C2 DA A 1 -4.477 10.286 10.942 1.00 0.13 C ATOM 17 N3 DA A 1 -4.203 9.196 10.230 1.00 0.13 N ATOM 18 C4 DA A 1 -5.235 8.329 10.244 1.00 0.10 C ATOM 0 H5' DA A 1 -4.121 2.206 7.973 1.00 0.16 H new ATOM 0 H5'' DA A 1 -5.252 3.079 8.988 1.00 0.16 H new ATOM 0 H4' DA A 1 -3.433 4.274 6.885 1.00 0.15 H new ATOM 0 H3' DA A 1 -2.948 3.629 9.650 1.00 0.12 H new ATOM 0 H2' DA A 1 -3.621 5.597 10.649 1.00 0.14 H new ATOM 0 H2'' DA A 1 -2.316 6.375 9.775 1.00 0.14 H new ATOM 0 HO5' DA A 1 -6.499 3.601 7.177 1.00 0.30 H new ATOM 0 H1' DA A 1 -3.750 7.309 8.238 1.00 0.14 H new ATOM 0 H8 DA A 1 -6.851 5.674 9.568 1.00 0.14 H new ATOM 0 H61 DA A 1 -7.813 10.837 12.786 1.00 0.14 H new ATOM 0 H62 DA A 1 -8.511 9.295 12.281 1.00 0.14 H new ATOM 0 H2 DA A 1 -3.703 11.038 10.986 1.00 0.13 H new ATOM 31 P DG A 2 -1.043 3.330 7.450 1.00 0.17 P ATOM 32 OP1 DG A 2 0.310 3.702 6.980 1.00 0.17 O ATOM 33 OP2 DG A 2 -2.107 3.031 6.467 1.00 0.22 O ATOM 34 O5' DG A 2 -0.899 2.065 8.434 1.00 0.21 O ATOM 35 C5' DG A 2 -1.292 0.756 7.997 1.00 0.23 C ATOM 36 C4' DG A 2 -0.470 -0.348 8.649 1.00 0.18 C ATOM 37 O4' DG A 2 -0.949 -1.649 8.242 1.00 0.20 O ATOM 38 C3' DG A 2 1.005 -0.241 8.266 1.00 0.17 C ATOM 39 O3' DG A 2 1.806 0.052 9.416 1.00 0.17 O ATOM 40 C2' DG A 2 1.370 -1.577 7.683 1.00 0.22 C ATOM 41 C1' DG A 2 0.089 -2.374 7.549 1.00 0.22 C ATOM 42 N9 DG A 2 -0.266 -2.554 6.129 1.00 0.19 N ATOM 43 C8 DG A 2 -0.511 -3.690 5.431 1.00 0.17 C ATOM 44 N7 DG A 2 -0.807 -3.571 4.179 1.00 0.14 N ATOM 45 C5 DG A 2 -0.757 -2.184 4.006 1.00 0.12 C ATOM 46 C6 DG A 2 -0.989 -1.400 2.842 1.00 0.12 C ATOM 47 O6 DG A 2 -1.289 -1.780 1.715 1.00 0.11 O ATOM 48 N1 DG A 2 -0.836 -0.045 3.102 1.00 0.13 N ATOM 49 C2 DG A 2 -0.503 0.495 4.328 1.00 0.14 C ATOM 50 N2 DG A 2 -0.416 1.820 4.380 1.00 0.13 N ATOM 51 N3 DG A 2 -0.284 -0.232 5.425 1.00 0.16 N ATOM 52 C4 DG A 2 -0.427 -1.555 5.196 1.00 0.15 C ATOM 0 H5' DG A 2 -1.187 0.691 6.914 1.00 0.23 H new ATOM 0 H5'' DG A 2 -2.347 0.602 8.225 1.00 0.23 H new ATOM 0 H4' DG A 2 -0.576 -0.230 9.727 1.00 0.18 H new ATOM 0 H3' DG A 2 1.179 0.566 7.554 1.00 0.17 H new ATOM 0 H2' DG A 2 1.850 -1.455 6.712 1.00 0.22 H new ATOM 0 H2'' DG A 2 2.080 -2.096 8.326 1.00 0.22 H new ATOM 0 H1' DG A 2 0.214 -3.367 7.981 1.00 0.22 H new ATOM 0 H8 DG A 2 -0.461 -4.659 5.904 1.00 0.17 H new ATOM 0 H1 DG A 2 -0.981 0.602 2.327 1.00 0.13 H new ATOM 0 H21 DG A 2 -0.174 2.281 5.257 1.00 0.13 H new ATOM 0 H22 DG A 2 -0.592 2.376 3.543 1.00 0.13 H new ATOM 64 P DG A 3 3.414 0.040 9.322 1.00 0.16 P ATOM 65 OP1 DG A 3 3.943 0.974 10.340 1.00 0.15 O ATOM 66 OP2 DG A 3 3.795 0.203 7.901 1.00 0.20 O ATOM 67 O5' DG A 3 3.787 -1.462 9.773 1.00 0.22 O ATOM 68 C5' DG A 3 4.992 -2.084 9.300 1.00 0.20 C ATOM 69 C4' DG A 3 4.714 -3.171 8.265 1.00 0.11 C ATOM 70 O4' DG A 3 3.729 -2.736 7.303 1.00 0.10 O ATOM 71 C3' DG A 3 5.977 -3.553 7.498 1.00 0.13 C ATOM 72 O3' DG A 3 6.454 -4.840 7.902 1.00 0.10 O ATOM 73 C2' DG A 3 5.575 -3.555 6.045 1.00 0.16 C ATOM 74 C1' DG A 3 4.107 -3.181 5.985 1.00 0.07 C ATOM 75 N9 DG A 3 3.869 -2.122 4.982 1.00 0.12 N ATOM 76 C8 DG A 3 3.956 -0.775 5.109 1.00 0.14 C ATOM 77 N7 DG A 3 3.702 -0.057 4.068 1.00 0.11 N ATOM 78 C5 DG A 3 3.405 -1.031 3.114 1.00 0.08 C ATOM 79 C6 DG A 3 3.042 -0.881 1.752 1.00 0.06 C ATOM 80 O6 DG A 3 2.910 0.158 1.110 1.00 0.08 O ATOM 81 N1 DG A 3 2.827 -2.111 1.143 1.00 0.05 N ATOM 82 C2 DG A 3 2.945 -3.337 1.767 1.00 0.07 C ATOM 83 N2 DG A 3 2.690 -4.407 1.015 1.00 0.08 N ATOM 84 N3 DG A 3 3.289 -3.488 3.052 1.00 0.09 N ATOM 85 C4 DG A 3 3.503 -2.301 3.664 1.00 0.10 C ATOM 0 H5' DG A 3 5.530 -2.517 10.143 1.00 0.20 H new ATOM 0 H5'' DG A 3 5.642 -1.326 8.862 1.00 0.20 H new ATOM 0 H4' DG A 3 4.344 -4.033 8.820 1.00 0.11 H new ATOM 0 H3' DG A 3 6.793 -2.856 7.690 1.00 0.13 H new ATOM 0 H2' DG A 3 6.177 -2.844 5.479 1.00 0.16 H new ATOM 0 H2'' DG A 3 5.740 -4.537 5.602 1.00 0.16 H new ATOM 0 H1' DG A 3 3.507 -4.039 5.682 1.00 0.07 H new ATOM 0 H8 DG A 3 4.229 -0.319 6.049 1.00 0.14 H new ATOM 0 H1 DG A 3 2.561 -2.108 0.158 1.00 0.05 H new ATOM 0 H21 DG A 3 2.760 -5.342 1.418 1.00 0.08 H new ATOM 0 H22 DG A 3 2.425 -4.291 0.037 1.00 0.08 H new ATOM 97 P DG A 4 8.034 -5.155 7.924 1.00 0.12 P ATOM 98 OP1 DG A 4 8.248 -6.401 8.693 1.00 0.13 O ATOM 99 OP2 DG A 4 8.747 -3.917 8.312 1.00 0.15 O ATOM 100 O5' DG A 4 8.356 -5.456 6.376 1.00 0.15 O ATOM 101 C5' DG A 4 7.871 -6.655 5.758 1.00 0.15 C ATOM 102 C4' DG A 4 8.020 -6.636 4.243 1.00 0.09 C ATOM 103 O4' DG A 4 7.345 -5.486 3.677 1.00 0.12 O ATOM 104 C3' DG A 4 9.485 -6.576 3.825 1.00 0.05 C ATOM 105 O3' DG A 4 9.762 -7.632 2.880 1.00 0.09 O ATOM 106 C2' DG A 4 9.662 -5.204 3.231 1.00 0.10 C ATOM 107 C1' DG A 4 8.282 -4.685 2.927 1.00 0.09 C ATOM 108 N9 DG A 4 8.154 -3.258 3.261 1.00 0.09 N ATOM 109 C8 DG A 4 8.468 -2.596 4.393 1.00 0.13 C ATOM 110 N7 DG A 4 8.304 -1.312 4.401 1.00 0.14 N ATOM 111 C5 DG A 4 7.811 -1.083 3.110 1.00 0.10 C ATOM 112 C6 DG A 4 7.423 0.131 2.473 1.00 0.11 C ATOM 113 O6 DG A 4 7.449 1.272 2.926 1.00 0.11 O ATOM 114 N1 DG A 4 6.980 -0.097 1.171 1.00 0.14 N ATOM 115 C2 DG A 4 6.919 -1.341 0.563 1.00 0.15 C ATOM 116 N2 DG A 4 6.443 -1.393 -0.677 1.00 0.16 N ATOM 117 N3 DG A 4 7.286 -2.471 1.157 1.00 0.13 N ATOM 118 C4 DG A 4 7.717 -2.275 2.415 1.00 0.09 C ATOM 0 H5' DG A 4 6.820 -6.792 6.014 1.00 0.15 H new ATOM 0 H5'' DG A 4 8.411 -7.511 6.162 1.00 0.15 H new ATOM 0 H4' DG A 4 7.574 -7.559 3.872 1.00 0.09 H new ATOM 0 H3' DG A 4 10.180 -6.726 4.651 1.00 0.05 H new ATOM 0 H2' DG A 4 10.179 -4.544 3.928 1.00 0.10 H new ATOM 0 H2'' DG A 4 10.267 -5.249 2.325 1.00 0.10 H new ATOM 0 H1' DG A 4 8.079 -4.764 1.859 1.00 0.09 H new ATOM 0 H8 DG A 4 8.843 -3.118 5.261 1.00 0.13 H new ATOM 0 H1 DG A 4 6.679 0.711 0.626 1.00 0.14 H new ATOM 0 H21 DG A 4 6.381 -2.288 -1.162 1.00 0.16 H new ATOM 0 H22 DG A 4 6.140 -0.538 -1.143 1.00 0.16 H new ATOM 130 P DT A 5 10.280 -7.350 1.376 1.00 0.12 P ATOM 131 OP1 DT A 5 10.122 -8.596 0.594 1.00 0.21 O ATOM 132 OP2 DT A 5 11.606 -6.698 1.459 1.00 0.08 O ATOM 133 O5' DT A 5 9.223 -6.268 0.816 1.00 0.22 O ATOM 134 C5' DT A 5 9.618 -5.350 -0.210 1.00 0.14 C ATOM 135 C4' DT A 5 9.363 -5.919 -1.610 1.00 0.11 C ATOM 136 O4' DT A 5 9.073 -7.332 -1.547 1.00 0.13 O ATOM 137 C3' DT A 5 8.182 -5.243 -2.310 1.00 0.10 C ATOM 138 O3' DT A 5 8.630 -4.231 -3.222 1.00 0.10 O ATOM 139 C2' DT A 5 7.481 -6.349 -3.029 1.00 0.13 C ATOM 140 C1' DT A 5 7.918 -7.635 -2.366 1.00 0.10 C ATOM 141 N1 DT A 5 6.817 -8.177 -1.541 1.00 0.11 N ATOM 142 C2 DT A 5 6.273 -9.396 -1.903 1.00 0.18 C ATOM 143 O2 DT A 5 6.707 -10.054 -2.846 1.00 0.22 O ATOM 144 N3 DT A 5 5.205 -9.833 -1.137 1.00 0.21 N ATOM 145 C4 DT A 5 4.646 -9.165 -0.060 1.00 0.18 C ATOM 146 O4 DT A 5 3.694 -9.646 0.550 1.00 0.23 O ATOM 147 C5 DT A 5 5.282 -7.902 0.242 1.00 0.10 C ATOM 148 C7 DT A 5 4.742 -7.034 1.378 1.00 0.09 C ATOM 149 C6 DT A 5 6.326 -7.459 -0.484 1.00 0.08 C ATOM 0 H5' DT A 5 10.677 -5.115 -0.100 1.00 0.14 H new ATOM 0 H5'' DT A 5 9.070 -4.415 -0.092 1.00 0.14 H new ATOM 0 H4' DT A 5 10.276 -5.732 -2.176 1.00 0.11 H new ATOM 0 H3' DT A 5 7.525 -4.734 -1.605 1.00 0.10 H new ATOM 0 H2' DT A 5 6.400 -6.228 -2.967 1.00 0.13 H new ATOM 0 H2'' DT A 5 7.741 -6.350 -4.087 1.00 0.13 H new ATOM 0 H1' DT A 5 8.175 -8.389 -3.110 1.00 0.10 H new ATOM 0 H3 DT A 5 4.791 -10.731 -1.390 1.00 0.21 H new ATOM 0 H71 DT A 5 3.669 -7.197 1.482 1.00 0.09 H new ATOM 0 H72 DT A 5 5.241 -7.301 2.309 1.00 0.09 H new ATOM 0 H73 DT A 5 4.930 -5.984 1.154 1.00 0.09 H new ATOM 0 H6 DT A 5 6.786 -6.516 -0.227 1.00 0.08 H new ATOM 162 P DT A 6 9.740 -4.569 -4.345 1.00 0.19 P ATOM 163 OP1 DT A 6 9.509 -5.951 -4.823 1.00 0.40 O ATOM 164 OP2 DT A 6 11.066 -4.184 -3.815 1.00 0.30 O ATOM 165 O5' DT A 6 9.358 -3.556 -5.534 1.00 0.13 O ATOM 166 C5' DT A 6 8.143 -3.726 -6.262 1.00 0.20 C ATOM 167 C4' DT A 6 7.561 -2.387 -6.701 1.00 0.19 C ATOM 168 O4' DT A 6 7.365 -1.520 -5.562 1.00 0.20 O ATOM 169 C3' DT A 6 8.474 -1.681 -7.691 1.00 0.15 C ATOM 170 O3' DT A 6 7.812 -1.498 -8.950 1.00 0.15 O ATOM 171 C2' DT A 6 8.822 -0.361 -7.062 1.00 0.15 C ATOM 172 C1' DT A 6 8.096 -0.288 -5.731 1.00 0.19 C ATOM 173 N1 DT A 6 9.047 -0.090 -4.617 1.00 0.17 N ATOM 174 C2 DT A 6 9.584 1.173 -4.458 1.00 0.21 C ATOM 175 O2 DT A 6 9.302 2.103 -5.210 1.00 0.23 O ATOM 176 N3 DT A 6 10.460 1.330 -3.400 1.00 0.27 N ATOM 177 C4 DT A 6 10.840 0.348 -2.501 1.00 0.28 C ATOM 178 O4 DT A 6 11.625 0.602 -1.590 1.00 0.37 O ATOM 179 C5 DT A 6 10.231 -0.940 -2.744 1.00 0.22 C ATOM 180 C7 DT A 6 10.569 -2.118 -1.828 1.00 0.20 C ATOM 181 C6 DT A 6 9.371 -1.119 -3.771 1.00 0.17 C ATOM 0 H5' DT A 6 7.418 -4.253 -5.643 1.00 0.20 H new ATOM 0 H5'' DT A 6 8.327 -4.348 -7.138 1.00 0.20 H new ATOM 0 H4' DT A 6 6.605 -2.597 -7.181 1.00 0.19 H new ATOM 0 H3' DT A 6 9.370 -2.266 -7.898 1.00 0.15 H new ATOM 0 H2' DT A 6 9.899 -0.277 -6.917 1.00 0.15 H new ATOM 0 H2'' DT A 6 8.522 0.464 -7.709 1.00 0.15 H new ATOM 0 H1' DT A 6 7.415 0.563 -5.724 1.00 0.19 H new ATOM 0 H3 DT A 6 10.865 2.257 -3.269 1.00 0.27 H new ATOM 0 H71 DT A 6 9.716 -2.795 -1.776 1.00 0.20 H new ATOM 0 H72 DT A 6 11.432 -2.652 -2.226 1.00 0.20 H new ATOM 0 H73 DT A 6 10.800 -1.748 -0.829 1.00 0.20 H new ATOM 0 H6 DT A 6 8.930 -2.092 -3.928 1.00 0.17 H new ATOM 194 P DA A 7 8.018 -2.562 -10.145 1.00 0.17 P ATOM 195 OP1 DA A 7 9.323 -3.232 -9.948 1.00 0.23 O ATOM 196 OP2 DA A 7 7.728 -1.880 -11.426 1.00 0.18 O ATOM 197 O5' DA A 7 6.852 -3.643 -9.876 1.00 0.22 O ATOM 198 C5' DA A 7 5.526 -3.415 -10.365 1.00 0.15 C ATOM 199 C4' DA A 7 4.492 -4.271 -9.626 1.00 0.14 C ATOM 200 O4' DA A 7 4.700 -4.208 -8.197 1.00 0.13 O ATOM 201 C3' DA A 7 3.068 -3.801 -9.922 1.00 0.12 C ATOM 202 O3' DA A 7 2.275 -4.868 -10.465 1.00 0.09 O ATOM 203 C2' DA A 7 2.504 -3.344 -8.605 1.00 0.13 C ATOM 204 C1' DA A 7 3.538 -3.660 -7.535 1.00 0.13 C ATOM 205 N9 DA A 7 3.928 -2.469 -6.732 1.00 0.13 N ATOM 206 C8 DA A 7 4.025 -1.148 -7.069 1.00 0.13 C ATOM 207 N7 DA A 7 4.405 -0.325 -6.157 1.00 0.15 N ATOM 208 C5 DA A 7 4.598 -1.175 -5.072 1.00 0.15 C ATOM 209 C6 DA A 7 5.014 -0.945 -3.764 1.00 0.18 C ATOM 210 N6 DA A 7 5.307 0.263 -3.299 1.00 0.25 N ATOM 211 N1 DA A 7 5.106 -2.002 -2.948 1.00 0.20 N ATOM 212 C2 DA A 7 4.806 -3.222 -3.387 1.00 0.19 C ATOM 213 N3 DA A 7 4.398 -3.558 -4.607 1.00 0.17 N ATOM 214 C4 DA A 7 4.315 -2.478 -5.409 1.00 0.14 C ATOM 0 H5' DA A 7 5.488 -3.639 -11.431 1.00 0.15 H new ATOM 0 H5'' DA A 7 5.273 -2.361 -10.252 1.00 0.15 H new ATOM 0 H4' DA A 7 4.619 -5.295 -9.978 1.00 0.14 H new ATOM 0 H3' DA A 7 3.063 -3.001 -10.663 1.00 0.12 H new ATOM 0 H2' DA A 7 2.290 -2.275 -8.629 1.00 0.13 H new ATOM 0 H2'' DA A 7 1.564 -3.853 -8.393 1.00 0.13 H new ATOM 0 H1' DA A 7 3.102 -4.370 -6.833 1.00 0.13 H new ATOM 0 H8 DA A 7 3.791 -0.807 -8.067 1.00 0.13 H new ATOM 0 H61 DA A 7 5.608 0.378 -2.331 1.00 0.25 H new ATOM 0 H62 DA A 7 5.231 1.077 -3.910 1.00 0.25 H new ATOM 0 H2 DA A 7 4.905 -4.027 -2.674 1.00 0.19 H new ATOM 226 P DG A 8 2.217 -6.308 -9.742 1.00 0.15 P ATOM 227 OP1 DG A 8 3.566 -6.912 -9.805 1.00 0.23 O ATOM 228 OP2 DG A 8 1.052 -7.047 -10.277 1.00 0.30 O ATOM 229 O5' DG A 8 1.908 -5.926 -8.208 1.00 0.13 O ATOM 230 C5' DG A 8 0.609 -6.154 -7.639 1.00 0.13 C ATOM 231 C4' DG A 8 0.557 -7.422 -6.801 1.00 0.13 C ATOM 232 O4' DG A 8 1.563 -7.387 -5.764 1.00 0.10 O ATOM 233 C3' DG A 8 -0.808 -7.582 -6.142 1.00 0.13 C ATOM 234 O3' DG A 8 -1.459 -8.774 -6.603 1.00 0.21 O ATOM 235 C2' DG A 8 -0.543 -7.644 -4.662 1.00 0.11 C ATOM 236 C1' DG A 8 0.960 -7.580 -4.467 1.00 0.08 C ATOM 237 N9 DG A 8 1.326 -6.480 -3.552 1.00 0.10 N ATOM 238 C8 DG A 8 1.688 -6.527 -2.247 1.00 0.15 C ATOM 239 N7 DG A 8 1.956 -5.408 -1.659 1.00 0.17 N ATOM 240 C5 DG A 8 1.752 -4.488 -2.691 1.00 0.12 C ATOM 241 C6 DG A 8 1.885 -3.072 -2.687 1.00 0.12 C ATOM 242 O6 DG A 8 2.210 -2.340 -1.755 1.00 0.17 O ATOM 243 N1 DG A 8 1.588 -2.528 -3.931 1.00 0.11 N ATOM 244 C2 DG A 8 1.208 -3.253 -5.045 1.00 0.09 C ATOM 245 N2 DG A 8 0.963 -2.551 -6.151 1.00 0.14 N ATOM 246 N3 DG A 8 1.081 -4.584 -5.057 1.00 0.08 N ATOM 247 C4 DG A 8 1.366 -5.136 -3.855 1.00 0.08 C ATOM 0 H5' DG A 8 -0.128 -6.220 -8.439 1.00 0.13 H new ATOM 0 H5'' DG A 8 0.332 -5.301 -7.020 1.00 0.13 H new ATOM 0 H4' DG A 8 0.742 -8.263 -7.470 1.00 0.13 H new ATOM 0 H3' DG A 8 -1.474 -6.755 -6.390 1.00 0.13 H new ATOM 0 H2' DG A 8 -1.032 -6.816 -4.150 1.00 0.11 H new ATOM 0 H2'' DG A 8 -0.946 -8.564 -4.238 1.00 0.11 H new ATOM 0 H1' DG A 8 1.320 -8.505 -4.016 1.00 0.08 H new ATOM 0 H8 DG A 8 1.750 -7.466 -1.717 1.00 0.15 H new ATOM 0 H1 DG A 8 1.656 -1.515 -4.030 1.00 0.11 H new ATOM 0 H21 DG A 8 0.679 -3.029 -7.006 1.00 0.14 H new ATOM 0 H22 DG A 8 1.060 -1.536 -6.142 1.00 0.14 H new ATOM 259 P DG A 9 -0.831 -10.227 -6.309 1.00 0.28 P ATOM 260 OP1 DG A 9 0.638 -10.086 -6.209 1.00 0.27 O ATOM 261 OP2 DG A 9 -1.417 -11.188 -7.270 1.00 0.40 O ATOM 262 O5' DG A 9 -1.407 -10.563 -4.845 1.00 0.29 O ATOM 263 C5' DG A 9 -2.818 -10.507 -4.590 1.00 0.25 C ATOM 264 C4' DG A 9 -3.134 -10.441 -3.102 1.00 0.16 C ATOM 265 O4' DG A 9 -2.482 -9.302 -2.497 1.00 0.15 O ATOM 266 C3' DG A 9 -4.640 -10.308 -2.865 1.00 0.10 C ATOM 267 O3' DG A 9 -5.154 -11.417 -2.110 1.00 0.07 O ATOM 268 C2' DG A 9 -4.816 -9.019 -2.112 1.00 0.09 C ATOM 269 C1' DG A 9 -3.435 -8.524 -1.744 1.00 0.11 C ATOM 270 N9 DG A 9 -3.295 -7.083 -2.034 1.00 0.12 N ATOM 271 C8 DG A 9 -3.534 -6.398 -3.181 1.00 0.09 C ATOM 272 N7 DG A 9 -3.338 -5.122 -3.168 1.00 0.08 N ATOM 273 C5 DG A 9 -2.915 -4.914 -1.851 1.00 0.10 C ATOM 274 C6 DG A 9 -2.540 -3.712 -1.194 1.00 0.11 C ATOM 275 O6 DG A 9 -2.505 -2.572 -1.650 1.00 0.15 O ATOM 276 N1 DG A 9 -2.182 -3.945 0.128 1.00 0.14 N ATOM 277 C2 DG A 9 -2.182 -5.177 0.748 1.00 0.15 C ATOM 278 N2 DG A 9 -1.804 -5.195 2.026 1.00 0.16 N ATOM 279 N3 DG A 9 -2.533 -6.312 0.138 1.00 0.15 N ATOM 280 C4 DG A 9 -2.886 -6.111 -1.152 1.00 0.12 C ATOM 0 H5' DG A 9 -3.298 -11.385 -5.023 1.00 0.25 H new ATOM 0 H5'' DG A 9 -3.241 -9.634 -5.088 1.00 0.25 H new ATOM 0 H4' DG A 9 -2.772 -11.366 -2.653 1.00 0.16 H new ATOM 0 H3' DG A 9 -5.190 -10.307 -3.806 1.00 0.10 H new ATOM 0 H2' DG A 9 -5.338 -8.284 -2.725 1.00 0.09 H new ATOM 0 H2'' DG A 9 -5.420 -9.175 -1.218 1.00 0.09 H new ATOM 0 H1' DG A 9 -3.260 -8.645 -0.675 1.00 0.11 H new ATOM 0 H8 DG A 9 -3.876 -6.902 -4.073 1.00 0.09 H new ATOM 0 H1 DG A 9 -1.896 -3.140 0.685 1.00 0.14 H new ATOM 0 H21 DG A 9 -1.783 -6.076 2.539 1.00 0.16 H new ATOM 0 H22 DG A 9 -1.536 -4.328 2.491 1.00 0.16 H new ATOM 292 P DG A 10 -4.482 -11.871 -0.714 1.00 0.10 P ATOM 293 OP1 DG A 10 -3.017 -11.953 -0.908 1.00 0.10 O ATOM 294 OP2 DG A 10 -5.223 -13.048 -0.208 1.00 0.16 O ATOM 295 O5' DG A 10 -4.790 -10.628 0.263 1.00 0.19 O ATOM 296 C5' DG A 10 -6.042 -10.528 0.960 1.00 0.27 C ATOM 297 C4' DG A 10 -5.949 -9.621 2.181 1.00 0.13 C ATOM 298 O4' DG A 10 -5.292 -8.378 1.840 1.00 0.11 O ATOM 299 C3' DG A 10 -7.335 -9.286 2.734 1.00 0.11 C ATOM 300 O3' DG A 10 -7.467 -9.706 4.099 1.00 0.13 O ATOM 301 C2' DG A 10 -7.451 -7.794 2.629 1.00 0.09 C ATOM 302 C1' DG A 10 -6.064 -7.269 2.339 1.00 0.09 C ATOM 303 N9 DG A 10 -6.112 -6.164 1.365 1.00 0.09 N ATOM 304 C8 DG A 10 -6.478 -6.174 0.059 1.00 0.13 C ATOM 305 N7 DG A 10 -6.450 -5.052 -0.579 1.00 0.20 N ATOM 306 C5 DG A 10 -6.009 -4.172 0.415 1.00 0.17 C ATOM 307 C6 DG A 10 -5.771 -2.776 0.350 1.00 0.21 C ATOM 308 O6 DG A 10 -5.900 -2.028 -0.610 1.00 0.28 O ATOM 309 N1 DG A 10 -5.339 -2.272 1.567 1.00 0.17 N ATOM 310 C2 DG A 10 -5.153 -3.011 2.713 1.00 0.11 C ATOM 311 N2 DG A 10 -4.725 -2.335 3.782 1.00 0.13 N ATOM 312 N3 DG A 10 -5.373 -4.330 2.788 1.00 0.10 N ATOM 313 C4 DG A 10 -5.799 -4.845 1.608 1.00 0.10 C ATOM 0 H5' DG A 10 -6.363 -11.522 1.271 1.00 0.27 H new ATOM 0 H5'' DG A 10 -6.804 -10.145 0.282 1.00 0.27 H new ATOM 0 H4' DG A 10 -5.376 -10.160 2.935 1.00 0.13 H new ATOM 0 H3' DG A 10 -8.120 -9.800 2.180 1.00 0.11 H new ATOM 0 H2' DG A 10 -8.144 -7.515 1.835 1.00 0.09 H new ATOM 0 H2'' DG A 10 -7.839 -7.370 3.555 1.00 0.09 H new ATOM 0 H1' DG A 10 -5.606 -6.863 3.241 1.00 0.09 H new ATOM 0 H8 DG A 10 -6.782 -7.088 -0.430 1.00 0.13 H new ATOM 0 H1 DG A 10 -5.143 -1.272 1.617 1.00 0.17 H new ATOM 0 H21 DG A 10 -4.567 -2.822 4.664 1.00 0.13 H new ATOM 0 H22 DG A 10 -4.556 -1.331 3.717 1.00 0.13 H new ATOM 325 P DT A 11 -6.517 -9.092 5.248 1.00 0.11 P ATOM 326 OP1 DT A 11 -5.124 -9.102 4.749 1.00 0.16 O ATOM 327 OP2 DT A 11 -6.845 -9.765 6.526 1.00 0.13 O ATOM 328 O5' DT A 11 -7.005 -7.558 5.351 1.00 0.13 O ATOM 329 C5' DT A 11 -8.152 -7.197 6.130 1.00 0.17 C ATOM 330 C4' DT A 11 -8.076 -5.744 6.608 1.00 0.13 C ATOM 331 O4' DT A 11 -7.030 -5.585 7.593 1.00 0.12 O ATOM 332 C3' DT A 11 -7.786 -4.798 5.446 1.00 0.10 C ATOM 333 O3' DT A 11 -8.829 -3.825 5.302 1.00 0.17 O ATOM 334 C2' DT A 11 -6.473 -4.141 5.771 1.00 0.06 C ATOM 335 C1' DT A 11 -6.075 -4.590 7.165 1.00 0.08 C ATOM 336 N1 DT A 11 -4.706 -5.151 7.175 1.00 0.09 N ATOM 337 C2 DT A 11 -3.782 -4.581 8.034 1.00 0.11 C ATOM 338 O2 DT A 11 -4.064 -3.631 8.761 1.00 0.14 O ATOM 339 N3 DT A 11 -2.520 -5.144 8.026 1.00 0.15 N ATOM 340 C4 DT A 11 -2.107 -6.210 7.247 1.00 0.12 C ATOM 341 O4 DT A 11 -0.956 -6.633 7.321 1.00 0.11 O ATOM 342 C5 DT A 11 -3.138 -6.738 6.382 1.00 0.13 C ATOM 343 C7 DT A 11 -2.820 -7.916 5.465 1.00 0.14 C ATOM 344 C6 DT A 11 -4.377 -6.206 6.372 1.00 0.13 C ATOM 0 H5' DT A 11 -8.230 -7.860 6.992 1.00 0.17 H new ATOM 0 H5'' DT A 11 -9.055 -7.338 5.536 1.00 0.17 H new ATOM 0 H4' DT A 11 -9.043 -5.499 7.047 1.00 0.13 H new ATOM 0 H3' DT A 11 -7.738 -5.334 4.498 1.00 0.10 H new ATOM 0 H2' DT A 11 -5.712 -4.424 5.044 1.00 0.06 H new ATOM 0 H2'' DT A 11 -6.566 -3.056 5.729 1.00 0.06 H new ATOM 0 H1' DT A 11 -6.077 -3.738 7.844 1.00 0.08 H new ATOM 0 H3 DT A 11 -1.828 -4.735 8.654 1.00 0.15 H new ATOM 0 H71 DT A 11 -1.767 -7.886 5.186 1.00 0.14 H new ATOM 0 H72 DT A 11 -3.031 -8.850 5.986 1.00 0.14 H new ATOM 0 H73 DT A 11 -3.435 -7.855 4.567 1.00 0.14 H new ATOM 0 H6 DT A 11 -5.126 -6.623 5.715 1.00 0.13 H new ATOM 357 P DT A 12 -9.175 -2.790 6.488 1.00 0.21 P ATOM 358 OP1 DT A 12 -8.041 -2.771 7.438 1.00 0.29 O ATOM 359 OP2 DT A 12 -10.540 -3.086 6.975 1.00 0.40 O ATOM 360 O5' DT A 12 -9.211 -1.377 5.717 1.00 0.15 O ATOM 361 C5' DT A 12 -8.131 -0.449 5.851 1.00 0.08 C ATOM 362 C4' DT A 12 -7.947 0.396 4.593 1.00 0.09 C ATOM 363 O4' DT A 12 -7.712 -0.439 3.438 1.00 0.15 O ATOM 364 C3' DT A 12 -9.167 1.256 4.310 1.00 0.10 C ATOM 365 O3' DT A 12 -8.928 2.610 4.709 1.00 0.10 O ATOM 366 C2' DT A 12 -9.385 1.151 2.827 1.00 0.14 C ATOM 367 C1' DT A 12 -8.526 0.002 2.332 1.00 0.14 C ATOM 368 N1 DT A 12 -9.363 -1.106 1.832 1.00 0.12 N ATOM 369 C2 DT A 12 -9.874 -0.997 0.552 1.00 0.12 C ATOM 370 O2 DT A 12 -9.660 -0.016 -0.156 1.00 0.15 O ATOM 371 N3 DT A 12 -10.642 -2.060 0.114 1.00 0.13 N ATOM 372 C4 DT A 12 -10.938 -3.205 0.835 1.00 0.15 C ATOM 373 O4 DT A 12 -11.631 -4.093 0.344 1.00 0.21 O ATOM 374 C5 DT A 12 -10.361 -3.228 2.162 1.00 0.13 C ATOM 375 C7 DT A 12 -10.605 -4.432 3.068 1.00 0.14 C ATOM 376 C6 DT A 12 -9.610 -2.204 2.611 1.00 0.11 C ATOM 0 H5' DT A 12 -7.210 -0.992 6.061 1.00 0.08 H new ATOM 0 H5'' DT A 12 -8.318 0.204 6.703 1.00 0.08 H new ATOM 0 H4' DT A 12 -7.085 1.037 4.776 1.00 0.09 H new ATOM 0 H3' DT A 12 -10.045 0.926 4.866 1.00 0.10 H new ATOM 0 H2' DT A 12 -10.436 0.970 2.604 1.00 0.14 H new ATOM 0 H2'' DT A 12 -9.109 2.081 2.330 1.00 0.14 H new ATOM 0 H1' DT A 12 -7.900 0.331 1.502 1.00 0.14 H new ATOM 0 H3 DT A 12 -11.027 -1.995 -0.828 1.00 0.13 H new ATOM 0 H71 DT A 12 -11.573 -4.874 2.833 1.00 0.14 H new ATOM 0 H72 DT A 12 -9.820 -5.172 2.910 1.00 0.14 H new ATOM 0 H73 DT A 12 -10.596 -4.111 4.110 1.00 0.14 H new ATOM 0 H6 DT A 12 -9.194 -2.250 3.607 1.00 0.11 H new ATOM 389 P DA A 13 -9.083 3.056 6.251 1.00 0.05 P ATOM 390 OP1 DA A 13 -8.106 4.134 6.522 1.00 0.09 O ATOM 391 OP2 DA A 13 -9.085 1.834 7.087 1.00 0.08 O ATOM 392 O5' DA A 13 -10.563 3.695 6.290 1.00 0.06 O ATOM 393 C5' DA A 13 -10.876 4.859 5.517 1.00 0.11 C ATOM 394 C4' DA A 13 -10.228 4.801 4.137 1.00 0.04 C ATOM 395 O4' DA A 13 -10.586 3.576 3.464 1.00 0.11 O ATOM 396 C3' DA A 13 -10.667 5.970 3.259 1.00 0.02 C ATOM 397 O3' DA A 13 -9.589 6.894 3.053 1.00 0.05 O ATOM 398 C2' DA A 13 -11.111 5.354 1.963 1.00 0.10 C ATOM 399 C1' DA A 13 -11.193 3.860 2.189 1.00 0.11 C ATOM 400 N9 DA A 13 -12.597 3.405 2.176 1.00 0.12 N ATOM 401 C8 DA A 13 -13.331 2.894 1.161 1.00 0.15 C ATOM 402 N7 DA A 13 -14.557 2.576 1.409 1.00 0.16 N ATOM 403 C5 DA A 13 -14.666 2.914 2.761 1.00 0.12 C ATOM 404 C6 DA A 13 -15.722 2.832 3.676 1.00 0.12 C ATOM 405 N6 DA A 13 -16.928 2.365 3.356 1.00 0.11 N ATOM 406 N1 DA A 13 -15.486 3.251 4.931 1.00 0.12 N ATOM 407 C2 DA A 13 -14.286 3.724 5.271 1.00 0.12 C ATOM 408 N3 DA A 13 -13.218 3.844 4.488 1.00 0.12 N ATOM 409 C4 DA A 13 -13.477 3.419 3.236 1.00 0.12 C ATOM 0 H5' DA A 13 -10.535 5.750 6.044 1.00 0.11 H new ATOM 0 H5'' DA A 13 -11.957 4.947 5.410 1.00 0.11 H new ATOM 0 H4' DA A 13 -9.150 4.852 4.291 1.00 0.04 H new ATOM 0 H3' DA A 13 -11.469 6.544 3.724 1.00 0.02 H new ATOM 0 H2' DA A 13 -12.079 5.752 1.659 1.00 0.10 H new ATOM 0 H2'' DA A 13 -10.406 5.585 1.164 1.00 0.10 H new ATOM 0 H1' DA A 13 -10.671 3.331 1.391 1.00 0.11 H new ATOM 0 H8 DA A 13 -12.906 2.757 0.178 1.00 0.15 H new ATOM 0 H61 DA A 13 -17.664 2.326 4.061 1.00 0.11 H new ATOM 0 H62 DA A 13 -17.116 2.046 2.406 1.00 0.11 H new ATOM 0 H2 DA A 13 -14.169 4.045 6.296 1.00 0.12 H new ATOM 421 P DI A 14 -8.191 6.408 2.412 1.00 0.13 P ATOM 422 OP1 DI A 14 -7.810 7.367 1.350 1.00 0.22 O ATOM 423 OP2 DI A 14 -8.304 4.965 2.096 1.00 0.07 O ATOM 424 O5' DI A 14 -7.157 6.575 3.637 1.00 0.20 O ATOM 425 C5' DI A 14 -6.503 5.431 4.208 1.00 0.14 C ATOM 426 C4' DI A 14 -5.041 5.704 4.549 1.00 0.08 C ATOM 427 O4' DI A 14 -4.436 4.535 5.153 1.00 0.09 O ATOM 428 C3' DI A 14 -4.232 6.053 3.299 1.00 0.09 C ATOM 429 O3' DI A 14 -3.874 7.443 3.271 1.00 0.15 O ATOM 430 C2' DI A 14 -3.014 5.184 3.377 1.00 0.08 C ATOM 431 C1' DI A 14 -3.376 4.047 4.306 1.00 0.05 C ATOM 432 N9 DI A 14 -3.829 2.861 3.549 1.00 0.08 N ATOM 433 C8 DI A 14 -3.939 1.573 3.952 1.00 0.11 C ATOM 434 N7 DI A 14 -4.390 0.712 3.101 1.00 0.13 N ATOM 435 C5 DI A 14 -4.613 1.520 1.978 1.00 0.12 C ATOM 436 C6 DI A 14 -5.108 1.183 0.696 1.00 0.15 C ATOM 437 O6 DI A 14 -5.460 0.088 0.278 1.00 0.17 O ATOM 438 N1 DI A 14 -5.172 2.294 -0.130 1.00 0.19 N ATOM 439 C2 DI A 14 -4.806 3.580 0.221 1.00 0.20 C ATOM 440 N3 DI A 14 -4.344 3.901 1.418 1.00 0.18 N ATOM 441 C4 DI A 14 -4.272 2.833 2.246 1.00 0.12 C ATOM 0 H5'' DI A 14 -7.033 5.127 5.111 1.00 0.14 H new ATOM 0 H2'' DI A 14 -2.737 4.810 2.391 1.00 0.08 H new ATOM 0 H8 DI A 14 -3.656 1.273 4.961 1.00 0.11 H new ATOM 0 H5' DI A 14 -6.560 4.597 3.508 1.00 0.14 H new ATOM 0 H4' DI A 14 -5.028 6.546 5.242 1.00 0.08 H new ATOM 0 H3' DI A 14 -4.804 5.881 2.387 1.00 0.09 H new ATOM 0 H2' DI A 14 -2.159 5.743 3.758 1.00 0.08 H new ATOM 0 H2 DI A 14 -4.903 4.368 -0.526 1.00 0.20 H new ATOM 0 H1' DI A 14 -2.509 3.736 4.889 1.00 0.05 H new ATOM 0 H1 DI A 14 -5.519 2.150 -1.078 1.00 0.19 H new ATOM 452 P DG A 15 -4.673 8.489 2.338 1.00 0.10 P ATOM 453 OP1 DG A 15 -3.944 9.778 2.357 1.00 0.20 O ATOM 454 OP2 DG A 15 -6.102 8.453 2.717 1.00 0.18 O ATOM 455 O5' DG A 15 -4.526 7.844 0.866 1.00 0.22 O ATOM 456 C5' DG A 15 -3.430 8.193 0.001 1.00 0.17 C ATOM 457 C4' DG A 15 -2.189 8.629 0.768 1.00 0.12 C ATOM 458 O4' DG A 15 -1.833 7.637 1.754 1.00 0.18 O ATOM 459 C3' DG A 15 -0.998 8.826 -0.165 1.00 0.07 C ATOM 460 O3' DG A 15 -0.438 10.136 0.010 1.00 0.06 O ATOM 461 C2' DG A 15 -0.010 7.753 0.217 1.00 0.12 C ATOM 462 C1' DG A 15 -0.497 7.152 1.519 1.00 0.17 C ATOM 463 N9 DG A 15 -0.484 5.678 1.483 1.00 0.14 N ATOM 464 C8 DG A 15 -0.124 4.810 2.455 1.00 0.07 C ATOM 465 N7 DG A 15 -0.258 3.554 2.215 1.00 0.07 N ATOM 466 C5 DG A 15 -0.771 3.558 0.920 1.00 0.07 C ATOM 467 C6 DG A 15 -1.136 2.467 0.087 1.00 0.08 C ATOM 468 O6 DG A 15 -1.091 1.265 0.346 1.00 0.10 O ATOM 469 N1 DG A 15 -1.603 2.902 -1.146 1.00 0.14 N ATOM 470 C2 DG A 15 -1.710 4.223 -1.535 1.00 0.22 C ATOM 471 N2 DG A 15 -2.161 4.436 -2.773 1.00 0.28 N ATOM 472 N3 DG A 15 -1.372 5.258 -0.753 1.00 0.23 N ATOM 473 C4 DG A 15 -0.912 4.857 0.456 1.00 0.15 C ATOM 0 H5' DG A 15 -3.741 8.998 -0.665 1.00 0.17 H new ATOM 0 H5'' DG A 15 -3.182 7.337 -0.627 1.00 0.17 H new ATOM 0 H4' DG A 15 -2.427 9.576 1.252 1.00 0.12 H new ATOM 0 H3' DG A 15 -1.280 8.749 -1.215 1.00 0.07 H new ATOM 0 H2' DG A 15 0.053 6.992 -0.560 1.00 0.12 H new ATOM 0 H2'' DG A 15 0.989 8.172 0.335 1.00 0.12 H new ATOM 0 H1' DG A 15 0.172 7.450 2.327 1.00 0.17 H new ATOM 0 H8 DG A 15 0.263 5.160 3.401 1.00 0.07 H new ATOM 0 H1 DG A 15 -1.890 2.190 -1.818 1.00 0.14 H new ATOM 0 H21 DG A 15 -2.263 5.389 -3.122 1.00 0.28 H new ATOM 0 H22 DG A 15 -2.403 3.646 -3.370 1.00 0.28 H new ATOM 485 P DG A 16 1.024 10.503 -0.559 1.00 0.07 P ATOM 486 OP1 DG A 16 1.133 11.977 -0.644 1.00 0.11 O ATOM 487 OP2 DG A 16 1.277 9.673 -1.759 1.00 0.12 O ATOM 488 O5' DG A 16 1.994 9.992 0.622 1.00 0.10 O ATOM 489 C5' DG A 16 1.921 10.585 1.927 1.00 0.08 C ATOM 490 C4' DG A 16 2.856 9.919 2.929 1.00 0.09 C ATOM 491 O4' DG A 16 2.524 8.523 3.096 1.00 0.09 O ATOM 492 C3' DG A 16 4.309 10.010 2.476 1.00 0.10 C ATOM 493 O3' DG A 16 5.054 10.884 3.333 1.00 0.11 O ATOM 494 C2' DG A 16 4.845 8.605 2.544 1.00 0.12 C ATOM 495 C1' DG A 16 3.713 7.710 3.005 1.00 0.11 C ATOM 496 N9 DG A 16 3.509 6.594 2.065 1.00 0.10 N ATOM 497 C8 DG A 16 3.257 6.622 0.735 1.00 0.06 C ATOM 498 N7 DG A 16 3.079 5.493 0.133 1.00 0.08 N ATOM 499 C5 DG A 16 3.232 4.584 1.184 1.00 0.11 C ATOM 500 C6 DG A 16 3.153 3.166 1.179 1.00 0.14 C ATOM 501 O6 DG A 16 2.925 2.418 0.227 1.00 0.20 O ATOM 502 N1 DG A 16 3.371 2.639 2.451 1.00 0.14 N ATOM 503 C2 DG A 16 3.634 3.385 3.584 1.00 0.15 C ATOM 504 N2 DG A 16 3.834 2.702 4.711 1.00 0.16 N ATOM 505 N3 DG A 16 3.707 4.719 3.594 1.00 0.15 N ATOM 506 C4 DG A 16 3.498 5.252 2.370 1.00 0.12 C ATOM 0 H5' DG A 16 0.897 10.521 2.294 1.00 0.08 H new ATOM 0 H5'' DG A 16 2.168 11.644 1.855 1.00 0.08 H new ATOM 0 H4' DG A 16 2.733 10.448 3.874 1.00 0.09 H new ATOM 0 H3' DG A 16 4.391 10.420 1.469 1.00 0.10 H new ATOM 0 H2' DG A 16 5.213 8.287 1.568 1.00 0.12 H new ATOM 0 H2'' DG A 16 5.685 8.548 3.236 1.00 0.12 H new ATOM 0 H1' DG A 16 3.950 7.273 3.975 1.00 0.11 H new ATOM 0 H8 DG A 16 3.207 7.556 0.196 1.00 0.06 H new ATOM 0 H1 DG A 16 3.333 1.625 2.553 1.00 0.14 H new ATOM 0 H21 DG A 16 4.032 3.198 5.580 1.00 0.16 H new ATOM 0 H22 DG A 16 3.789 1.683 4.705 1.00 0.16 H new ATOM 518 P DT A 17 5.747 12.215 2.747 1.00 0.10 P ATOM 519 OP1 DT A 17 5.731 13.251 3.804 1.00 0.15 O ATOM 520 OP2 DT A 17 5.152 12.504 1.422 1.00 0.12 O ATOM 521 O5' DT A 17 7.272 11.748 2.524 1.00 0.07 O ATOM 522 C5' DT A 17 7.587 10.724 1.576 1.00 0.07 C ATOM 523 C4' DT A 17 8.907 10.038 1.908 1.00 0.09 C ATOM 524 O4' DT A 17 8.906 9.550 3.270 1.00 0.11 O ATOM 525 C3' DT A 17 9.153 8.848 0.983 1.00 0.09 C ATOM 526 O3' DT A 17 10.254 9.097 0.096 1.00 0.09 O ATOM 527 C2' DT A 17 9.442 7.684 1.894 1.00 0.12 C ATOM 528 C1' DT A 17 9.445 8.213 3.314 1.00 0.10 C ATOM 529 N1 DT A 17 8.645 7.344 4.201 1.00 0.10 N ATOM 530 C2 DT A 17 8.976 6.002 4.242 1.00 0.13 C ATOM 531 O2 DT A 17 9.897 5.536 3.575 1.00 0.14 O ATOM 532 N3 DT A 17 8.206 5.213 5.076 1.00 0.16 N ATOM 533 C4 DT A 17 7.152 5.642 5.861 1.00 0.16 C ATOM 534 O4 DT A 17 6.534 4.851 6.569 1.00 0.21 O ATOM 535 C5 DT A 17 6.879 7.059 5.755 1.00 0.12 C ATOM 536 C7 DT A 17 5.738 7.667 6.566 1.00 0.16 C ATOM 537 C6 DT A 17 7.616 7.850 4.948 1.00 0.11 C ATOM 0 H5' DT A 17 7.643 11.157 0.577 1.00 0.07 H new ATOM 0 H5'' DT A 17 6.786 9.985 1.559 1.00 0.07 H new ATOM 0 H4' DT A 17 9.694 10.781 1.777 1.00 0.09 H new ATOM 0 H3' DT A 17 8.292 8.654 0.343 1.00 0.09 H new ATOM 0 H2' DT A 17 8.687 6.906 1.775 1.00 0.12 H new ATOM 0 H2'' DT A 17 10.404 7.234 1.649 1.00 0.12 H new ATOM 0 H1' DT A 17 10.457 8.224 3.719 1.00 0.10 H new ATOM 0 H3 DT A 17 8.437 4.220 5.116 1.00 0.16 H new ATOM 0 H71 DT A 17 4.958 6.920 6.714 1.00 0.16 H new ATOM 0 H72 DT A 17 6.115 7.995 7.535 1.00 0.16 H new ATOM 0 H73 DT A 17 5.325 8.521 6.029 1.00 0.16 H new ATOM 0 H6 DT A 17 7.389 8.904 4.890 1.00 0.11 H new ATOM 550 P DT A 18 11.691 9.550 0.664 1.00 0.07 P ATOM 551 OP1 DT A 18 12.061 8.637 1.770 1.00 0.07 O ATOM 552 OP2 DT A 18 11.658 11.011 0.894 1.00 0.13 O ATOM 553 O5' DT A 18 12.670 9.257 -0.582 1.00 0.10 O ATOM 554 C5' DT A 18 12.680 10.112 -1.731 1.00 0.11 C ATOM 555 C4' DT A 18 11.978 9.463 -2.926 1.00 0.07 C ATOM 556 O4' DT A 18 12.551 8.167 -3.212 1.00 0.09 O ATOM 557 C3' DT A 18 10.488 9.279 -2.659 1.00 0.09 C ATOM 558 O3' DT A 18 9.709 10.091 -3.548 1.00 0.09 O ATOM 559 C2' DT A 18 10.211 7.812 -2.878 1.00 0.12 C ATOM 560 C1' DT A 18 11.544 7.134 -3.127 1.00 0.08 C ATOM 561 N1 DT A 18 11.858 6.192 -2.033 1.00 0.11 N ATOM 562 C2 DT A 18 11.471 4.872 -2.184 1.00 0.15 C ATOM 563 O2 DT A 18 10.901 4.470 -3.196 1.00 0.15 O ATOM 564 N3 DT A 18 11.765 4.030 -1.126 1.00 0.18 N ATOM 565 C4 DT A 18 12.399 4.389 0.050 1.00 0.19 C ATOM 566 O4 DT A 18 12.612 3.557 0.928 1.00 0.28 O ATOM 567 C5 DT A 18 12.765 5.787 0.115 1.00 0.15 C ATOM 568 C7 DT A 18 13.449 6.330 1.366 1.00 0.19 C ATOM 569 C6 DT A 18 12.493 6.624 -0.903 1.00 0.11 C ATOM 0 H5' DT A 18 13.710 10.350 -1.999 1.00 0.11 H new ATOM 0 H5'' DT A 18 12.188 11.054 -1.488 1.00 0.11 H new ATOM 0 H4' DT A 18 12.115 10.129 -3.778 1.00 0.07 H new ATOM 0 H3' DT A 18 10.219 9.586 -1.648 1.00 0.09 H new ATOM 0 H2' DT A 18 9.717 7.380 -2.008 1.00 0.12 H new ATOM 0 H2'' DT A 18 9.543 7.670 -3.727 1.00 0.12 H new ATOM 0 H1' DT A 18 11.511 6.560 -4.053 1.00 0.08 H new ATOM 0 H3 DT A 18 11.488 3.053 -1.222 1.00 0.18 H new ATOM 0 H71 DT A 18 14.103 7.158 1.093 1.00 0.19 H new ATOM 0 H72 DT A 18 12.694 6.681 2.070 1.00 0.19 H new ATOM 0 H73 DT A 18 14.039 5.540 1.830 1.00 0.19 H new ATOM 0 H6 DT A 18 12.783 7.661 -0.825 1.00 0.11 H new ATOM 582 P DA A 19 9.806 9.900 -5.145 1.00 0.09 P ATOM 583 OP1 DA A 19 11.071 9.195 -5.452 1.00 0.11 O ATOM 584 OP2 DA A 19 9.511 11.201 -5.786 1.00 0.10 O ATOM 585 O5' DA A 19 8.584 8.898 -5.451 1.00 0.07 O ATOM 586 C5' DA A 19 7.244 9.275 -5.123 1.00 0.10 C ATOM 587 C4' DA A 19 6.317 8.061 -5.060 1.00 0.07 C ATOM 588 O4' DA A 19 6.830 7.051 -4.163 1.00 0.10 O ATOM 589 C3' DA A 19 4.924 8.443 -4.566 1.00 0.06 C ATOM 590 O3' DA A 19 3.986 8.457 -5.648 1.00 0.06 O ATOM 591 C2' DA A 19 4.560 7.393 -3.548 1.00 0.09 C ATOM 592 C1' DA A 19 5.731 6.435 -3.462 1.00 0.07 C ATOM 593 N9 DA A 19 6.091 6.139 -2.059 1.00 0.08 N ATOM 594 C8 DA A 19 6.347 6.979 -1.024 1.00 0.10 C ATOM 595 N7 DA A 19 6.685 6.447 0.105 1.00 0.14 N ATOM 596 C5 DA A 19 6.648 5.083 -0.203 1.00 0.09 C ATOM 597 C6 DA A 19 6.903 3.928 0.551 1.00 0.11 C ATOM 598 N6 DA A 19 7.284 3.960 1.829 1.00 0.16 N ATOM 599 N1 DA A 19 6.770 2.740 -0.069 1.00 0.13 N ATOM 600 C2 DA A 19 6.409 2.694 -1.355 1.00 0.13 C ATOM 601 N3 DA A 19 6.148 3.718 -2.157 1.00 0.11 N ATOM 602 C4 DA A 19 6.286 4.891 -1.516 1.00 0.07 C ATOM 0 H5' DA A 19 6.871 9.980 -5.866 1.00 0.10 H new ATOM 0 H5'' DA A 19 7.235 9.790 -4.163 1.00 0.10 H new ATOM 0 H4' DA A 19 6.262 7.672 -6.077 1.00 0.07 H new ATOM 0 H3' DA A 19 4.907 9.444 -4.135 1.00 0.06 H new ATOM 0 H2' DA A 19 4.362 7.849 -2.578 1.00 0.09 H new ATOM 0 H2'' DA A 19 3.652 6.867 -3.844 1.00 0.09 H new ATOM 0 H1' DA A 19 5.471 5.478 -3.914 1.00 0.07 H new ATOM 0 H8 DA A 19 6.271 8.050 -1.139 1.00 0.10 H new ATOM 0 H61 DA A 19 7.457 3.089 2.332 1.00 0.16 H new ATOM 0 H62 DA A 19 7.403 4.855 2.303 1.00 0.16 H new ATOM 0 H2 DA A 19 6.319 1.710 -1.791 1.00 0.13 H new ATOM 614 P DG A 20 2.427 8.752 -5.381 1.00 0.07 P ATOM 615 OP1 DG A 20 2.144 10.149 -5.781 1.00 0.20 O ATOM 616 OP2 DG A 20 2.090 8.293 -4.015 1.00 0.24 O ATOM 617 O5' DG A 20 1.707 7.772 -6.434 1.00 0.14 O ATOM 618 C5' DG A 20 2.138 6.410 -6.563 1.00 0.15 C ATOM 619 C4' DG A 20 1.307 5.633 -7.572 1.00 0.08 C ATOM 620 O4' DG A 20 1.796 4.279 -7.695 1.00 0.08 O ATOM 621 C3' DG A 20 -0.157 5.575 -7.149 1.00 0.09 C ATOM 622 O3' DG A 20 -0.983 6.306 -8.067 1.00 0.08 O ATOM 623 C2' DG A 20 -0.522 4.116 -7.138 1.00 0.09 C ATOM 624 C1' DG A 20 0.711 3.339 -7.562 1.00 0.09 C ATOM 625 N9 DG A 20 1.035 2.297 -6.571 1.00 0.10 N ATOM 626 C8 DG A 20 0.988 0.948 -6.692 1.00 0.12 C ATOM 627 N7 DG A 20 1.304 0.244 -5.659 1.00 0.12 N ATOM 628 C5 DG A 20 1.605 1.233 -4.719 1.00 0.09 C ATOM 629 C6 DG A 20 2.025 1.103 -3.369 1.00 0.07 C ATOM 630 O6 DG A 20 2.210 0.070 -2.727 1.00 0.07 O ATOM 631 N1 DG A 20 2.223 2.345 -2.775 1.00 0.08 N ATOM 632 C2 DG A 20 2.037 3.563 -3.399 1.00 0.10 C ATOM 633 N2 DG A 20 2.276 4.649 -2.659 1.00 0.13 N ATOM 634 N3 DG A 20 1.641 3.693 -4.671 1.00 0.10 N ATOM 635 C4 DG A 20 1.444 2.495 -5.269 1.00 0.08 C ATOM 0 H5' DG A 20 2.078 5.919 -5.592 1.00 0.15 H new ATOM 0 H5'' DG A 20 3.185 6.390 -6.866 1.00 0.15 H new ATOM 0 H4' DG A 20 1.391 6.151 -8.527 1.00 0.08 H new ATOM 0 H3' DG A 20 -0.309 6.030 -6.170 1.00 0.09 H new ATOM 0 H2' DG A 20 -0.847 3.809 -6.144 1.00 0.09 H new ATOM 0 H2'' DG A 20 -1.351 3.922 -7.818 1.00 0.09 H new ATOM 0 H1' DG A 20 0.534 2.834 -8.512 1.00 0.09 H new ATOM 0 H8 DG A 20 0.696 0.479 -7.620 1.00 0.12 H new ATOM 0 H1 DG A 20 2.530 2.357 -1.802 1.00 0.08 H new ATOM 0 H21 DG A 20 2.157 5.578 -3.063 1.00 0.13 H new ATOM 0 H22 DG A 20 2.578 4.549 -1.690 1.00 0.13 H new ATOM 647 P DG A 21 -1.122 5.837 -9.601 1.00 0.07 P ATOM 648 OP1 DG A 21 0.211 5.404 -10.076 1.00 0.10 O ATOM 649 OP2 DG A 21 -1.865 6.883 -10.339 1.00 0.16 O ATOM 650 O5' DG A 21 -2.064 4.536 -9.485 1.00 0.13 O ATOM 651 C5' DG A 21 -2.247 3.670 -10.612 1.00 0.10 C ATOM 652 C4' DG A 21 -3.226 2.537 -10.329 1.00 0.10 C ATOM 653 O4' DG A 21 -2.774 1.725 -9.223 1.00 0.16 O ATOM 654 C3' DG A 21 -4.611 3.071 -9.976 1.00 0.10 C ATOM 655 O3' DG A 21 -5.528 2.870 -11.058 1.00 0.18 O ATOM 656 C2' DG A 21 -5.037 2.302 -8.754 1.00 0.15 C ATOM 657 C1' DG A 21 -3.896 1.375 -8.387 1.00 0.15 C ATOM 658 N9 DG A 21 -3.551 1.495 -6.957 1.00 0.19 N ATOM 659 C8 DG A 21 -3.249 2.597 -6.224 1.00 0.27 C ATOM 660 N7 DG A 21 -2.969 2.428 -4.975 1.00 0.24 N ATOM 661 C5 DG A 21 -3.097 1.040 -4.840 1.00 0.14 C ATOM 662 C6 DG A 21 -2.919 0.216 -3.698 1.00 0.15 C ATOM 663 O6 DG A 21 -2.602 0.550 -2.558 1.00 0.18 O ATOM 664 N1 DG A 21 -3.148 -1.122 -3.994 1.00 0.20 N ATOM 665 C2 DG A 21 -3.503 -1.614 -5.233 1.00 0.23 C ATOM 666 N2 DG A 21 -3.679 -2.934 -5.312 1.00 0.35 N ATOM 667 N3 DG A 21 -3.671 -0.846 -6.314 1.00 0.17 N ATOM 668 C4 DG A 21 -3.454 0.463 -6.050 1.00 0.13 C ATOM 0 H5' DG A 21 -1.284 3.249 -10.902 1.00 0.10 H new ATOM 0 H5'' DG A 21 -2.608 4.254 -11.459 1.00 0.10 H new ATOM 0 H4' DG A 21 -3.279 1.940 -11.240 1.00 0.10 H new ATOM 0 H3' DG A 21 -4.594 4.145 -9.788 1.00 0.10 H new ATOM 0 H2' DG A 21 -5.261 2.981 -7.931 1.00 0.15 H new ATOM 0 H2'' DG A 21 -5.945 1.734 -8.954 1.00 0.15 H new ATOM 0 H1' DG A 21 -4.183 0.336 -8.550 1.00 0.15 H new ATOM 0 H8 DG A 21 -3.243 3.581 -6.670 1.00 0.27 H new ATOM 0 H1 DG A 21 -3.045 -1.795 -3.234 1.00 0.20 H new ATOM 0 H21 DG A 21 -3.942 -3.361 -6.200 1.00 0.35 H new ATOM 0 H22 DG A 21 -3.550 -3.516 -4.484 1.00 0.35 H new ATOM 680 P DG A 22 -7.105 3.125 -10.857 1.00 0.32 P ATOM 681 OP1 DG A 22 -7.718 3.318 -12.190 1.00 0.53 O ATOM 682 OP2 DG A 22 -7.278 4.158 -9.810 1.00 0.47 O ATOM 683 O5' DG A 22 -7.618 1.717 -10.265 1.00 0.18 O ATOM 684 C5' DG A 22 -7.694 0.560 -11.111 1.00 0.19 C ATOM 685 C4' DG A 22 -8.253 -0.658 -10.388 1.00 0.16 C ATOM 686 O4' DG A 22 -7.417 -1.027 -9.269 1.00 0.18 O ATOM 687 C3' DG A 22 -9.656 -0.393 -9.855 1.00 0.09 C ATOM 688 O3' DG A 22 -10.645 -1.038 -10.663 1.00 0.10 O ATOM 689 C2' DG A 22 -9.662 -0.943 -8.455 1.00 0.11 C ATOM 690 C1' DG A 22 -8.235 -1.334 -8.119 1.00 0.16 C ATOM 691 N9 DG A 22 -7.763 -0.609 -6.928 1.00 0.18 N ATOM 692 C8 DG A 22 -7.521 0.715 -6.759 1.00 0.23 C ATOM 693 N7 DG A 22 -7.103 1.104 -5.602 1.00 0.26 N ATOM 694 C5 DG A 22 -7.055 -0.103 -4.897 1.00 0.22 C ATOM 695 C6 DG A 22 -6.671 -0.356 -3.555 1.00 0.21 C ATOM 696 O6 DG A 22 -6.289 0.447 -2.705 1.00 0.23 O ATOM 697 N1 DG A 22 -6.768 -1.707 -3.245 1.00 0.19 N ATOM 698 C2 DG A 22 -7.182 -2.696 -4.111 1.00 0.17 C ATOM 699 N2 DG A 22 -7.213 -3.937 -3.616 1.00 0.18 N ATOM 700 N3 DG A 22 -7.544 -2.467 -5.377 1.00 0.14 N ATOM 701 C4 DG A 22 -7.458 -1.156 -5.703 1.00 0.18 C ATOM 0 H5' DG A 22 -6.700 0.327 -11.492 1.00 0.19 H new ATOM 0 H5'' DG A 22 -8.321 0.786 -11.973 1.00 0.19 H new ATOM 0 H4' DG A 22 -8.281 -1.466 -11.119 1.00 0.16 H new ATOM 0 H3' DG A 22 -9.898 0.670 -9.872 1.00 0.09 H new ATOM 0 H2' DG A 22 -10.032 -0.198 -7.751 1.00 0.11 H new ATOM 0 H2'' DG A 22 -10.324 -1.806 -8.384 1.00 0.11 H new ATOM 0 H1' DG A 22 -8.176 -2.398 -7.889 1.00 0.16 H new ATOM 0 H8 DG A 22 -7.673 1.418 -7.564 1.00 0.23 H new ATOM 0 H1 DG A 22 -6.512 -1.990 -2.299 1.00 0.19 H new ATOM 0 H21 DG A 22 -7.510 -4.714 -4.206 1.00 0.18 H new ATOM 0 H22 DG A 22 -6.939 -4.107 -2.648 1.00 0.18 H new ATOM 713 P DT A 23 -12.201 -0.646 -10.512 1.00 0.14 P ATOM 714 OP1 DT A 23 -12.960 -1.354 -11.567 1.00 0.11 O ATOM 715 OP2 DT A 23 -12.297 0.827 -10.396 1.00 0.20 O ATOM 716 O5' DT A 23 -12.592 -1.290 -9.090 1.00 0.18 O ATOM 717 C5' DT A 23 -12.883 -2.686 -8.982 1.00 0.16 C ATOM 718 C4' DT A 23 -13.361 -3.058 -7.580 1.00 0.18 C ATOM 719 O4' DT A 23 -12.346 -2.780 -6.593 1.00 0.29 O ATOM 720 C3' DT A 23 -14.609 -2.274 -7.192 1.00 0.23 C ATOM 721 O3' DT A 23 -15.777 -3.097 -7.271 1.00 0.21 O ATOM 722 C2' DT A 23 -14.367 -1.808 -5.782 1.00 0.27 C ATOM 723 C1' DT A 23 -12.958 -2.231 -5.406 1.00 0.23 C ATOM 724 N1 DT A 23 -12.176 -1.084 -4.890 1.00 0.20 N ATOM 725 C2 DT A 23 -11.692 -1.170 -3.597 1.00 0.20 C ATOM 726 O2 DT A 23 -11.895 -2.152 -2.887 1.00 0.21 O ATOM 727 N3 DT A 23 -10.963 -0.085 -3.147 1.00 0.27 N ATOM 728 C4 DT A 23 -10.682 1.063 -3.866 1.00 0.29 C ATOM 729 O4 DT A 23 -10.022 1.971 -3.366 1.00 0.32 O ATOM 730 C5 DT A 23 -11.228 1.066 -5.206 1.00 0.25 C ATOM 731 C7 DT A 23 -10.995 2.274 -6.108 1.00 0.23 C ATOM 732 C6 DT A 23 -11.942 0.019 -5.669 1.00 0.24 C ATOM 0 H5' DT A 23 -11.992 -3.263 -9.227 1.00 0.16 H new ATOM 0 H5'' DT A 23 -13.648 -2.955 -9.710 1.00 0.16 H new ATOM 0 H4' DT A 23 -13.583 -4.125 -7.603 1.00 0.18 H new ATOM 0 H3' DT A 23 -14.785 -1.436 -7.866 1.00 0.23 H new ATOM 0 H2' DT A 23 -14.476 -0.726 -5.710 1.00 0.27 H new ATOM 0 H2'' DT A 23 -15.096 -2.248 -5.101 1.00 0.27 H new ATOM 0 HO3' DT A 23 -16.565 -2.573 -7.016 1.00 0.21 H new ATOM 0 H1' DT A 23 -12.984 -2.974 -4.609 1.00 0.23 H new ATOM 0 H3 DT A 23 -10.598 -0.136 -2.196 1.00 0.27 H new ATOM 0 H71 DT A 23 -10.970 1.951 -7.149 1.00 0.23 H new ATOM 0 H72 DT A 23 -11.803 2.992 -5.970 1.00 0.23 H new ATOM 0 H73 DT A 23 -10.045 2.743 -5.850 1.00 0.23 H new ATOM 0 H6 DT A 23 -12.337 0.051 -6.674 1.00 0.24 H new TER 746 DT A 23